data_1jjr_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 1jjr _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 47' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.987 0.423 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.415 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 0.7 OUTLIER -71.82 -42.13 67.38 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.336 179.502 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.42 ' HG3' ' CE1' ' A' ' 76' ' ' TYR . 0.4 OUTLIER 163.11 -42.84 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.367 179.84 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.2 -58.7 6.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.311 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.449 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.4 tp10 -58.88 -39.1 80.4 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.447 HD13 ' CE1' ' A' ' 76' ' ' TYR . 22.1 mt -60.2 -52.94 63.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.222 178.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.501 ' HG2' ' CE2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.56 -48.21 69.35 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-O 121.033 0.444 . . . . 0.0 109.952 179.168 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.7 m -59.39 -45.6 91.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.954 179.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.461 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 15.3 m-70 -59.59 -49.07 79.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.258 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 58.7 mt -55.29 -40.56 57.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.946 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.4 t -53.26 -77.01 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.347 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -49.28 77.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.29 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 118.67 31.84 1.42 Allowed Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.743 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' THR . . . . . 0.47 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 2.9 m -98.25 -6.23 31.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.587 0.232 . . . . 0.0 111.099 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.461 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -59.86 -22.46 62.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.874 0.369 . . . . 0.0 110.337 179.352 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -90.77 22.44 28.17 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.846 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.47 ' HB2' ' O ' ' A' ' 60' ' ' THR . 0.2 OUTLIER -90.4 -54.87 3.82 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.107 0.48 . . . . 0.0 109.987 179.47 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -49.42 158.27 0.43 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.563 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 65.3 p -73.89 -168.0 0.55 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.624 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.505 ' HB ' ' HD3' ' A' ' 67' ' ' PRO . 47.4 t -77.35 -47.51 2.53 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.656 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.505 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 51.7 Cg_exo -52.15 -34.14 57.16 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.187 1.924 . . . . 0.0 111.88 179.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 46.5 mtm -80.01 -40.48 27.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.497 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.442 ' HB3' ' CB ' ' A' ' 87' ' ' LEU . 9.6 mt -60.32 -41.52 93.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.491 179.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.93 -34.91 57.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.684 179.142 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.09 -54.86 39.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.966 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -56.94 -43.56 81.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.672 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 13.7 m -60.27 -41.26 92.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.442 179.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.85 -35.95 79.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.544 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.99 -30.29 50.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.817 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.447 ' CE1' HD13 ' A' ' 52' ' ' LEU . 2.7 m-85 -84.26 -29.11 26.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.006 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.77 24.02 47.47 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.573 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.9 mt -81.2 -170.79 2.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.796 0.331 . . . . 0.0 110.846 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -96.86 -37.58 10.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.881 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 68.23 176.58 0.26 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.857 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -137.37 146.22 18.07 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.483 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.2 mp -80.75 65.63 5.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.83 0.348 . . . . 0.0 111.015 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 2.0 tptt -157.39 -73.38 0.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.029 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 83' ' ' LYS . 35.8 tttm 168.9 -83.77 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.582 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -47.55 -31.77 4.72 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.159 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -52.37 -36.86 54.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.696 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.442 ' CB ' ' HB3' ' A' ' 69' ' ' LEU . 1.2 mt -62.39 -47.37 84.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.764 179.166 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -51.2 -51.25 55.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.333 178.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.44 -53.2 39.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.816 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -52.91 -44.09 66.69 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.112 0.482 . . . . 0.0 110.117 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.0 mt -65.94 -57.3 8.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.696 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.1 m -49.76 -55.9 12.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.365 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.8 mmtm -48.61 -35.21 13.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.216 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.427 ' CD2' ' CD2' ' A' ' 76' ' ' TYR . 1.5 t-80 -79.17 -3.35 45.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.817 -179.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . 0.501 ' CE2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.5 27.66 0.9 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.663 0.268 . . . . 0.0 110.947 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.982 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 121.016 0.436 . . . . 0.0 110.696 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.51 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 85.3 p -71.52 -47.89 52.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.31 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.51 ' HB3' ' O ' ' A' ' 48' ' ' SER . 5.3 pt-20 167.39 -42.16 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.486 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -55.7 -56.1 24.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.251 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.458 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.3 OUTLIER -60.07 -40.73 90.55 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.395 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.471 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 23.7 mt -60.05 -50.98 71.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.208 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.557 ' HD2' ' CZ ' ' A' ' 95' ' ' PHE . 41.5 tttm -53.04 -48.88 67.28 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.1 m -55.19 -43.12 74.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.313 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.458 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 4.7 m-70 -60.79 -49.81 75.98 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.686 178.467 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 34.3 mt -55.89 -46.74 80.31 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.905 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 58.5 m -53.7 -74.37 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.272 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -61.79 -74.77 0.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.133 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 145.66 37.39 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.857 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 63.2 p -100.41 -9.48 22.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.688 0.28 . . . . 0.0 111.034 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.434 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 0.7 OUTLIER -58.67 -24.84 62.05 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.843 0.354 . . . . 0.0 110.38 179.611 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -88.01 16.19 52.54 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.581 179.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.6 mtmt -91.38 -57.91 2.62 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.089 0.471 . . . . 0.0 110.125 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -49.92 155.8 0.84 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.361 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 73.6 p -74.4 -169.53 0.84 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.708 179.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.486 ' HB ' ' HD3' ' A' ' 67' ' ' PRO . 53.7 t -78.01 -46.69 2.25 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.748 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.486 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 52.6 Cg_exo -51.97 -34.69 57.64 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.192 1.928 . . . . 0.0 111.84 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 17.0 mtm -80.27 -39.26 29.24 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.404 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.9 mt -60.82 -46.89 88.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.393 179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.08 -33.14 37.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.628 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.402 ' O ' ' CG ' ' A' ' 74' ' ' ARG . 2.2 tm-20 -56.82 -53.76 54.12 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.865 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.4 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -57.68 -33.74 68.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.031 0.443 . . . . 0.0 110.38 179.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 34.8 m -61.45 -47.48 85.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.02 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.407 ' HG3' ' N ' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -61.99 -28.45 69.57 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.921 -179.849 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.407 ' N ' ' HG3' ' A' ' 74' ' ' ARG . . . -80.14 -34.29 37.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.986 0.422 . . . . 0.0 110.724 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.471 ' CZ ' HD11 ' A' ' 52' ' ' LEU . 3.2 m-30 -84.8 -25.76 27.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.047 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.07 24.52 31.73 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.457 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.3 mt -81.13 -164.73 0.79 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.759 0.314 . . . . 0.0 110.821 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.64 24.4 2.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.006 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.83 -166.99 0.87 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.785 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 108.8 88.03 1.93 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.632 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 19.2 mt -158.86 -86.17 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.675 0.274 . . . . 0.0 110.667 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 3.1 mmtm -82.0 -66.01 0.94 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.841 0.353 . . . . 0.0 110.642 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.43 ' HB2' ' O ' ' A' ' 83' ' ' LYS . 0.8 OUTLIER 169.13 -65.63 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.019 179.931 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.68 -37.48 28.89 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.248 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.87 -40.12 69.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.067 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.9 mt -61.54 -47.16 86.84 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.4 mp -51.42 -53.02 41.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.227 178.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -51.12 -52.75 40.71 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.879 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -52.88 -43.24 66.0 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.103 0.478 . . . . 0.0 110.107 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.406 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.4 OUTLIER -66.82 -58.52 4.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.695 179.187 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.408 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.2 m -49.37 -55.59 12.43 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.263 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.8 mtpp -46.31 -34.21 4.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.043 179.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.459 ' HB3' ' CE2' ' A' ' 76' ' ' TYR . 33.1 t-80 -66.22 -55.42 16.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.143 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . 0.557 ' CZ ' ' HD2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -92.38 14.26 17.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.5 -179.629 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.408 ' N ' ' O ' ' A' ' 92' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.169 0 CA-C-O 120.729 0.3 . . . . 0.0 110.873 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.987 0.423 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.462 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 13.1 p -71.87 -46.92 56.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.518 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 48' ' ' SER . 1.2 tt0 168.16 -43.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.537 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.33 -58.55 6.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.374 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.417 ' O ' ' CD2' ' A' ' 55' ' ' HIS . 0.3 OUTLIER -59.06 -39.26 81.53 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.463 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.461 HD11 ' CE1' ' A' ' 76' ' ' TYR . 38.0 mt -60.33 -52.3 65.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.306 178.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.444 ' HE3' ' CD1' ' A' ' 95' ' ' PHE . 1.4 tmtp? -54.87 -47.34 74.37 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-O 121.107 0.479 . . . . 0.0 110.005 179.153 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.2 m -59.09 -44.04 91.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.9 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.417 ' CD2' ' O ' ' A' ' 51' ' ' GLU . 19.3 m-70 -58.68 -49.73 76.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.889 179.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.2 mt -57.63 -48.21 83.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.014 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.91 -65.74 0.51 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.645 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 46.2 mttt -60.69 -39.01 86.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.166 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 111.29 23.67 5.68 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.527 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 44.5 p -97.65 -13.63 21.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.587 0.232 . . . . 0.0 111.001 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.421 ' O ' ' CD2' ' A' ' 88' ' ' LEU . 3.1 tm? -59.09 -28.53 66.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.746 0.308 . . . . 0.0 110.463 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.4 ' O ' HD13 ' A' ' 88' ' ' LEU . . . -86.7 13.22 59.26 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.598 179.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.94 -45.68 6.84 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.815 0.341 . . . . 0.0 111.275 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -45.24 144.77 1.27 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.958 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.4 ' O ' ' CD1' ' A' ' 69' ' ' LEU . 26.7 p -74.13 -168.2 0.6 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.82 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.508 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 55.5 t -76.1 -56.84 1.54 Allowed Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.626 -179.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.508 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 7.9 Cg_endo -50.28 -34.9 41.96 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.357 2.038 . . . . 0.0 112.416 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 47.1 mtm -80.1 -33.91 38.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.489 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.456 ' CD1' HD21 ' A' ' 88' ' ' LEU . 4.8 mt -61.43 -41.55 97.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.924 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.75 -37.68 43.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.839 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.61 -57.79 10.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.985 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.61 -44.29 85.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.872 0.368 . . . . 0.0 110.546 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.2 m -60.27 -37.26 79.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.436 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.0 mtt180 -62.47 -36.89 83.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.647 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -78.82 -32.16 46.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.005 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.461 ' CE1' HD11 ' A' ' 52' ' ' LEU . 2.7 m-85 -83.79 -25.99 29.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.187 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.7 24.45 55.9 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.617 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.4 mt -81.11 175.6 10.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.822 0.344 . . . . 0.0 110.842 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.01 -53.8 3.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.833 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 86.8 p 45.29 -166.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.35 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.408 ' O ' ' HG ' ' A' ' 82' ' ' LEU . . . -148.22 -112.23 0.66 Allowed Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.475 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.419 ' CD1' ' N ' ' A' ' 82' ' ' LEU . 0.1 OUTLIER -153.31 13.09 0.49 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.594 0.235 . . . . 0.0 111.395 -179.942 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.403 ' O ' ' HB3' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -84.97 8.05 19.09 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.764 -0.198 . . . . 0.0 111.292 179.476 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.403 ' HB3' ' O ' ' A' ' 83' ' ' LYS . 32.4 tttt 71.39 -79.35 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.57 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.403 ' HA ' HD12 ' A' ' 88' ' ' LEU . 0.5 OUTLIER -47.3 -40.44 16.92 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.88 0.372 . . . . 0.0 111.093 179.592 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.22 -49.78 66.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.692 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.454 ' HB3' ' HB3' ' A' ' 69' ' ' LEU . 2.4 mt -61.22 -49.58 76.56 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 178.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.456 HD21 ' CD1' ' A' ' 69' ' ' LEU . 15.4 mt -52.67 -50.55 63.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.941 178.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -54.5 -52.4 62.08 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.593 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -51.33 -41.4 60.53 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.099 0.476 . . . . 0.0 110.114 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.1 mt -65.67 -61.54 2.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.295 179.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.7 m -50.17 -56.67 10.05 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.086 179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.4 mtpt -48.36 -33.41 8.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.095 179.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -71.6 -15.47 62.26 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.684 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . 0.444 ' CD1' ' HE3' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.19 34.84 0.89 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.839 0.352 . . . . 0.0 110.908 -179.867 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.88 -179.979 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 121.015 0.435 . . . . 0.0 110.482 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.519 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 85.3 p -73.67 -55.32 6.41 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.616 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.519 ' HB3' ' O ' ' A' ' 48' ' ' SER . 1.0 OUTLIER 168.66 -37.22 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.149 179.831 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -57.09 -54.79 42.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.765 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.46 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.0 OUTLIER -61.09 -42.92 99.4 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.022 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.459 ' CD1' ' CE1' ' A' ' 76' ' ' TYR . 33.1 mt -58.72 -50.99 71.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.077 178.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.476 ' CE ' ' CD1' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -52.42 -48.92 65.45 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.858 179.055 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.9 m -57.51 -42.34 82.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.643 178.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.46 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 4.7 m-70 -60.09 -48.9 79.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.859 178.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 74.7 mt -56.41 -47.95 80.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.859 179.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.48 -72.75 0.06 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.51 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 4.1 mttt -61.53 -74.34 0.08 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.297 -179.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 145.53 35.24 0.07 OUTLIER Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.949 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' THR . . . . . 0.428 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 0.7 OUTLIER -99.82 -9.62 22.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.644 0.259 . . . . 0.0 110.85 179.603 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.445 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -59.32 -21.48 59.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.902 0.382 . . . . 0.0 110.379 179.544 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -90.66 15.12 61.16 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.934 -0.651 . . . . 0.0 112.535 179.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.428 ' HB2' ' O ' ' A' ' 60' ' ' THR . 0.1 OUTLIER -90.92 -55.95 3.36 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.025 0.44 . . . . 0.0 109.977 179.633 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -49.82 151.79 1.71 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.236 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 17.8 p -73.87 -165.49 0.3 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.767 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.503 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 41.7 t -76.59 -57.55 1.26 Allowed Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.205 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 9.1 Cg_endo -50.95 -28.97 25.63 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.272 1.981 . . . . 0.0 112.101 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.4 mtp -79.98 -39.33 30.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.151 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.463 ' HB3' ' HB3' ' A' ' 87' ' ' LEU . 7.0 mt -61.16 -43.03 99.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.52 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.41 ' N ' HD23 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -51.94 -33.4 37.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.854 179.578 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -56.02 -52.52 63.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.053 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.67 -53.01 63.04 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.687 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.97 -33.61 72.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.358 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -37.72 87.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.08 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.77 -26.83 31.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.715 179.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CD2' ' CD2' ' A' ' 94' ' ' HIS . 3.0 m-85 -82.97 -30.92 27.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.817 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.97 14.6 59.05 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.809 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.4 mt -82.04 167.19 19.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.934 0.397 . . . . 0.0 111.103 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.29 75.58 1.82 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.662 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.475 ' OG ' ' HA ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -75.85 -169.07 1.0 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.103 -179.697 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -140.91 -120.37 1.67 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.47 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.7 pp -155.4 11.23 0.32 Allowed 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.8 tptp -85.52 7.05 24.38 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.614 0.245 . . . . 0.0 111.095 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.4 ttmm 69.43 -76.82 0.06 Allowed 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.53 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -50.56 -36.36 34.21 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.876 0.37 . . . . 0.0 111.161 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -62.08 -38.28 88.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.062 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.475 ' HA ' ' OG ' ' A' ' 80' ' ' SER . 1.2 mt -61.38 -42.44 98.72 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.2 mp -52.04 -54.48 29.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.34 178.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -50.37 -52.54 36.36 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.828 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -51.4 -44.09 62.13 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.199 0.523 . . . . 0.0 109.814 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.66 -61.09 2.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.653 179.016 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.0 m -48.88 -52.14 25.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.365 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 15.6 tptp -48.46 -34.64 11.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.168 179.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.501 ' CD2' ' CD2' ' A' ' 76' ' ' TYR . 24.7 t60 -78.53 -5.55 52.98 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.923 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . 0.476 ' CD1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.65 27.96 0.98 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.799 0.333 . . . . 0.0 110.975 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.884 179.92 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 . . . . . 0 CA--C 1.522 -0.11 0 CA-C-O 120.971 0.415 . . . . 0.0 110.754 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.511 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 83.0 p -72.47 -52.99 13.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.342 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.511 ' HB3' ' O ' ' A' ' 48' ' ' SER . 2.5 pt-20 164.83 -39.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.001 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -56.13 -58.26 8.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.471 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.419 ' HG3' ' CE1' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -58.92 -37.5 76.81 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 179.61 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.43 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 36.2 mt -60.95 -53.6 55.31 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.22 178.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.572 ' HD2' ' CZ ' ' A' ' 95' ' ' PHE . 20.8 tttm -54.7 -47.02 74.21 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-O 121.03 0.443 . . . . 0.0 110.096 178.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.9 m -56.97 -44.81 83.01 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.489 178.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.433 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 12.0 m-70 -60.42 -51.49 69.26 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.824 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 11.6 mt -56.96 -42.42 78.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.024 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.78 -76.11 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.643 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.9 pttt -60.97 -51.51 68.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.371 -179.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 123.98 52.18 0.2 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.564 -0.826 . . . . 0.0 112.805 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.18 -4.13 7.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.506 0.193 . . . . 0.0 111.097 179.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.433 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 60.7 tp -60.05 -20.89 60.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.843 0.354 . . . . 0.0 110.559 179.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -93.05 22.8 32.47 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.25 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.37 -57.59 2.73 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.018 0.437 . . . . 0.0 110.073 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -49.84 157.26 0.61 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.25 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 30.6 p -73.86 -169.4 0.73 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.037 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.516 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 75.2 t -76.77 -56.22 1.4 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.315 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 9.9 Cg_endo -52.31 -29.61 39.26 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.147 1.898 . . . . 0.0 112.027 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.71 -41.51 26.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.2 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.512 ' HB3' ' CB ' ' A' ' 87' ' ' LEU . 24.6 mt -61.4 -34.68 75.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.52 179.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.406 ' N ' HD22 ' A' ' 87' ' ' LEU . 12.4 mmtt -53.16 -38.21 62.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.097 179.636 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -54.98 -49.66 70.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.964 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.31 -48.81 77.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.733 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.76 -40.04 86.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.418 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -37.03 81.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.478 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.01 -30.39 44.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.734 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.43 ' CZ ' HD11 ' A' ' 52' ' ' LEU . 2.7 m-85 -85.48 5.38 31.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.417 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.82 16.18 58.92 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.704 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -81.1 178.74 8.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.873 0.368 . . . . 0.0 110.868 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.17 -31.85 12.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.698 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.9 p 65.63 169.3 0.21 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.977 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -151.06 150.91 22.95 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.56 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.57 66.95 6.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.921 0.391 . . . . 0.0 110.864 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -155.88 8.33 0.24 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.938 -179.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.409 ' HA ' ' CD1' ' A' ' 87' ' ' LEU . 0.0 OUTLIER 65.99 -76.48 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.725 0.298 . . . . 0.0 111.031 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -47.83 -34.01 8.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.332 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 37.8 tp10 -59.72 -42.54 93.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.925 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.512 ' CB ' ' HB3' ' A' ' 69' ' ' LEU . 1.5 mp -61.11 -43.91 98.15 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.2 mp -51.51 -53.71 34.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.269 178.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -50.47 -53.25 31.21 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.97 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -52.19 -43.99 64.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.062 0.458 . . . . 0.0 110.128 179.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.36 -58.54 5.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.424 179.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.9 m -50.23 -57.27 8.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.419 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.51 -31.87 11.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.279 179.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -85.43 0.49 52.09 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . 0.572 ' CZ ' ' HD2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -147.64 19.75 1.17 Allowed 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.036 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 . . . . . 0 C--N 1.333 -0.141 0 CA-C-O 120.799 0.333 . . . . 0.0 110.92 179.988 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 . . . . . 0 N--CA 1.461 0.084 0 CA-C-O 121.022 0.439 . . . . 0.0 110.967 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.508 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 2.7 p -73.34 -53.31 11.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.383 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.508 ' HB3' ' O ' ' A' ' 48' ' ' SER . 8.1 pt-20 168.24 -39.46 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.214 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -56.29 -55.61 31.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.036 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.476 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -59.97 -43.02 95.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.343 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.425 ' HA ' ' CD2' ' A' ' 55' ' ' HIS . 15.4 mt -58.9 -50.68 73.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.055 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.486 ' CG ' ' CZ ' ' A' ' 95' ' ' PHE . 0.5 OUTLIER -52.61 -49.05 65.84 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.878 178.976 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.9 m -58.05 -43.45 86.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.727 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.476 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 6.2 m-70 -59.73 -49.33 78.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.84 178.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 16.4 mt -56.22 -47.73 80.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.988 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.54 -75.7 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.344 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -61.74 -72.28 0.13 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.148 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 143.33 39.47 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.582 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -99.52 -9.95 22.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.704 0.288 . . . . 0.0 111.068 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.467 ' N ' ' HB3' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -59.7 -21.46 60.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.862 0.363 . . . . 0.0 110.648 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.4 ' N ' HD21 ' A' ' 88' ' ' LEU . . . -94.84 17.11 59.88 Favored Glycine 0 C--N 1.333 0.363 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.514 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.87 -57.44 2.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.992 0.425 . . . . 0.0 110.272 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -48.62 161.95 0.11 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.181 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 52.8 p -73.25 -174.63 1.65 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.816 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.519 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 82.7 t -75.86 -56.3 1.74 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.227 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 7.4 Cg_endo -50.08 -28.32 19.06 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.201 1.934 . . . . 0.0 111.89 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.47 -42.35 25.48 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.026 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.461 ' CD1' HD12 ' A' ' 87' ' ' LEU . 11.9 mt -60.87 -42.65 98.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.061 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.5 mmtp -54.06 -33.71 58.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.29 178.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -55.42 31.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.919 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.11 -44.57 83.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.02 0.438 . . . . 0.0 110.378 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 86.3 m -60.89 -43.26 98.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.426 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -35.74 78.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.469 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.67 -31.51 59.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.609 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -84.22 -23.45 30.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.972 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 92.47 15.4 53.3 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.57 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.5 mt -81.21 172.98 12.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.753 0.311 . . . . 0.0 110.856 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.68 -50.07 4.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.654 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 59.0 p 45.44 -166.15 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.593 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.58 164.88 17.91 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.368 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.1 mt 76.51 118.62 0.05 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.071 0.462 . . . . 0.0 111.031 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.428 ' O ' ' HB3' ' A' ' 84' ' ' LYS . 0.3 OUTLIER 62.53 -79.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.635 179.627 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.428 ' HB3' ' O ' ' A' ' 83' ' ' LYS . 3.9 ptpt 163.68 -46.71 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.945 0.403 . . . . 0.0 110.14 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -47.24 -39.78 15.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.904 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -48.81 -36.42 16.72 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.56 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.461 HD12 ' CD1' ' A' ' 69' ' ' LEU . 9.6 mt -62.43 -51.66 66.65 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 178.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.4 HD21 ' N ' ' A' ' 62' ' ' GLY . 4.0 mp -52.35 -54.29 33.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.844 178.225 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -51.5 -49.31 62.12 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.663 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -52.41 -45.24 65.82 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.161 0.505 . . . . 0.0 109.884 179.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.61 -60.38 2.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.554 179.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.4 m -50.24 -52.96 31.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.368 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -48.88 -32.01 8.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.869 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -93.09 13.84 19.7 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.531 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . 0.486 ' CZ ' ' CG ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -145.44 -6.09 0.64 Allowed 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.914 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.821 0.343 . . . . 0.0 110.893 179.911 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 . . . . . 0 N--CA 1.462 0.127 0 CA-C-O 121.056 0.455 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.47 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 79.8 p -72.73 -44.24 61.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.703 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 48' ' ' SER . 26.7 tt0 165.22 -45.89 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.223 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.1 -56.55 16.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.22 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.468 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.1 OUTLIER -59.1 -40.28 84.81 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 179.29 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 28.0 mt -59.04 -53.66 55.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.285 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.46 ' HD2' ' CE1' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.77 -47.28 70.87 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 121.065 0.459 . . . . 0.0 109.942 179.131 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.1 m -58.2 -42.17 85.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.697 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.468 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 12.8 m-70 -60.53 -47.76 84.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.181 179.033 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -55.51 -44.48 76.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.977 179.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 m -52.93 -73.13 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.307 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.2 mttm -62.13 -52.9 61.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.997 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 117.71 32.63 1.41 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.503 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.31 -3.14 34.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.613 0.244 . . . . 0.0 111.297 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.433 ' CB ' ' HB3' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -60.21 -23.0 63.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.723 0.297 . . . . 0.0 110.871 179.883 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -96.62 20.72 49.33 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.818 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.69 -56.64 2.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.949 0.404 . . . . 0.0 110.325 179.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -48.43 154.17 0.66 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.345 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 72.1 p -73.09 -163.05 0.13 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.623 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.518 ' HB ' ' HD3' ' A' ' 67' ' ' PRO . 11.9 t -77.41 -51.69 1.89 Allowed Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.518 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.518 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 78.5 Cg_exo -46.43 -33.15 12.2 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.271 1.98 . . . . 0.0 111.966 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 9.4 mmm -80.18 -51.18 9.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.552 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.44 ' HB3' ' CB ' ' A' ' 87' ' ' LEU . 55.8 mt -60.43 -39.31 87.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.574 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.14 -41.94 62.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.75 179.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.81 -55.15 29.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.22 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.32 -47.95 80.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.961 0.41 . . . . 0.0 110.499 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.426 ' O ' ' N ' ' A' ' 77' ' ' GLY . 31.9 m -61.41 -40.11 93.21 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.648 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.53 -35.55 80.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.944 0.402 . . . . 0.0 110.524 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.43 -43.27 70.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.854 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CE1' ' CE1' ' A' ' 94' ' ' HIS . 8.8 m-85 -84.87 -16.52 40.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.43 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.426 ' N ' ' O ' ' A' ' 73' ' ' CYS . . . 59.39 46.27 94.17 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.571 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.5 mt -84.65 14.34 4.76 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? 61.91 8.12 2.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.315 -0.402 . . . . 0.0 112.006 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.89 -168.74 1.9 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.853 0.359 . . . . 0.0 110.906 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 93.6 88.5 1.62 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.629 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -159.76 -80.19 0.05 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.79 0.329 . . . . 0.0 110.932 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.54 -69.21 0.61 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.822 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 9.4 ttmm 173.97 -81.25 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.461 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 5.0 tt0 -47.8 -29.8 3.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.177 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.73 -36.33 62.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.784 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.44 ' CB ' ' HB3' ' A' ' 69' ' ' LEU . 2.3 mt -62.29 -44.94 95.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.276 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.401 ' HB2' ' O ' ' A' ' 85' ' ' GLN . 42.4 mt -50.87 -52.89 37.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.4 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -49.73 -52.13 33.71 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.861 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -53.67 -48.28 69.61 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.941 0.4 . . . . 0.0 110.663 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.3 mt -66.86 -49.2 66.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.62 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.41 ' CG2' ' N ' ' A' ' 93' ' ' LYS . 0.6 OUTLIER -52.15 -58.71 5.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.604 179.822 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.41 ' N ' ' CG2' ' A' ' 92' ' ' THR . 3.6 ptmt -47.85 -30.48 4.11 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.261 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.5 ' CE1' ' CE1' ' A' ' 76' ' ' TYR . 37.9 t-80 -73.32 -21.54 60.54 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.411 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . 0.46 ' CE1' ' HD2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.46 43.21 1.1 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.944 0.402 . . . . 0.0 111.054 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.819 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 . . . . . 0 C--O 1.232 0.138 0 CA-C-O 121.01 0.433 . . . . 0.0 110.95 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.515 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 88.0 p -73.07 -47.78 41.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.268 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.515 ' HB3' ' O ' ' A' ' 48' ' ' SER . 6.4 pt-20 166.18 -41.72 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.898 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.17 -54.78 41.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.979 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.496 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.5 OUTLIER -59.58 -43.11 93.73 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.281 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.423 ' HA ' ' CD2' ' A' ' 55' ' ' HIS . 16.5 mt -59.04 -51.61 69.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.194 178.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.588 ' O ' HG21 ' A' ' 56' ' ' ILE . 1.3 mmtt -54.2 -45.15 72.12 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-O 121.273 0.559 . . . . 0.0 110.224 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.11 -41.45 96.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.496 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 7.7 m-70 -60.75 -50.63 72.68 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.402 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.588 HG21 ' O ' ' A' ' 53' ' ' LYS . 8.7 tt -58.21 -42.35 83.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 121.064 0.459 . . . . 0.0 110.67 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.515 ' N ' HG23 ' A' ' 56' ' ' ILE . 29.7 t -54.29 -76.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.172 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 9.8 mttt -62.43 -68.86 0.29 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.023 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 141.08 39.61 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.729 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 60.7 p -101.18 -10.45 20.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.676 0.274 . . . . 0.0 111.165 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.458 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -59.09 -23.86 62.44 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.811 0.338 . . . . 0.0 110.586 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -90.58 11.99 69.86 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.414 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.1 mmtp -92.17 -54.4 3.84 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.931 0.396 . . . . 0.0 110.473 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -47.95 152.15 0.82 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.274 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 24.0 p -73.56 -166.66 0.37 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.852 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.494 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 53.2 t -76.96 -57.83 1.11 Allowed Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.437 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 5.7 Cg_endo -48.34 -29.97 14.31 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.275 1.983 . . . . 0.0 112.105 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.2 mtp -80.27 -41.45 24.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.26 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.437 ' HB3' ' CB ' ' A' ' 87' ' ' LEU . 11.9 mt -61.15 -49.86 75.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.555 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.0 mttt -51.32 -31.34 21.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.542 179.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -56.58 -53.57 56.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.796 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.83 -46.38 84.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.543 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 42.0 m -60.22 -40.67 90.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.561 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.9 ttt-85 -61.23 -36.52 80.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.51 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.3 -36.35 61.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.692 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CD2' ' CD2' ' A' ' 94' ' ' HIS . 2.9 m-30 -85.49 5.97 28.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.481 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.93 33.59 64.0 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.546 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -80.66 -170.18 2.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.798 0.332 . . . . 0.0 110.884 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.6 35.68 1.63 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.859 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.21 -162.5 0.29 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.736 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 100.95 104.98 2.75 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.487 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -160.26 -39.16 0.05 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.872 0.368 . . . . 0.0 110.97 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -157.74 -52.96 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.768 -179.924 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 83' ' ' LYS . 3.1 ttpt 175.24 -76.67 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.472 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -47.83 -29.95 3.63 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.297 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -57.54 -38.67 75.11 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.811 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.437 ' CB ' ' HB3' ' A' ' 69' ' ' LEU . 8.1 mt -62.11 -45.88 91.54 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.2 mp -50.62 -51.04 52.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.233 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -51.31 -55.14 19.93 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.831 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -51.71 -42.24 62.09 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.136 0.493 . . . . 0.0 110.014 179.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -65.96 -59.56 3.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.646 179.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.3 m -48.41 -55.07 11.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.408 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.69 -35.97 15.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.163 179.28 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.501 ' CD2' ' CD2' ' A' ' 76' ' ' TYR . 3.2 t60 -84.9 5.68 27.98 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.591 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . 0.473 ' CE1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.47 17.29 1.17 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.562 0.22 . . . . 0.0 111.164 179.934 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.333 -0.135 0 CA-C-O 120.8 0.333 . . . . 0.0 110.864 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 . . . . . 0 C--O 1.231 0.131 0 CA-C-O 121.11 0.481 . . . . 0.0 110.517 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 65.8 p -73.22 -45.83 53.86 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.012 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.419 ' O ' ' HD2' ' A' ' 53' ' ' LYS . 1.2 pt-20 166.06 -46.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.425 -179.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.93 -58.8 5.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.398 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.431 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 3.3 mm-40 -58.8 -39.53 81.4 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 50.6 mt -59.3 -53.58 56.63 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.315 178.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.722 ' HE2' ' CG ' ' A' ' 95' ' ' PHE . 0.1 OUTLIER -55.11 -46.11 75.55 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.438 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.9 m -58.53 -44.83 89.69 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.431 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 13.5 m-70 -61.65 -53.57 54.36 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.056 -0.975 . . . . 0.0 109.738 178.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 14.4 mt -57.26 -41.38 78.03 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.74 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.7 t -55.08 -74.9 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.237 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.3 mtpp -62.75 -69.39 0.26 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.007 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 145.52 37.69 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.698 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 73.9 p -100.79 -10.32 20.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.643 0.259 . . . . 0.0 111.036 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.415 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 22.8 tp -58.27 -22.45 52.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.847 0.356 . . . . 0.0 110.646 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -94.09 15.51 63.01 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.609 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.07 -56.24 3.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.95 0.405 . . . . 0.0 110.51 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -48.68 154.79 0.63 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.383 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 82.6 p -73.33 -170.51 0.8 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.584 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.503 ' HB ' ' HD3' ' A' ' 67' ' ' PRO . 65.9 t -77.89 -46.9 2.3 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.838 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.503 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 60.1 Cg_exo -50.83 -35.26 48.12 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.17 1.914 . . . . 0.0 111.972 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 34.8 mtm -79.99 -40.33 28.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.474 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.404 ' HB3' ' CB ' ' A' ' 87' ' ' LEU . 7.7 mt -60.42 -44.82 95.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.496 179.523 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.75 -34.08 37.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.666 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -57.02 -54.54 45.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.899 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -56.79 -50.12 73.29 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.993 0.425 . . . . 0.0 110.496 179.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 8.2 m -60.89 -40.01 91.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.509 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.32 -35.94 80.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.735 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.8 -29.86 40.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.901 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.498 ' CE2' ' CD2' ' A' ' 94' ' ' HIS . 3.2 m-85 -84.63 -26.95 27.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.04 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.89 25.03 23.67 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.661 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -81.21 -175.66 5.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.828 0.346 . . . . 0.0 110.905 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.02 -24.69 15.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.01 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 50.04 -176.62 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.916 0.389 . . . . 0.0 111.266 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -165.97 161.31 34.9 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.523 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 mp -80.38 -4.46 53.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.585 0.231 . . . . 0.0 111.411 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.1 2.24 28.2 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.673 -0.239 . . . . 0.0 111.57 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.9 ttmm 66.85 -73.98 0.07 Allowed 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.663 0.268 . . . . 0.0 110.962 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -47.74 -30.52 3.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.149 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -60.24 -35.57 75.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.792 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.404 ' CB ' ' HB3' ' A' ' 69' ' ' LEU . 1.5 mt -61.78 -42.32 98.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.048 0.452 . . . . 0.0 109.812 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.408 ' N ' ' CD1' ' A' ' 88' ' ' LEU . 3.9 mp -51.83 -55.63 18.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.333 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -50.55 -51.2 50.12 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.888 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -52.68 -45.1 66.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.018 0.437 . . . . 0.0 110.165 179.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.37 -57.86 5.84 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.598 179.16 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.401 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.3 m -50.44 -55.11 17.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.226 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.4 mtpt -48.05 -30.39 4.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.098 179.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.498 ' CD2' ' CE2' ' A' ' 76' ' ' TYR . 7.2 t60 -77.23 -15.9 59.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.983 -179.252 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . 0.722 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -147.19 33.11 0.89 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.782 0.325 . . . . 0.0 111.326 -179.819 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.401 ' N ' ' O ' ' A' ' 92' ' ' THR . 1.8 tp60 . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.861 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.993 0.425 . . . . 0.0 110.729 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.488 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 0.8 OUTLIER -72.51 -54.57 8.87 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.424 179.898 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.488 ' HB3' ' O ' ' A' ' 48' ' ' SER . 1.2 pt-20 168.11 -35.04 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.129 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.97 -59.43 5.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 179.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -59.83 -38.3 81.66 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.444 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 79.5 mt -61.3 -51.3 69.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.124 178.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.489 ' HE3' ' CD1' ' A' ' 95' ' ' PHE . 16.4 tttt -55.1 -47.84 74.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.988 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 91.6 m -57.83 -42.45 84.35 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.849 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.425 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 16.7 m-70 -59.64 -48.38 81.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.814 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.6 mt -57.5 -48.96 81.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.981 179.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.0 p -53.43 -62.84 1.39 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.714 -179.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.1 mttm -60.7 -34.65 74.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.257 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 108.64 19.98 8.4 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.557 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 61.8 p -97.95 -18.21 18.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.472 0.177 . . . . 0.0 110.888 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.425 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 2.6 tm? -57.28 -36.76 71.43 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.417 ' HA2' ' HB3' ' A' ' 88' ' ' LEU . . . -90.06 51.78 3.49 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.057 178.405 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -139.56 -46.11 0.45 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.888 0.375 . . . . 0.0 110.835 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -47.07 152.85 0.5 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.53 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 30.7 p -74.12 -169.56 0.8 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.992 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.502 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 63.3 t -76.12 -57.34 1.44 Allowed Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.469 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.502 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 4.4 Cg_endo -47.34 -34.23 18.36 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.47 2.113 . . . . 0.0 112.284 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 40.8 mtm -80.2 -38.13 31.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.335 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.466 ' HB3' ' HB3' ' A' ' 87' ' ' LEU . 5.2 mt -61.31 -39.93 92.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.846 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.42 -45.75 55.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.227 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -55.52 -52.2 64.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.027 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.38 -44.2 84.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.883 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.93 -41.31 91.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.512 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.6 ttt85 -61.78 -36.12 80.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.623 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.72 -30.54 51.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.789 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.444 ' CZ ' HD11 ' A' ' 52' ' ' LEU . 3.2 m-30 -84.45 -22.26 30.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.017 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.44 12.35 61.34 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.65 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.8 mt -81.11 -176.05 5.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.759 0.314 . . . . 0.0 110.873 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.9 38.44 1.46 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.866 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.46 -173.11 2.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.839 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 126.64 162.1 11.11 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.736 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 5.1 mt 68.02 26.71 7.25 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.693 0.283 . . . . 0.0 111.413 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.49 -6.08 0.08 Allowed 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.404 ' CG ' ' CG2' ' A' ' 66' ' ' VAL . 66.5 mttm 61.75 -85.25 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.598 0.237 . . . . 0.0 110.716 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.08 -43.39 30.64 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.941 0.4 . . . . 0.0 110.957 179.722 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -47.92 -46.54 32.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.793 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.466 ' HB3' ' HB3' ' A' ' 69' ' ' LEU . 1.8 mt -61.68 -50.15 73.63 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.463 HD23 ' CD1' ' A' ' 69' ' ' LEU . 19.7 mt -51.83 -52.82 46.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.047 178.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.36 -50.86 64.16 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.656 179.256 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.41 ' HA ' ' HG2' ' A' ' 93' ' ' LYS . . . -52.35 -42.9 64.3 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.624 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.1 -56.68 11.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.472 179.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.2 m -49.3 -60.4 2.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.494 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.41 ' HG2' ' HA ' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -48.72 -29.59 4.64 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.097 179.306 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.425 ' HB3' ' CE2' ' A' ' 76' ' ' TYR . 1.8 t60 -69.31 -19.24 63.89 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.557 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . 0.489 ' CD1' ' HE3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -146.3 37.9 1.04 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.905 0.383 . . . . 0.0 110.896 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.799 179.811 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.867 0.365 . . . . 0.0 111.461 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.498 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 83.3 p -73.99 -55.3 6.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.326 179.401 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.498 ' HB3' ' O ' ' A' ' 48' ' ' SER . 2.9 pt-20 167.49 -36.23 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.084 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -57.13 -56.48 21.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.98 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.411 ' O ' ' CD2' ' A' ' 55' ' ' HIS . 0.1 OUTLIER -60.67 -41.03 94.24 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.269 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.453 ' CD1' ' CE1' ' A' ' 76' ' ' TYR . 39.9 mt -60.12 -50.64 72.91 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.081 178.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.459 ' CE ' ' CD1' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.74 -48.83 69.27 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.126 179.053 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.0 m -59.37 -43.11 92.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.054 179.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.411 ' CD2' ' O ' ' A' ' 51' ' ' GLU . 24.8 m-70 -59.57 -48.7 80.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.969 179.189 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 16.3 mt -56.63 -48.08 81.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.903 179.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.67 -63.29 1.2 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.42 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.5 mtmt -61.04 -45.91 92.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.235 -179.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 118.36 20.48 4.32 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.702 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 40.6 p -97.57 -10.07 25.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.568 0.223 . . . . 0.0 111.059 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -58.52 -24.21 60.01 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.795 0.331 . . . . 0.0 110.176 179.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.401 ' O ' HD12 ' A' ' 88' ' ' LEU . . . -87.38 16.58 48.22 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.94 -0.647 . . . . 0.0 112.281 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.34 -46.1 6.86 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.874 0.369 . . . . 0.0 111.2 -179.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -45.45 143.87 1.69 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.27 -179.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.8 p -74.87 -172.38 1.58 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.748 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.506 ' N ' ' CD ' ' A' ' 67' ' ' PRO . 85.4 t -75.85 -44.46 3.96 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.206 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.506 ' CD ' ' N ' ' A' ' 66' ' ' VAL . 36.3 Cg_exo -60.86 -38.46 69.82 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.264 1.976 . . . . 0.0 112.15 179.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -80.03 -31.41 39.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.799 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.537 ' HB3' ' HB3' ' A' ' 87' ' ' LEU . 5.7 mt -60.97 -43.83 98.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.003 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.7 -39.46 51.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.099 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -56.13 -52.66 63.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.144 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.09 -49.42 75.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.861 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.79 -36.13 76.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.518 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -37.69 86.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.545 179.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -80.9 -30.03 35.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.894 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.453 ' CE1' ' CD1' ' A' ' 52' ' ' LEU . 2.7 m-85 -83.63 -22.25 32.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.023 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.19 21.02 53.78 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.523 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -81.49 169.94 16.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.839 0.352 . . . . 0.0 111.014 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.13 -38.06 9.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.613 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 46.21 -166.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.425 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -152.38 -118.47 0.76 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.743 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -159.3 72.79 0.56 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.935 0.398 . . . . 0.0 110.801 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -156.03 11.43 0.29 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.695 -179.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.408 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 54.4 tttt 67.43 -83.87 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.797 -179.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.403 ' HA ' HD11 ' A' ' 88' ' ' LEU . 16.1 tt0 -45.34 -40.89 8.3 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.786 0.327 . . . . 0.0 111.108 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.441 ' HA ' ' HG2' ' A' ' 89' ' ' GLU . 1.7 tp10 -57.83 -46.71 84.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.652 179.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.537 ' HB3' ' HB3' ' A' ' 69' ' ' LEU . 0.8 OUTLIER -62.87 -46.64 86.93 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 178.571 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.454 HD23 ' CD1' ' A' ' 69' ' ' LEU . 24.9 mt -53.51 -56.63 15.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.519 179.05 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.441 ' HG2' ' HA ' ' A' ' 86' ' ' GLU . 11.1 pt-20 -55.89 -44.42 78.18 Favored 'General case' 0 CA--C 1.523 -0.08 0 CA-C-O 120.831 0.348 . . . . 0.0 110.375 179.274 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -52.3 -42.08 63.47 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 121.037 0.446 . . . . 0.0 110.237 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.6 mt -64.86 -62.98 1.24 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.655 179.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 49.7 m -47.47 -53.43 14.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.483 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.76 -36.55 16.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.976 178.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 33.4 t60 -73.26 -8.28 55.15 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.738 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . 0.459 ' CD1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.36 33.47 0.88 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.818 0.342 . . . . 0.0 110.803 -179.912 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.886 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.44 ' CD1' HD22 ' A' ' 52' ' ' LEU . 11.9 m-85 . . . . . 0 C--O 1.231 0.094 0 CA-C-O 121.015 0.436 . . . . 0.0 110.465 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.476 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 58.5 p -73.44 -53.78 9.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.615 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.476 ' HB3' ' O ' ' A' ' 48' ' ' SER . 2.5 pt-20 167.54 -39.07 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.123 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.01 -57.6 11.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.241 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.454 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.5 tp10 -59.15 -40.51 85.79 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 179.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.44 HD22 ' CD1' ' A' ' 47' ' ' TYR . 30.7 mt -59.7 -51.78 68.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.236 178.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.547 ' HD2' ' CZ ' ' A' ' 95' ' ' PHE . 37.8 tttm -53.56 -48.26 69.29 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.1 0.476 . . . . 0.0 109.835 178.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 78.4 m -56.55 -42.12 78.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.556 178.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.454 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 7.4 m-70 -60.49 -49.65 76.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.573 178.588 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.6 mt -57.45 -49.31 80.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.159 179.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.49 -70.8 0.08 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.544 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 74.6 mttt -61.01 -77.12 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.135 -179.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 151.94 35.72 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.777 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.9 p -100.89 -13.65 18.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.715 0.293 . . . . 0.0 110.93 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.427 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 14.8 tp -58.71 -26.82 64.28 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.92 0.391 . . . . 0.0 110.47 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -87.21 5.32 85.33 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.512 179.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -91.03 -54.46 3.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.983 0.42 . . . . 0.0 110.185 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -48.82 148.91 1.98 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.188 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.8 p -73.35 -166.02 0.3 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.96 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.505 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 52.4 t -75.5 -57.34 1.64 Allowed Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.056 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.505 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 4.4 Cg_endo -47.37 -27.87 7.63 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.247 1.965 . . . . 0.0 111.869 179.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -79.24 -50.16 11.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.842 179.076 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.452 ' HB3' ' HB3' ' A' ' 87' ' ' LEU . 14.4 mt -61.5 -39.04 89.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.163 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -52.25 -44.47 64.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.989 179.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -53.76 -52.11 61.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.946 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.99 -43.09 86.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.643 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -40.26 88.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.641 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.12 -35.58 79.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.795 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.08 -32.63 44.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.202 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -84.92 -28.85 25.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.2 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.83 33.81 50.04 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.53 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.39 178.16 8.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.833 0.349 . . . . 0.0 111.286 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -102.34 76.74 1.59 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.004 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 24.1 t -161.35 -163.06 0.95 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.749 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.491 ' HA2' HD22 ' A' ' 87' ' ' LEU . . . 134.8 -32.1 2.64 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.729 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mt -80.6 -73.18 0.38 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.973 0.416 . . . . 0.0 111.284 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.2 mtmm -80.45 110.16 15.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.575 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 87' ' ' LEU . 10.0 ptmm? -47.06 -52.92 13.85 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.907 179.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -49.12 -37.67 22.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.134 0.492 . . . . 0.0 110.054 179.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -70.54 -33.16 70.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.932 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.491 HD22 ' HA2' ' A' ' 81' ' ' GLY . 62.5 mt -61.8 -43.48 98.76 Favored 'General case' 0 CA--C 1.52 -0.18 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.7 mp -52.93 -60.39 3.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.28 178.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -48.72 -47.53 41.15 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.645 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.423 ' HA ' ' HG2' ' A' ' 93' ' ' LYS . . . -53.62 -46.31 70.41 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.059 0.457 . . . . 0.0 110.286 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.15 -56.13 11.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.44 179.055 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -50.04 -56.96 8.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.555 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.423 ' HG2' ' HA ' ' A' ' 90' ' ' ALA . 0.0 OUTLIER -50.05 -28.29 6.85 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.161 179.537 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.412 ' N ' ' HG3' ' A' ' 93' ' ' LYS . 3.0 t60 -89.86 5.35 46.61 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.818 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . 0.547 ' CZ ' ' HD2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -146.14 11.31 1.18 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 121.02 -0.272 . . . . 0.0 111.442 179.973 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.333 -0.145 0 CA-C-O 120.804 0.335 . . . . 0.0 110.881 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.422 ' CD1' HD22 ' A' ' 52' ' ' LEU . 68.9 m-85 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 121.091 0.472 . . . . 0.0 110.792 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.511 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 35.6 p -74.12 -55.15 6.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.462 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.511 ' HB3' ' O ' ' A' ' 48' ' ' SER . 10.8 pt-20 170.25 -40.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.114 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -55.78 -55.24 34.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.962 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.464 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.9 tt0 -59.88 -41.6 91.95 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.152 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.422 HD22 ' CD1' ' A' ' 47' ' ' TYR . 30.4 mt -58.54 -53.42 58.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.205 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.473 ' HG2' ' CE2' ' A' ' 95' ' ' PHE . 0.8 OUTLIER -53.1 -47.56 68.48 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.068 0.461 . . . . 0.0 109.888 179.105 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.0 m -58.7 -44.76 90.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.615 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.464 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 12.8 m-70 -59.26 -50.82 72.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.815 178.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 40.9 mt -57.18 -46.26 84.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.98 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.5 m -52.45 -73.91 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.511 -179.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp -61.35 -69.01 0.26 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.956 -179.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 143.44 37.29 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.658 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 19.3 p -100.92 -13.69 18.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.545 0.212 . . . . 0.0 111.015 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.438 ' N ' ' HB3' ' A' ' 55' ' ' HIS . 14.5 tp -59.07 -32.06 69.44 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.009 0.433 . . . . 0.0 110.236 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -80.16 6.15 60.81 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.73 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.31 -50.29 6.21 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 120.927 0.394 . . . . 0.0 110.403 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -49.11 149.22 2.06 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.348 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 31.5 p -73.71 -162.86 0.14 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.663 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.48 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 24.6 t -75.67 -59.17 1.26 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.884 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 5.4 Cg_endo -47.48 -29.39 10.11 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.275 1.984 . . . . 0.0 111.877 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -79.69 -44.84 20.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.89 179.183 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.528 ' HB3' ' HB3' ' A' ' 87' ' ' LEU . 15.9 mt -61.32 -48.87 79.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.129 179.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.6 mmmt -52.64 -34.11 49.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.298 179.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -56.3 -55.84 28.39 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.855 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.63 -45.55 85.27 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.994 0.426 . . . . 0.0 110.317 179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 91.3 m -60.59 -43.12 97.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.239 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -35.08 78.36 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.546 179.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.19 -37.93 72.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.741 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.404 ' OH ' ' CE2' ' A' ' 95' ' ' PHE . 2.6 m-85 -83.88 -23.28 31.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.132 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.3 24.21 29.62 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.341 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.4 mt -81.17 -174.27 4.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.788 0.327 . . . . 0.0 110.989 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.16 71.3 1.39 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.063 0.459 . . . . 0.0 110.505 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.0 m -76.52 -170.9 1.65 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.024 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.413 ' O ' ' CD1' ' A' ' 82' ' ' LEU . . . -116.69 -129.04 4.26 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.691 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.436 ' HA ' HD11 ' A' ' 82' ' ' LEU . 2.5 mm? -147.03 9.8 0.99 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.498 0.189 . . . . 0.0 111.143 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.5 tptm -84.04 6.0 23.78 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.599 0.238 . . . . 0.0 111.23 179.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.7 mtmm 72.13 -78.34 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.518 -179.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -51.1 -32.15 21.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.901 0.381 . . . . 0.0 111.008 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -64.16 -40.03 95.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.919 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.528 ' HB3' ' HB3' ' A' ' 69' ' ' LEU . 1.2 mt -61.11 -42.78 99.16 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 179.314 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -50.72 -53.65 29.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.502 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -50.85 -53.23 34.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.872 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -53.24 -43.29 67.2 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.133 0.492 . . . . 0.0 110.261 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.11 -58.11 6.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.264 179.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.426 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.9 m -50.74 -59.13 4.41 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.018 179.701 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.4 tptm -47.63 -31.51 4.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.235 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -75.33 -44.19 46.65 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.367 -179.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . 0.473 ' CE2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -92.81 3.68 55.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.623 -179.641 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' A' ' 92' ' ' THR . 1.4 tp-100 . . . . . 0 C--N 1.332 -0.181 0 CA-C-O 120.788 0.328 . . . . 0.0 110.726 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 . . . . . 0 N--CA 1.453 -0.295 0 CA-C-O 121.253 0.549 . . . . 0.0 110.251 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.8 p -163.61 -33.11 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.218 -179.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.469 ' HG2' ' CE2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER 169.07 -56.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.287 179.576 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.0 -53.79 44.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.695 0.284 . . . . 0.0 110.835 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.418 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.1 tp10 -61.11 -40.77 95.02 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.449 HD21 ' CB ' ' A' ' 72' ' ' ALA . 45.2 mt -59.7 -52.33 65.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.182 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.465 ' HG2' ' CE2' ' A' ' 95' ' ' PHE . 1.2 mmtp -52.76 -47.97 67.11 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.016 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.8 m -57.23 -45.7 83.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.271 178.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.418 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 12.9 m-70 -60.94 -52.93 62.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.828 178.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 24.7 mt -57.75 -38.45 65.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.057 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.4 t -52.31 -75.21 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.408 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -61.52 -70.48 0.19 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.946 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 150.53 34.93 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.774 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.8 p -101.96 -15.07 16.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.742 0.306 . . . . 0.0 111.022 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.43 ' HA ' ' CE2' ' A' ' 64' ' ' PHE . 2.8 tm? -58.57 -26.72 63.9 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.895 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.406 ' HA2' ' CG ' ' A' ' 88' ' ' LEU . . . -93.09 2.56 71.95 Favored Glycine 0 C--N 1.33 0.242 0 C-N-CA 120.766 -0.731 . . . . 0.0 113.034 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.5 mtmm -91.87 -38.67 12.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.929 0.395 . . . . 0.0 110.586 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.43 ' CE2' ' HA ' ' A' ' 61' ' ' LEU . 28.6 m-85 -47.08 152.66 0.52 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.511 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.64 -171.56 1.06 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.014 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.486 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 69.2 t -75.83 -58.25 1.38 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.696 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.486 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 9.3 Cg_endo -52.31 -28.32 34.17 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.047 1.831 . . . . 0.0 111.489 179.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.7 mtm -79.57 -45.94 18.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.9 179.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.452 ' CB ' ' CD1' ' A' ' 87' ' ' LEU . 27.2 mt -61.67 -44.05 97.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.346 179.175 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.71 -36.38 46.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.732 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -55.51 -53.1 60.52 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.637 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.449 ' CB ' HD21 ' A' ' 52' ' ' LEU . . . -58.05 -44.92 87.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.575 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.7 m -58.83 -40.69 84.96 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.935 179.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.79 -36.53 83.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.191 179.127 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.68 -32.56 65.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.642 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.481 ' CD1' ' CE1' ' A' ' 94' ' ' HIS . 1.5 m-85 -82.92 -34.21 26.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.773 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 97.61 15.63 36.73 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.584 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.41 159.83 24.2 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.794 0.331 . . . . 0.0 110.891 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.49 28.19 6.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.161 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.75 -173.38 3.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.874 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.409 ' O ' ' HB2' ' A' ' 82' ' ' LEU . . . 117.0 -145.67 18.73 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.767 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 81' ' ' GLY . 5.2 mt 68.3 -67.77 0.19 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.022 0.439 . . . . 0.0 110.847 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -83.73 -95.63 0.06 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.909 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.44 -61.34 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.9 0.381 . . . . 0.0 109.995 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.433 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.2 OUTLIER -55.13 -46.61 75.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.702 179.128 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -44.13 -35.85 2.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.073 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.452 ' CD1' ' CB ' ' A' ' 69' ' ' LEU . 15.9 mt -63.04 -43.93 97.32 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 85' ' ' GLN . 1.8 mp -51.76 -55.4 19.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.161 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.54 -52.13 41.58 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.817 179.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -52.68 -42.7 65.0 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 121.188 0.518 . . . . 0.0 110.055 179.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.19 -60.32 2.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.48 178.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.1 m -50.03 -54.95 16.82 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.273 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 30.6 mttm -49.61 -33.06 14.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.035 179.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.481 ' CE1' ' CD1' ' A' ' 76' ' ' TYR . 2.1 t-160 -83.89 1.1 44.92 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.676 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . 0.469 ' CE2' ' HG2' ' A' ' 49' ' ' GLU . 0.1 OUTLIER -148.75 22.4 1.0 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.749 0.309 . . . . 0.0 111.05 179.751 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.331 -0.201 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.891 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.448 ' CD2' ' HB3' ' A' ' 71' ' ' GLU . 30.2 m-85 . . . . . 0 C--O 1.231 0.107 0 CA-C-O 121.046 0.451 . . . . 0.0 111.031 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 90.5 p -74.02 -52.65 12.07 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.661 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.427 ' HG3' ' CE1' ' A' ' 76' ' ' TYR . 3.4 mt-10 164.31 -36.45 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.348 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -60.16 3.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.258 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.472 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.2 OUTLIER -58.72 -40.48 83.85 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.402 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.491 HD12 ' CZ ' ' A' ' 76' ' ' TYR . 68.1 mt -59.47 -51.89 67.96 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.247 178.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.435 ' HD2' ' CE1' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.5 -48.09 69.27 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.152 0.501 . . . . 0.0 109.872 179.115 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.2 m -57.8 -42.24 83.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.708 178.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.472 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 8.4 m-70 -60.07 -48.94 79.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.916 178.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 55.6 mt -57.24 -47.72 83.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.143 179.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -53.08 -73.76 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.542 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.83 -70.81 0.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.279 -179.441 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 144.34 36.18 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.868 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.88 -10.49 21.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.705 0.288 . . . . 0.0 110.898 179.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.42 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 28.8 tp -59.05 -21.27 58.85 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.829 0.347 . . . . 0.0 110.507 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -90.77 16.86 57.23 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.435 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.8 mtpt -89.66 -47.25 8.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.008 0.433 . . . . 0.0 110.356 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -48.17 153.41 0.7 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.489 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 55.0 m -74.94 -81.62 0.07 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.602 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.481 ' HB ' ' CD ' ' A' ' 67' ' ' PRO . 3.8 t -160.42 -64.84 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.131 -178.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.481 ' CD ' ' HB ' ' A' ' 66' ' ' VAL . 10.2 Cg_endo -50.63 -26.11 16.29 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.264 1.976 . . . . 0.0 110.912 178.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.7 mtm -78.6 -43.2 26.98 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.535 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.467 ' HB3' ' HB3' ' A' ' 87' ' ' LEU . 19.8 mt -62.63 -44.34 96.54 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.457 179.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.3 mmtt -51.3 -34.56 33.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.656 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.448 ' HB3' ' CD2' ' A' ' 47' ' ' TYR . 2.3 tp10 -55.8 -55.44 32.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.799 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.94 88.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.96 0.41 . . . . 0.0 110.36 179.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 80.5 m -60.4 -40.94 92.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.248 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.6 ttm-85 -61.69 -36.9 82.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.133 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.43 -28.52 56.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.541 179.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.491 ' CZ ' HD12 ' A' ' 52' ' ' LEU . 3.3 m-85 -83.02 -32.6 26.81 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.705 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.67 16.71 59.58 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.62 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.0 mt -81.85 -165.61 1.02 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.877 0.37 . . . . 0.0 111.115 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -133.96 74.98 1.57 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.321 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.406 ' CB ' ' HA ' ' A' ' 87' ' ' LEU . 4.3 p -74.54 -176.44 2.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.288 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -113.18 165.52 12.05 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.842 -179.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -81.83 1.38 35.12 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.07 -75.54 0.24 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.721 0.296 . . . . 0.0 110.686 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 166.82 -71.41 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.593 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -51.06 -30.76 16.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.852 0.358 . . . . 0.0 111.106 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -58.92 -39.68 82.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.746 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.467 ' HB3' ' HB3' ' A' ' 69' ' ' LEU . 1.1 mt -61.58 -43.94 97.94 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.0 mp -51.78 -53.91 34.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.134 178.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -50.23 -53.15 30.2 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.867 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -51.89 -44.01 63.58 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.145 0.498 . . . . 0.0 110.341 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.39 -57.15 7.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.352 178.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.2 m -50.46 -56.64 10.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.544 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.52 -31.06 9.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.052 179.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 19.1 t60 -75.76 -9.28 58.46 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.655 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . 0.435 ' CE1' ' HD2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.21 29.98 0.95 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.862 0.363 . . . . 0.0 110.955 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.807 179.764 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 . . . . . 0 C--O 1.232 0.134 0 CA-C-O 121.09 0.471 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.12 -46.74 40.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.719 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 166.91 -43.02 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.386 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.1 -55.97 25.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.016 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.457 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 3.5 tt0 -59.72 -40.89 89.51 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.128 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.412 ' CD2' ' CD2' ' A' ' 91' ' ' LEU . 26.8 mt -59.24 -52.81 64.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.245 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.612 ' O ' HG21 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -53.89 -46.38 71.38 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 121.256 0.551 . . . . 0.0 110.126 179.2 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.9 m -59.48 -43.53 93.26 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.457 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 11.1 m-70 -60.49 -51.65 68.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.99 178.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.612 HG21 ' O ' ' A' ' 53' ' ' LYS . 8.8 tt -58.54 -44.85 90.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-O 120.841 0.353 . . . . 0.0 110.617 179.48 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.434 ' N ' HG23 ' A' ' 56' ' ' ILE . 68.2 m -56.59 -63.48 1.18 Allowed 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.869 179.626 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.403 ' N ' ' CD ' ' A' ' 58' ' ' LYS . 8.9 mptt -62.19 -50.52 71.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.953 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.8 23.63 4.59 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.495 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 38.2 p -101.07 1.08 39.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.498 0.19 . . . . 0.0 111.512 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.414 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 47.5 tp -59.63 -26.85 65.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.778 0.323 . . . . 0.0 110.923 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -92.87 12.89 68.92 Favored Glycine 0 CA--C 1.518 0.267 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.738 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -91.67 -51.55 5.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.851 0.358 . . . . 0.0 110.676 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -46.78 158.11 0.13 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.166 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 26.4 p -72.84 -167.83 0.41 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.886 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.462 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 55.9 t -76.76 -59.58 0.95 Allowed Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.209 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.496 ' HA ' ' CD ' ' A' ' 70' ' ' LYS . 3.8 Cg_endo -46.42 -29.68 7.42 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.526 2.151 . . . . 0.0 112.144 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 29.4 mtm -79.2 -44.72 21.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.167 0.508 . . . . 0.0 109.993 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.446 ' HB3' ' CB ' ' A' ' 87' ' ' LEU . 29.6 mt -64.73 -55.64 18.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.071 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.496 ' CD ' ' HA ' ' A' ' 67' ' ' PRO . 0.0 OUTLIER -51.19 -27.3 8.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.748 0.309 . . . . 0.0 110.784 179.865 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -57.53 -53.05 62.54 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.586 179.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -59.01 -48.32 82.0 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.986 0.422 . . . . 0.0 110.357 179.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 90.8 m -61.33 -40.73 95.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.666 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -61.77 -36.22 80.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.675 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.19 -44.87 64.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.611 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -88.71 10.02 22.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.574 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.37 44.67 76.56 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.86 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -81.33 -177.95 6.71 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.827 0.346 . . . . 0.0 110.919 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.44 -43.87 7.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.826 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.2 p 45.99 -164.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.367 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.405 ' N ' ' HB3' ' A' ' 86' ' ' GLU . . . -137.88 -108.71 0.86 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.727 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -160.49 -31.35 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -65.96 0.88 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.689 0.281 . . . . 0.0 111.205 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 173.36 -64.57 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.102 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -46.9 -34.89 5.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.876 0.37 . . . . 0.0 111.189 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.405 ' HB3' ' N ' ' A' ' 81' ' ' GLY . 3.7 mm-40 -59.91 -44.57 94.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.565 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.446 ' CB ' ' HB3' ' A' ' 69' ' ' LEU . 1.3 mt -61.78 -43.04 99.64 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.8 mt -50.64 -50.99 53.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.425 178.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -51.05 -54.61 23.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.105 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.448 ' O ' ' HG3' ' A' ' 93' ' ' LYS . . . -55.12 -43.4 74.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.95 0.405 . . . . 0.0 110.909 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.412 ' CD2' ' CD2' ' A' ' 52' ' ' LEU . 0.8 OUTLIER -69.12 -49.02 60.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.498 179.438 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.402 ' CG2' ' N ' ' A' ' 93' ' ' LYS . 0.7 OUTLIER -52.4 -61.32 2.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.711 -179.988 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 0.0 OUTLIER -48.87 -28.38 3.72 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.731 0.301 . . . . 0.0 111.058 179.557 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 -72.89 -23.6 60.74 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.262 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . 0.478 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.06 45.13 1.08 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.889 0.376 . . . . 0.0 111.014 -179.856 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.937 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.987 0.422 . . . . 0.0 111.128 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.503 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 91.2 p -72.28 -52.83 14.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.283 179.642 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.503 ' HB3' ' O ' ' A' ' 48' ' ' SER . 1.8 pt-20 165.4 -34.68 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.009 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -60.13 4.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.062 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.431 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.1 OUTLIER -59.23 -39.75 83.71 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.251 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.439 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 22.3 mt -60.21 -51.56 69.07 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.155 178.767 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.484 ' CE ' ' CD1' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.72 -48.39 69.65 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.86 179.045 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.1 m -57.89 -45.09 86.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.605 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.431 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 14.8 m-70 -59.56 -51.01 71.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.808 178.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 20.3 mt -56.84 -45.12 83.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.844 179.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.4 m -52.94 -70.74 0.08 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.352 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.6 mttp -61.56 -79.75 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.029 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 157.49 33.26 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.885 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 17.0 p -102.77 -12.46 17.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.734 0.302 . . . . 0.0 111.037 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.425 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 3.1 tm? -59.65 -27.09 66.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.802 0.334 . . . . 0.0 110.81 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -90.22 11.13 71.98 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.755 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.74 -47.01 7.59 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.879 0.371 . . . . 0.0 110.557 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -47.43 146.6 1.99 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.388 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 32.6 p -73.71 -169.84 0.77 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.118 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.512 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 78.8 t -76.4 -56.24 1.54 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.507 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.512 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 5.5 Cg_endo -48.29 -35.94 28.53 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.341 2.027 . . . . 0.0 112.233 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 26.9 mtp -81.69 -34.34 30.72 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.78 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.424 ' HB3' ' CB ' ' A' ' 87' ' ' LEU . 7.5 mt -63.04 -52.89 61.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.572 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.473 ' CD ' ' HA ' ' A' ' 67' ' ' PRO . 0.5 OUTLIER -49.45 -29.87 7.22 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.868 0.366 . . . . 0.0 111.026 -179.663 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.413 ' N ' ' HG2' ' A' ' 70' ' ' LYS . 2.0 tt0 -57.32 -55.34 36.08 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.357 179.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.91 -40.2 83.81 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.29 179.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 7.7 m -60.12 -40.58 90.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.391 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.94 -36.43 81.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.466 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.87 -32.74 59.84 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.63 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.499 ' CD2' ' CG ' ' A' ' 94' ' ' HIS . 3.2 m-30 -84.17 -23.91 30.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.971 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 82.36 23.76 55.87 Favored Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.492 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.4 mt -81.81 170.48 15.65 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.922 0.392 . . . . 0.0 111.155 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -111.47 81.16 1.4 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.76 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -159.5 -171.22 3.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.084 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.401 ' HA2' ' CD2' ' A' ' 87' ' ' LEU . . . 109.38 48.54 0.8 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.667 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -158.51 19.24 0.22 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.586 0.232 . . . . 0.0 111.576 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.15 6.49 0.1 Allowed 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 16.5 ttpp 69.13 -82.4 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.604 0.24 . . . . 0.0 110.895 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.455 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 34.1 tt0 -49.04 -45.38 42.65 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.897 0.379 . . . . 0.0 111.249 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.28 -39.38 14.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.902 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.424 ' CB ' ' HB3' ' A' ' 69' ' ' LEU . 1.7 mt -62.57 -43.93 97.58 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.27 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.455 ' HB2' ' O ' ' A' ' 85' ' ' GLN . 1.2 mp -51.97 -53.55 40.09 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.139 178.79 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -50.79 -52.97 35.83 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.812 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -52.85 -43.83 66.34 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.02 0.438 . . . . 0.0 110.496 179.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.29 -54.87 19.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.425 179.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.401 ' CG2' ' NE2' ' A' ' 96' ' ' GLN . 0.9 OUTLIER -50.58 -59.41 4.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.373 179.802 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.5 ptmm? -48.24 -31.2 5.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.214 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.499 ' CG ' ' CD2' ' A' ' 76' ' ' TYR . 51.3 t-80 -74.26 -17.9 60.8 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.712 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . 0.484 ' CD1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -146.87 38.04 0.99 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.945 0.402 . . . . 0.0 110.855 -179.831 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.401 ' NE2' ' CG2' ' A' ' 92' ' ' THR . 1.7 tt0 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.876 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 28.0 m-85 . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.988 0.423 . . . . 0.0 110.718 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.405 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 1.1 p -72.05 -42.83 65.81 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.637 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.405 ' CB ' ' O ' ' A' ' 48' ' ' SER . 3.4 mt-10 163.79 -43.94 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.536 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.0 -56.28 21.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.173 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.455 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.0 OUTLIER -60.02 -40.33 88.94 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.327 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.439 HD12 ' CZ ' ' A' ' 76' ' ' TYR . 19.8 mt -59.9 -51.73 68.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.247 178.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.459 ' HG2' ' CD2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -54.07 -47.84 71.25 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-O 121.073 0.463 . . . . 0.0 109.938 179.071 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.5 m -57.81 -42.61 84.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.685 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.455 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 11.7 m-70 -59.61 -49.29 78.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.829 178.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 6.9 mt -57.36 -48.36 82.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.988 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 2.4 m -53.78 -63.54 1.12 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.54 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 30.4 mttm -60.85 -46.45 90.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.254 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 116.98 20.78 4.76 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.692 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 21.8 p -97.87 -8.44 28.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.613 0.244 . . . . 0.0 111.047 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.454 ' O ' ' CD2' ' A' ' 88' ' ' LEU . 3.4 tm? -58.87 -29.37 66.94 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.654 0.264 . . . . 0.0 110.378 179.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.407 ' HA2' ' HB3' ' A' ' 88' ' ' LEU . . . -85.0 10.67 62.29 Favored Glycine 0 CA--C 1.52 0.387 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.536 179.52 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -95.48 -40.71 9.33 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.781 0.324 . . . . 0.0 111.641 -179.547 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -44.74 144.74 1.06 Allowed 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -179.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.405 ' O ' ' CD1' ' A' ' 69' ' ' LEU . 15.8 p -74.24 -171.68 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.54 179.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.501 ' HB ' ' HD3' ' A' ' 67' ' ' PRO . 70.6 t -76.81 -46.23 3.0 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.65 -179.625 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.501 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 39.6 Cg_exo -60.42 -30.28 90.54 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.13 1.887 . . . . 0.0 111.952 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' MET . . . . . 0.404 ' HE1' ' N ' ' A' ' 68' ' ' MET . 0.0 OUTLIER -81.45 -39.15 25.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.301 179.656 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.547 ' HB3' ' HB3' ' A' ' 87' ' ' LEU . 11.5 mt -61.01 -40.96 95.53 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.147 179.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -52.33 -42.0 63.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.949 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.39 -53.52 56.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.411 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -56.26 -50.36 71.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.942 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -59.58 -37.43 78.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.194 179.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -62.46 -37.74 87.08 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.161 179.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.88 -27.99 49.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.744 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.439 ' CZ ' HD12 ' A' ' 52' ' ' LEU . 2.8 m-30 -82.09 -37.94 25.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.939 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 100.75 18.19 21.29 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.923 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 21.0 mt -81.15 -166.71 1.21 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.696 0.284 . . . . 0.0 110.737 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.428 ' O ' ' O ' ' A' ' 80' ' ' SER . 0.2 OUTLIER -96.26 -43.85 7.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.774 179.813 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.428 ' O ' ' O ' ' A' ' 79' ' ' LYS . 0.0 OUTLIER 57.71 138.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.434 179.527 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.415 ' O ' ' HB2' ' A' ' 82' ' ' LEU . . . 147.17 -165.93 28.55 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.231 -0.985 . . . . 0.0 113.086 179.57 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 81' ' ' GLY . 4.7 mp 68.83 -67.4 0.21 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.961 0.41 . . . . 0.0 110.793 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.65 152.85 16.43 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.248 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.37 -54.61 5.68 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.895 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -46.19 -43.65 15.4 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.014 0.435 . . . . 0.0 110.3 179.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -60.91 -42.2 97.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.504 178.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.547 ' HB3' ' HB3' ' A' ' 69' ' ' LEU . 26.6 mt -62.72 -54.25 42.12 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 178.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.454 ' CD2' ' O ' ' A' ' 61' ' ' LEU . 4.3 mt -53.44 -52.07 60.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.679 178.369 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.37 -49.21 70.36 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.572 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -51.83 -42.69 62.75 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 121.128 0.49 . . . . 0.0 110.01 179.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.82 -62.46 1.55 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.247 178.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 18.0 m -49.55 -57.51 6.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.101 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -47.06 -30.8 2.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.138 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -65.83 -52.92 46.45 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.627 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . 0.459 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -90.91 -9.82 44.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.799 -179.386 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 C--N 1.33 -0.261 0 CA-C-O 120.863 0.363 . . . . 0.0 110.908 179.809 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 . . . . . 0 N--CA 1.457 -0.09 0 CA-C-O 120.998 0.428 . . . . 0.0 110.729 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.55 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 78.9 p -71.18 -55.54 7.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.424 179.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.55 ' HB3' ' O ' ' A' ' 48' ' ' SER . 4.6 pt-20 170.38 -37.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.446 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -57.46 -55.28 36.9 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.703 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.444 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 2.1 tt0 -61.35 -41.56 97.25 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.006 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.433 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 43.3 mt -59.65 -50.58 73.29 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.14 178.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.47 ' HG2' ' CD2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -52.58 -49.86 64.16 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.011 178.957 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 94.5 m -59.3 -42.42 91.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.012 179.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.444 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 12.5 m-70 -58.44 -50.04 75.13 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 36.8 mt -58.27 -56.86 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.514 178.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.9 p -67.36 46.59 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.117 179.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -175.6 -58.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.744 0.307 . . . . 0.0 111.019 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 125.25 24.2 1.65 Allowed Glycine 0 CA--C 1.518 0.257 0 C-N-CA 120.659 -0.782 . . . . 0.0 113.036 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.7 -11.92 20.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.599 0.238 . . . . 0.0 111.097 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.415 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 17.8 tp -58.81 -22.61 58.87 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.815 0.34 . . . . 0.0 110.602 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -91.05 19.37 46.62 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.343 179.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.41 -58.34 2.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.037 0.446 . . . . 0.0 110.214 179.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -49.54 152.32 1.4 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.397 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 22.4 p -74.14 -167.09 0.47 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.881 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.5 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 55.3 t -77.14 -57.42 1.12 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.276 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 6.2 Cg_endo -48.89 -31.42 19.95 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.358 2.039 . . . . 0.0 112.139 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 45.8 mtm -79.46 -39.54 31.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.249 179.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.464 ' HB3' ' CB ' ' A' ' 87' ' ' LEU . 8.8 mt -61.12 -39.69 90.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.631 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.418 ' N ' HD21 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -52.74 -36.77 58.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.891 179.725 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -55.52 -52.49 63.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.925 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.58 -42.85 83.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.731 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 8.8 m -59.84 -38.91 83.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.681 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 mtt-85 -62.07 -36.33 81.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.671 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -81.14 -29.89 34.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.082 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CD2' ' CG ' ' A' ' 94' ' ' HIS . 2.8 m-30 -84.82 -25.64 27.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.105 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.59 21.73 49.88 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.592 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.8 mt -81.27 -175.93 5.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.866 0.365 . . . . 0.0 110.961 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.2 tmtt? -97.47 -40.35 8.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.029 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 69.68 173.52 0.3 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.768 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -138.23 -130.27 2.78 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.588 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 12.3 mt -159.18 53.1 0.39 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.004 0.43 . . . . 0.0 110.744 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.15 10.16 0.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.803 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 75.03 -71.94 0.12 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.816 0.341 . . . . 0.0 110.755 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -47.33 -34.81 7.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.405 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -62.04 -45.29 94.24 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.057 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.464 ' CB ' ' HB3' ' A' ' 69' ' ' LEU . 1.2 mt -60.96 -42.62 98.63 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.8 mt -52.61 -53.28 48.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.273 178.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.78 -52.47 40.54 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.799 179.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -53.12 -45.03 68.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.005 0.431 . . . . 0.0 110.52 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.1 mt -66.52 -53.8 30.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.347 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -51.5 -60.49 3.08 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.448 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.422 ' HG3' ' N ' ' A' ' 94' ' ' HIS . 1.6 pttt -48.12 -28.96 3.21 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.801 0.334 . . . . 0.0 110.975 179.48 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.5 ' CG ' ' CD2' ' A' ' 76' ' ' TYR . 27.5 t-80 -67.54 -58.49 4.62 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.673 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . 0.47 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -95.82 22.4 7.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.256 179.887 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 C--N 1.331 -0.229 0 CA-C-O 120.809 0.338 . . . . 0.0 110.72 179.935 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.413 ' CD2' ' HB3' ' A' ' 71' ' ' GLU . 25.7 m-85 . . . . . 0 C--O 1.231 0.129 0 CA-C-O 121.017 0.436 . . . . 0.0 110.811 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.518 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 5.6 p -72.4 -53.13 13.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.356 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.518 ' HB3' ' O ' ' A' ' 48' ' ' SER . 2.8 pt-20 169.01 -35.03 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.207 179.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.52 -58.29 8.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.812 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.45 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -60.07 -41.59 92.74 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.208 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 14.0 mt -60.36 -49.52 77.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.013 178.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.452 ' HG2' ' CD2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.29 -49.27 67.32 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.096 179.208 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.52 -44.76 89.65 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.553 179.032 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.45 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 8.1 m-70 -60.13 -51.12 70.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.815 178.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.7 mt -56.66 -45.49 82.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.939 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -53.61 -73.96 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.221 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 48.3 mttt -62.18 -75.56 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.078 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 149.77 37.71 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.738 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.2 p -100.89 -8.81 22.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.656 0.265 . . . . 0.0 111.066 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.405 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 16.1 tp -58.79 -23.77 60.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.812 0.339 . . . . 0.0 110.694 179.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -91.42 14.07 64.82 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.367 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.2 tttt -92.28 -55.81 3.28 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.934 0.397 . . . . 0.0 110.407 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -48.0 154.54 0.53 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.307 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.3 p -73.67 -167.32 0.45 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.929 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.493 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 56.0 t -77.03 -57.94 1.08 Allowed Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.256 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 5.2 Cg_endo -47.83 -30.25 12.9 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.34 2.026 . . . . 0.0 112.054 179.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 33.1 mtm -80.33 -46.88 15.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.271 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.467 ' HB3' ' CB ' ' A' ' 87' ' ' LEU . 36.1 mt -61.14 -46.11 91.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.449 179.381 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.95 -32.1 31.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.54 179.272 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.413 ' HB3' ' CD2' ' A' ' 47' ' ' TYR . 0.0 OUTLIER -56.76 -54.92 40.71 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.891 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.12 -46.9 82.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.974 0.416 . . . . 0.0 110.372 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 57.3 m -61.01 -44.06 97.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.338 179.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.1 mmt180 -63.15 -34.3 77.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.67 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.86 -38.08 73.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.846 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.503 ' CD1' ' CE1' ' A' ' 94' ' ' HIS . 4.5 m-85 -84.28 -28.63 27.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.035 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.94 26.57 11.33 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.605 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -81.09 176.41 9.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.793 0.33 . . . . 0.0 110.912 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.92 -33.07 11.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.799 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.9 p 48.33 -173.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.418 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -124.92 160.4 19.55 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.47 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 35.4 mt -80.85 -4.5 54.98 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -80.38 -73.55 0.36 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.677 0.275 . . . . 0.0 110.768 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 167.84 -67.32 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.978 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.0 OUTLIER -54.5 -38.13 66.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.041 0.448 . . . . 0.0 110.681 179.76 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -45.13 -31.64 1.5 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.432 -179.065 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.467 ' CB ' ' HB3' ' A' ' 69' ' ' LEU . 2.3 mt -62.46 -40.72 97.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.099 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' A' ' 85' ' ' GLN . 5.1 mp -50.92 -53.64 30.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.38 178.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -49.74 -54.52 18.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.956 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -51.49 -44.54 62.52 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.199 0.524 . . . . 0.0 110.121 179.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.75 -58.2 5.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.755 179.16 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.416 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.3 m -49.35 -53.95 19.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.298 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.92 -31.12 4.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.12 179.264 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.503 ' CE1' ' CD1' ' A' ' 76' ' ' TYR . 2.5 t60 -76.44 -16.55 59.66 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.704 -179.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . 0.452 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -146.78 36.12 0.95 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.819 0.343 . . . . 0.0 110.998 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.416 ' N ' ' O ' ' A' ' 92' ' ' THR . 2.8 pt20 . . . . . 0 CA--C 1.532 0.251 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.985 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.8 mtmt . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.696 0.284 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.4 p 41.39 38.31 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.697 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.83 3.52 14.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.823 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 70.81 44.45 0.62 Allowed 'General case' 0 C--O 1.231 0.13 0 CA-C-O 120.987 0.423 . . . . 0.0 110.811 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.415 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 0.7 OUTLIER -71.82 -42.13 67.38 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.336 179.502 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.42 ' HG3' ' CE1' ' A' ' 76' ' ' TYR . 0.4 OUTLIER 163.11 -42.84 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.367 179.84 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.2 -58.7 6.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.311 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.449 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.4 tp10 -58.88 -39.1 80.4 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.447 HD13 ' CE1' ' A' ' 76' ' ' TYR . 22.1 mt -60.2 -52.94 63.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.222 178.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.501 ' HG2' ' CE2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.56 -48.21 69.35 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-O 121.033 0.444 . . . . 0.0 109.952 179.168 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.7 m -59.39 -45.6 91.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.954 179.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.461 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 15.3 m-70 -59.59 -49.07 79.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.258 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 58.7 mt -55.29 -40.56 57.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.946 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.4 t -53.26 -77.01 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.347 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -49.28 77.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.29 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 118.67 31.84 1.42 Allowed Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.743 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' THR . . . . . 0.47 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 2.9 m -98.25 -6.23 31.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.587 0.232 . . . . 0.0 111.099 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.461 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -59.86 -22.46 62.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.874 0.369 . . . . 0.0 110.337 179.352 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -90.77 22.44 28.17 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.846 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.47 ' HB2' ' O ' ' A' ' 60' ' ' THR . 0.2 OUTLIER -90.4 -54.87 3.82 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.107 0.48 . . . . 0.0 109.987 179.47 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -49.42 158.27 0.43 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.563 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 65.3 p -73.89 -168.0 0.55 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.624 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.505 ' HB ' ' HD3' ' A' ' 67' ' ' PRO . 47.4 t -77.35 -47.51 2.53 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.656 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.505 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 51.7 Cg_exo -52.15 -34.14 57.16 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.187 1.924 . . . . 0.0 111.88 179.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 46.5 mtm -80.01 -40.48 27.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.497 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.442 ' HB3' ' CB ' ' A' ' 87' ' ' LEU . 9.6 mt -60.32 -41.52 93.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.491 179.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.93 -34.91 57.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.684 179.142 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.09 -54.86 39.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.966 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -56.94 -43.56 81.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.672 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 13.7 m -60.27 -41.26 92.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.442 179.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.85 -35.95 79.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.544 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.99 -30.29 50.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.817 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.447 ' CE1' HD13 ' A' ' 52' ' ' LEU . 2.7 m-85 -84.26 -29.11 26.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.006 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.77 24.02 47.47 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.573 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.9 mt -81.2 -170.79 2.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.796 0.331 . . . . 0.0 110.846 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -96.86 -37.58 10.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.881 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 68.23 176.58 0.26 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.857 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -137.37 146.22 18.07 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.483 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.2 mp -80.75 65.63 5.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.83 0.348 . . . . 0.0 111.015 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 2.0 tptt -157.39 -73.38 0.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.029 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 83' ' ' LYS . 35.8 tttm 168.9 -83.77 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.582 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -47.55 -31.77 4.72 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.159 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -52.37 -36.86 54.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.696 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.442 ' CB ' ' HB3' ' A' ' 69' ' ' LEU . 1.2 mt -62.39 -47.37 84.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.764 179.166 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -51.2 -51.25 55.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.333 178.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.44 -53.2 39.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.816 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -52.91 -44.09 66.69 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.112 0.482 . . . . 0.0 110.117 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.0 mt -65.94 -57.3 8.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.696 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.1 m -49.76 -55.9 12.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.365 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.8 mmtm -48.61 -35.21 13.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.216 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.427 ' CD2' ' CD2' ' A' ' 76' ' ' TYR . 1.5 t-80 -79.17 -3.35 45.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.817 -179.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . 0.501 ' CE2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.5 27.66 0.9 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.663 0.268 . . . . 0.0 110.947 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -167.1 125.61 1.34 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.982 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.906 -179.933 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.9 mttt . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.808 0.337 . . . . 0.0 111.192 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.0 p -78.43 34.71 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.979 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -78.59 2.91 17.71 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 70.42 50.99 0.37 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.016 0.436 . . . . 0.0 110.696 -179.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.51 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 85.3 p -71.52 -47.89 52.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.31 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.51 ' HB3' ' O ' ' A' ' 48' ' ' SER . 5.3 pt-20 167.39 -42.16 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.486 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -55.7 -56.1 24.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.251 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.458 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.3 OUTLIER -60.07 -40.73 90.55 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.395 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.471 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 23.7 mt -60.05 -50.98 71.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.208 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.557 ' HD2' ' CZ ' ' A' ' 95' ' ' PHE . 41.5 tttm -53.04 -48.88 67.28 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.1 m -55.19 -43.12 74.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.313 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.458 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 4.7 m-70 -60.79 -49.81 75.98 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.686 178.467 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 34.3 mt -55.89 -46.74 80.31 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.905 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 58.5 m -53.7 -74.37 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.272 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -61.79 -74.77 0.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.133 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 145.66 37.39 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.857 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 63.2 p -100.41 -9.48 22.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.688 0.28 . . . . 0.0 111.034 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.434 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 0.7 OUTLIER -58.67 -24.84 62.05 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.843 0.354 . . . . 0.0 110.38 179.611 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -88.01 16.19 52.54 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.581 179.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.6 mtmt -91.38 -57.91 2.62 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.089 0.471 . . . . 0.0 110.125 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -49.92 155.8 0.84 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.361 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 73.6 p -74.4 -169.53 0.84 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.708 179.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.486 ' HB ' ' HD3' ' A' ' 67' ' ' PRO . 53.7 t -78.01 -46.69 2.25 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.748 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.486 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 52.6 Cg_exo -51.97 -34.69 57.64 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.192 1.928 . . . . 0.0 111.84 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 17.0 mtm -80.27 -39.26 29.24 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.404 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.9 mt -60.82 -46.89 88.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.393 179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.08 -33.14 37.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.628 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.402 ' O ' ' CG ' ' A' ' 74' ' ' ARG . 2.2 tm-20 -56.82 -53.76 54.12 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.865 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.4 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -57.68 -33.74 68.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.031 0.443 . . . . 0.0 110.38 179.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 34.8 m -61.45 -47.48 85.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.02 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.407 ' HG3' ' N ' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -61.99 -28.45 69.57 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.921 -179.849 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.407 ' N ' ' HG3' ' A' ' 74' ' ' ARG . . . -80.14 -34.29 37.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.986 0.422 . . . . 0.0 110.724 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.471 ' CZ ' HD11 ' A' ' 52' ' ' LEU . 3.2 m-30 -84.8 -25.76 27.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.047 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.07 24.52 31.73 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.457 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.3 mt -81.13 -164.73 0.79 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.759 0.314 . . . . 0.0 110.821 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.64 24.4 2.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.006 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.83 -166.99 0.87 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.785 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 108.8 88.03 1.93 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.632 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 19.2 mt -158.86 -86.17 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.675 0.274 . . . . 0.0 110.667 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 3.1 mmtm -82.0 -66.01 0.94 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.841 0.353 . . . . 0.0 110.642 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.43 ' HB2' ' O ' ' A' ' 83' ' ' LYS . 0.8 OUTLIER 169.13 -65.63 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.019 179.931 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.68 -37.48 28.89 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.248 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.87 -40.12 69.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.067 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.9 mt -61.54 -47.16 86.84 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.4 mp -51.42 -53.02 41.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.227 178.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -51.12 -52.75 40.71 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.879 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -52.88 -43.24 66.0 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.103 0.478 . . . . 0.0 110.107 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.406 ' CD2' HD21 ' A' ' 52' ' ' LEU . 0.4 OUTLIER -66.82 -58.52 4.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.695 179.187 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.408 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.2 m -49.37 -55.59 12.43 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.263 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.8 mtpp -46.31 -34.21 4.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.043 179.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.459 ' HB3' ' CE2' ' A' ' 76' ' ' TYR . 33.1 t-80 -66.22 -55.42 16.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.143 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . 0.557 ' CZ ' ' HD2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -92.38 14.26 17.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.5 -179.629 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.408 ' N ' ' O ' ' A' ' 92' ' ' THR . 0.0 OUTLIER -73.54 105.94 5.1 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.729 0.3 . . . . 0.0 110.873 179.692 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.242 -0.885 . . . . 0.0 110.929 -179.988 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.832 0.349 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 20.0 t -76.16 2.41 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.998 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -73.38 -16.55 61.34 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.6 0.238 . . . . 0.0 111.345 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 65.14 55.0 1.15 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.987 0.423 . . . . 0.0 110.911 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.462 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 13.1 p -71.87 -46.92 56.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.518 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 48' ' ' SER . 1.2 tt0 168.16 -43.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.537 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.33 -58.55 6.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.374 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.417 ' O ' ' CD2' ' A' ' 55' ' ' HIS . 0.3 OUTLIER -59.06 -39.26 81.53 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.463 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.461 HD11 ' CE1' ' A' ' 76' ' ' TYR . 38.0 mt -60.33 -52.3 65.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.306 178.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.444 ' HE3' ' CD1' ' A' ' 95' ' ' PHE . 1.4 tmtp? -54.87 -47.34 74.37 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-O 121.107 0.479 . . . . 0.0 110.005 179.153 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.2 m -59.09 -44.04 91.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.9 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.417 ' CD2' ' O ' ' A' ' 51' ' ' GLU . 19.3 m-70 -58.68 -49.73 76.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.889 179.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.2 mt -57.63 -48.21 83.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.014 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.91 -65.74 0.51 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.645 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 46.2 mttt -60.69 -39.01 86.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.166 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 111.29 23.67 5.68 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.527 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 44.5 p -97.65 -13.63 21.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.587 0.232 . . . . 0.0 111.001 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.421 ' O ' ' CD2' ' A' ' 88' ' ' LEU . 3.1 tm? -59.09 -28.53 66.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.746 0.308 . . . . 0.0 110.463 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.4 ' O ' HD13 ' A' ' 88' ' ' LEU . . . -86.7 13.22 59.26 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.598 179.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.94 -45.68 6.84 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.815 0.341 . . . . 0.0 111.275 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -45.24 144.77 1.27 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.958 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.4 ' O ' ' CD1' ' A' ' 69' ' ' LEU . 26.7 p -74.13 -168.2 0.6 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.82 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.508 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 55.5 t -76.1 -56.84 1.54 Allowed Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.626 -179.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.508 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 7.9 Cg_endo -50.28 -34.9 41.96 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.357 2.038 . . . . 0.0 112.416 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 47.1 mtm -80.1 -33.91 38.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.489 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.456 ' CD1' HD21 ' A' ' 88' ' ' LEU . 4.8 mt -61.43 -41.55 97.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.924 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.75 -37.68 43.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.839 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.61 -57.79 10.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.985 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.61 -44.29 85.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.872 0.368 . . . . 0.0 110.546 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.2 m -60.27 -37.26 79.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.436 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.0 mtt180 -62.47 -36.89 83.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.647 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -78.82 -32.16 46.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.005 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.461 ' CE1' HD11 ' A' ' 52' ' ' LEU . 2.7 m-85 -83.79 -25.99 29.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.187 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.7 24.45 55.9 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.617 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.4 mt -81.11 175.6 10.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.822 0.344 . . . . 0.0 110.842 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.01 -53.8 3.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.833 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 86.8 p 45.29 -166.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.35 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.408 ' O ' ' HG ' ' A' ' 82' ' ' LEU . . . -148.22 -112.23 0.66 Allowed Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.475 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.419 ' CD1' ' N ' ' A' ' 82' ' ' LEU . 0.1 OUTLIER -153.31 13.09 0.49 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.594 0.235 . . . . 0.0 111.395 -179.942 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.403 ' O ' ' HB3' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -84.97 8.05 19.09 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.764 -0.198 . . . . 0.0 111.292 179.476 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.403 ' HB3' ' O ' ' A' ' 83' ' ' LYS . 32.4 tttt 71.39 -79.35 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.57 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.403 ' HA ' HD12 ' A' ' 88' ' ' LEU . 0.5 OUTLIER -47.3 -40.44 16.92 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.88 0.372 . . . . 0.0 111.093 179.592 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.22 -49.78 66.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.692 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.454 ' HB3' ' HB3' ' A' ' 69' ' ' LEU . 2.4 mt -61.22 -49.58 76.56 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 178.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.456 HD21 ' CD1' ' A' ' 69' ' ' LEU . 15.4 mt -52.67 -50.55 63.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.941 178.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -54.5 -52.4 62.08 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.593 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -51.33 -41.4 60.53 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.099 0.476 . . . . 0.0 110.114 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.1 mt -65.67 -61.54 2.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.295 179.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.7 m -50.17 -56.67 10.05 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.086 179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.4 mtpt -48.36 -33.41 8.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.095 179.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -71.6 -15.47 62.26 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.684 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . 0.444 ' CD1' ' HE3' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.19 34.84 0.89 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.839 0.352 . . . . 0.0 110.908 -179.867 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -72.45 -177.83 2.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.88 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.5 t70 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.893 179.991 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.438 ' O ' ' CG2' ' A' ' 45' ' ' VAL . 19.9 mmtp . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.713 0.292 . . . . 0.0 111.116 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.438 ' CG2' ' O ' ' A' ' 44' ' ' LYS . 63.5 t -160.52 -54.16 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.752 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.415 ' O ' ' CD1' ' A' ' 47' ' ' TYR . 11.5 mm-40 -164.25 -70.49 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.832 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.415 ' CD1' ' O ' ' A' ' 46' ' ' GLU . 60.6 m-85 -156.17 75.5 0.88 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.482 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.519 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 85.3 p -73.67 -55.32 6.41 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.616 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.519 ' HB3' ' O ' ' A' ' 48' ' ' SER . 1.0 OUTLIER 168.66 -37.22 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.149 179.831 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -57.09 -54.79 42.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.765 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.46 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.0 OUTLIER -61.09 -42.92 99.4 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.022 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.459 ' CD1' ' CE1' ' A' ' 76' ' ' TYR . 33.1 mt -58.72 -50.99 71.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.077 178.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.476 ' CE ' ' CD1' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -52.42 -48.92 65.45 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.858 179.055 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.9 m -57.51 -42.34 82.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.643 178.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.46 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 4.7 m-70 -60.09 -48.9 79.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.859 178.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 74.7 mt -56.41 -47.95 80.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.859 179.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.48 -72.75 0.06 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.51 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 4.1 mttt -61.53 -74.34 0.08 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.297 -179.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 145.53 35.24 0.07 OUTLIER Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.949 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' THR . . . . . 0.428 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 0.7 OUTLIER -99.82 -9.62 22.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.644 0.259 . . . . 0.0 110.85 179.603 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.445 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -59.32 -21.48 59.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.902 0.382 . . . . 0.0 110.379 179.544 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -90.66 15.12 61.16 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.934 -0.651 . . . . 0.0 112.535 179.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.428 ' HB2' ' O ' ' A' ' 60' ' ' THR . 0.1 OUTLIER -90.92 -55.95 3.36 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.025 0.44 . . . . 0.0 109.977 179.633 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -49.82 151.79 1.71 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.236 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 17.8 p -73.87 -165.49 0.3 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.767 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.503 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 41.7 t -76.59 -57.55 1.26 Allowed Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.205 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 9.1 Cg_endo -50.95 -28.97 25.63 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.272 1.981 . . . . 0.0 112.101 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.4 mtp -79.98 -39.33 30.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.151 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.463 ' HB3' ' HB3' ' A' ' 87' ' ' LEU . 7.0 mt -61.16 -43.03 99.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.52 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.41 ' N ' HD23 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -51.94 -33.4 37.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.854 179.578 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -56.02 -52.52 63.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.053 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.67 -53.01 63.04 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.687 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.97 -33.61 72.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.358 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -37.72 87.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.08 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.77 -26.83 31.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.715 179.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CD2' ' CD2' ' A' ' 94' ' ' HIS . 3.0 m-85 -82.97 -30.92 27.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.817 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.97 14.6 59.05 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.809 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.4 mt -82.04 167.19 19.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.934 0.397 . . . . 0.0 111.103 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.29 75.58 1.82 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.662 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.475 ' OG ' ' HA ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -75.85 -169.07 1.0 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.103 -179.697 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -140.91 -120.37 1.67 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.47 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.7 pp -155.4 11.23 0.32 Allowed 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.8 tptp -85.52 7.05 24.38 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.614 0.245 . . . . 0.0 111.095 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.4 ttmm 69.43 -76.82 0.06 Allowed 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.53 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -50.56 -36.36 34.21 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.876 0.37 . . . . 0.0 111.161 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -62.08 -38.28 88.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.062 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.475 ' HA ' ' OG ' ' A' ' 80' ' ' SER . 1.2 mt -61.38 -42.44 98.72 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.2 mp -52.04 -54.48 29.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.34 178.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -50.37 -52.54 36.36 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.828 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -51.4 -44.09 62.13 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.199 0.523 . . . . 0.0 109.814 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.66 -61.09 2.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.653 179.016 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.0 m -48.88 -52.14 25.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.365 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 15.6 tptp -48.46 -34.64 11.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.168 179.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.501 ' CD2' ' CD2' ' A' ' 76' ' ' TYR . 24.7 t60 -78.53 -5.55 52.98 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.923 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . 0.476 ' CD1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.65 27.96 0.98 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.799 0.333 . . . . 0.0 110.975 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -72.71 98.17 2.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.884 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.847 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.8 mmpt? . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.866 0.365 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.9 p -73.57 -33.23 38.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.053 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -76.76 -0.42 23.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.671 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 64.42 83.05 0.17 Allowed 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.971 0.415 . . . . 0.0 110.754 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.511 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 83.0 p -72.47 -52.99 13.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.342 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.511 ' HB3' ' O ' ' A' ' 48' ' ' SER . 2.5 pt-20 164.83 -39.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.001 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -56.13 -58.26 8.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.471 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.419 ' HG3' ' CE1' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -58.92 -37.5 76.81 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 179.61 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.43 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 36.2 mt -60.95 -53.6 55.31 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.22 178.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.572 ' HD2' ' CZ ' ' A' ' 95' ' ' PHE . 20.8 tttm -54.7 -47.02 74.21 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-O 121.03 0.443 . . . . 0.0 110.096 178.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.9 m -56.97 -44.81 83.01 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.489 178.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.433 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 12.0 m-70 -60.42 -51.49 69.26 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.824 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 11.6 mt -56.96 -42.42 78.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.024 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.78 -76.11 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.643 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.9 pttt -60.97 -51.51 68.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.371 -179.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 123.98 52.18 0.2 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.564 -0.826 . . . . 0.0 112.805 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.18 -4.13 7.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.506 0.193 . . . . 0.0 111.097 179.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.433 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 60.7 tp -60.05 -20.89 60.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.843 0.354 . . . . 0.0 110.559 179.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -93.05 22.8 32.47 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.25 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.37 -57.59 2.73 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.018 0.437 . . . . 0.0 110.073 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -49.84 157.26 0.61 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.25 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 30.6 p -73.86 -169.4 0.73 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.037 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.516 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 75.2 t -76.77 -56.22 1.4 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.315 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 9.9 Cg_endo -52.31 -29.61 39.26 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.147 1.898 . . . . 0.0 112.027 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.71 -41.51 26.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.2 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.512 ' HB3' ' CB ' ' A' ' 87' ' ' LEU . 24.6 mt -61.4 -34.68 75.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.52 179.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.406 ' N ' HD22 ' A' ' 87' ' ' LEU . 12.4 mmtt -53.16 -38.21 62.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.097 179.636 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -54.98 -49.66 70.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.964 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.31 -48.81 77.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.733 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.76 -40.04 86.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.418 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -37.03 81.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.478 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.01 -30.39 44.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.734 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.43 ' CZ ' HD11 ' A' ' 52' ' ' LEU . 2.7 m-85 -85.48 5.38 31.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.417 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.82 16.18 58.92 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.704 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -81.1 178.74 8.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.873 0.368 . . . . 0.0 110.868 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.17 -31.85 12.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.698 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.9 p 65.63 169.3 0.21 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.977 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -151.06 150.91 22.95 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.56 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.57 66.95 6.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.921 0.391 . . . . 0.0 110.864 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -155.88 8.33 0.24 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.938 -179.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.409 ' HA ' ' CD1' ' A' ' 87' ' ' LEU . 0.0 OUTLIER 65.99 -76.48 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.725 0.298 . . . . 0.0 111.031 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -47.83 -34.01 8.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.332 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 37.8 tp10 -59.72 -42.54 93.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.925 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.512 ' CB ' ' HB3' ' A' ' 69' ' ' LEU . 1.5 mp -61.11 -43.91 98.15 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.2 mp -51.51 -53.71 34.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.269 178.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -50.47 -53.25 31.21 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.97 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -52.19 -43.99 64.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.062 0.458 . . . . 0.0 110.128 179.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.36 -58.54 5.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.424 179.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.9 m -50.23 -57.27 8.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.419 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.51 -31.87 11.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.279 179.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -85.43 0.49 52.09 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . 0.572 ' CZ ' ' HD2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -147.64 19.75 1.17 Allowed 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.036 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -72.57 82.48 1.11 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.799 0.333 . . . . 0.0 110.92 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.897 179.987 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.0 mtpt . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.833 0.349 . . . . 0.0 111.196 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.3 t -73.65 -45.11 51.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.087 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 76.24 28.91 0.77 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.043 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 51.95 68.8 0.75 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.022 0.439 . . . . 0.0 110.967 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.508 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 2.7 p -73.34 -53.31 11.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.383 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.508 ' HB3' ' O ' ' A' ' 48' ' ' SER . 8.1 pt-20 168.24 -39.46 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.214 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -56.29 -55.61 31.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.036 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.476 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -59.97 -43.02 95.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.343 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.425 ' HA ' ' CD2' ' A' ' 55' ' ' HIS . 15.4 mt -58.9 -50.68 73.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.055 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.486 ' CG ' ' CZ ' ' A' ' 95' ' ' PHE . 0.5 OUTLIER -52.61 -49.05 65.84 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.878 178.976 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.9 m -58.05 -43.45 86.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.727 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.476 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 6.2 m-70 -59.73 -49.33 78.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.84 178.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 16.4 mt -56.22 -47.73 80.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.988 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.54 -75.7 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.344 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -61.74 -72.28 0.13 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.148 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 143.33 39.47 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.582 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -99.52 -9.95 22.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.704 0.288 . . . . 0.0 111.068 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.467 ' N ' ' HB3' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -59.7 -21.46 60.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.862 0.363 . . . . 0.0 110.648 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.4 ' N ' HD21 ' A' ' 88' ' ' LEU . . . -94.84 17.11 59.88 Favored Glycine 0 C--N 1.333 0.363 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.514 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.87 -57.44 2.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.992 0.425 . . . . 0.0 110.272 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -48.62 161.95 0.11 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.181 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 52.8 p -73.25 -174.63 1.65 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.816 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.519 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 82.7 t -75.86 -56.3 1.74 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.227 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 7.4 Cg_endo -50.08 -28.32 19.06 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.201 1.934 . . . . 0.0 111.89 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.47 -42.35 25.48 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.026 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.461 ' CD1' HD12 ' A' ' 87' ' ' LEU . 11.9 mt -60.87 -42.65 98.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.061 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.5 mmtp -54.06 -33.71 58.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.29 178.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -55.42 31.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.919 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.11 -44.57 83.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.02 0.438 . . . . 0.0 110.378 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 86.3 m -60.89 -43.26 98.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.426 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -35.74 78.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.469 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.67 -31.51 59.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.609 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -84.22 -23.45 30.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.972 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 92.47 15.4 53.3 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.57 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.5 mt -81.21 172.98 12.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.753 0.311 . . . . 0.0 110.856 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.68 -50.07 4.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.654 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 59.0 p 45.44 -166.15 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.593 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.58 164.88 17.91 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.368 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.1 mt 76.51 118.62 0.05 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.071 0.462 . . . . 0.0 111.031 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.428 ' O ' ' HB3' ' A' ' 84' ' ' LYS . 0.3 OUTLIER 62.53 -79.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.635 179.627 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.428 ' HB3' ' O ' ' A' ' 83' ' ' LYS . 3.9 ptpt 163.68 -46.71 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.945 0.403 . . . . 0.0 110.14 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -47.24 -39.78 15.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.904 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -48.81 -36.42 16.72 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.56 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.461 HD12 ' CD1' ' A' ' 69' ' ' LEU . 9.6 mt -62.43 -51.66 66.65 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 178.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.4 HD21 ' N ' ' A' ' 62' ' ' GLY . 4.0 mp -52.35 -54.29 33.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.844 178.225 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -51.5 -49.31 62.12 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.663 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -52.41 -45.24 65.82 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.161 0.505 . . . . 0.0 109.884 179.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.61 -60.38 2.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.554 179.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.4 m -50.24 -52.96 31.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.368 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -48.88 -32.01 8.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.869 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -93.09 13.84 19.7 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.531 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . 0.486 ' CZ ' ' CG ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -145.44 -6.09 0.64 Allowed 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.914 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -73.27 122.58 22.2 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.821 0.343 . . . . 0.0 110.893 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.892 -179.946 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 12.7 tptt . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.782 0.325 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 8.3 p -73.63 -30.36 29.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.048 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 74.98 21.48 1.99 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.215 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 50.39 58.48 5.45 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.056 0.455 . . . . 0.0 110.955 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.47 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 79.8 p -72.73 -44.24 61.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.703 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 48' ' ' SER . 26.7 tt0 165.22 -45.89 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.223 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.1 -56.55 16.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.22 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.468 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.1 OUTLIER -59.1 -40.28 84.81 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 179.29 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 28.0 mt -59.04 -53.66 55.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.285 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.46 ' HD2' ' CE1' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.77 -47.28 70.87 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 121.065 0.459 . . . . 0.0 109.942 179.131 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.1 m -58.2 -42.17 85.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.697 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.468 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 12.8 m-70 -60.53 -47.76 84.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.181 179.033 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -55.51 -44.48 76.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.977 179.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 m -52.93 -73.13 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.307 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.2 mttm -62.13 -52.9 61.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.997 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 117.71 32.63 1.41 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.503 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.31 -3.14 34.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.613 0.244 . . . . 0.0 111.297 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.433 ' CB ' ' HB3' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -60.21 -23.0 63.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.723 0.297 . . . . 0.0 110.871 179.883 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -96.62 20.72 49.33 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.818 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.69 -56.64 2.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.949 0.404 . . . . 0.0 110.325 179.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -48.43 154.17 0.66 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.345 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 72.1 p -73.09 -163.05 0.13 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.623 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.518 ' HB ' ' HD3' ' A' ' 67' ' ' PRO . 11.9 t -77.41 -51.69 1.89 Allowed Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.518 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.518 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 78.5 Cg_exo -46.43 -33.15 12.2 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.271 1.98 . . . . 0.0 111.966 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 9.4 mmm -80.18 -51.18 9.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.552 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.44 ' HB3' ' CB ' ' A' ' 87' ' ' LEU . 55.8 mt -60.43 -39.31 87.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.574 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.14 -41.94 62.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.75 179.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.81 -55.15 29.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.22 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.32 -47.95 80.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.961 0.41 . . . . 0.0 110.499 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.426 ' O ' ' N ' ' A' ' 77' ' ' GLY . 31.9 m -61.41 -40.11 93.21 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.648 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.53 -35.55 80.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.944 0.402 . . . . 0.0 110.524 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.43 -43.27 70.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.854 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CE1' ' CE1' ' A' ' 94' ' ' HIS . 8.8 m-85 -84.87 -16.52 40.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.43 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.426 ' N ' ' O ' ' A' ' 73' ' ' CYS . . . 59.39 46.27 94.17 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.571 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.5 mt -84.65 14.34 4.76 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? 61.91 8.12 2.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.315 -0.402 . . . . 0.0 112.006 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.89 -168.74 1.9 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.853 0.359 . . . . 0.0 110.906 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 93.6 88.5 1.62 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.629 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -159.76 -80.19 0.05 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.79 0.329 . . . . 0.0 110.932 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.54 -69.21 0.61 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.822 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 9.4 ttmm 173.97 -81.25 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.461 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 5.0 tt0 -47.8 -29.8 3.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.177 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.73 -36.33 62.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.784 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.44 ' CB ' ' HB3' ' A' ' 69' ' ' LEU . 2.3 mt -62.29 -44.94 95.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.276 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.401 ' HB2' ' O ' ' A' ' 85' ' ' GLN . 42.4 mt -50.87 -52.89 37.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.4 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -49.73 -52.13 33.71 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.861 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -53.67 -48.28 69.61 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.941 0.4 . . . . 0.0 110.663 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.3 mt -66.86 -49.2 66.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.62 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.41 ' CG2' ' N ' ' A' ' 93' ' ' LYS . 0.6 OUTLIER -52.15 -58.71 5.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.604 179.822 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.41 ' N ' ' CG2' ' A' ' 92' ' ' THR . 3.6 ptmt -47.85 -30.48 4.11 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.261 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.5 ' CE1' ' CE1' ' A' ' 76' ' ' TYR . 37.9 t-80 -73.32 -21.54 60.54 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.411 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . 0.46 ' CE1' ' HD2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.46 43.21 1.1 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.944 0.402 . . . . 0.0 111.054 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.91 121.13 0.91 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.819 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.937 -179.951 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.2 mttp . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.837 0.351 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.5 t -73.86 -38.78 51.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.1 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 65.67 30.72 10.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.991 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 57.98 57.58 4.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.01 0.433 . . . . 0.0 110.95 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.515 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 88.0 p -73.07 -47.78 41.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.268 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.515 ' HB3' ' O ' ' A' ' 48' ' ' SER . 6.4 pt-20 166.18 -41.72 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.898 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.17 -54.78 41.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.979 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.496 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.5 OUTLIER -59.58 -43.11 93.73 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.281 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.423 ' HA ' ' CD2' ' A' ' 55' ' ' HIS . 16.5 mt -59.04 -51.61 69.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.194 178.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.588 ' O ' HG21 ' A' ' 56' ' ' ILE . 1.3 mmtt -54.2 -45.15 72.12 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-O 121.273 0.559 . . . . 0.0 110.224 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.11 -41.45 96.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.496 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 7.7 m-70 -60.75 -50.63 72.68 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.402 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.588 HG21 ' O ' ' A' ' 53' ' ' LYS . 8.7 tt -58.21 -42.35 83.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 121.064 0.459 . . . . 0.0 110.67 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.515 ' N ' HG23 ' A' ' 56' ' ' ILE . 29.7 t -54.29 -76.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.172 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 9.8 mttt -62.43 -68.86 0.29 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.023 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 141.08 39.61 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.729 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 60.7 p -101.18 -10.45 20.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.676 0.274 . . . . 0.0 111.165 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.458 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -59.09 -23.86 62.44 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.811 0.338 . . . . 0.0 110.586 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -90.58 11.99 69.86 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.414 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.1 mmtp -92.17 -54.4 3.84 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.931 0.396 . . . . 0.0 110.473 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -47.95 152.15 0.82 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.274 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 24.0 p -73.56 -166.66 0.37 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.852 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.494 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 53.2 t -76.96 -57.83 1.11 Allowed Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.437 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 5.7 Cg_endo -48.34 -29.97 14.31 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.275 1.983 . . . . 0.0 112.105 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.2 mtp -80.27 -41.45 24.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.26 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.437 ' HB3' ' CB ' ' A' ' 87' ' ' LEU . 11.9 mt -61.15 -49.86 75.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.555 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.0 mttt -51.32 -31.34 21.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.542 179.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -56.58 -53.57 56.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.796 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.83 -46.38 84.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.543 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 42.0 m -60.22 -40.67 90.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.561 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.9 ttt-85 -61.23 -36.52 80.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.51 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.3 -36.35 61.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.692 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CD2' ' CD2' ' A' ' 94' ' ' HIS . 2.9 m-30 -85.49 5.97 28.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.481 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.93 33.59 64.0 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.546 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -80.66 -170.18 2.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.798 0.332 . . . . 0.0 110.884 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.6 35.68 1.63 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.859 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.21 -162.5 0.29 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.736 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 100.95 104.98 2.75 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.487 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -160.26 -39.16 0.05 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.872 0.368 . . . . 0.0 110.97 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -157.74 -52.96 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.768 -179.924 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 83' ' ' LYS . 3.1 ttpt 175.24 -76.67 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.472 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -47.83 -29.95 3.63 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.297 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -57.54 -38.67 75.11 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.811 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.437 ' CB ' ' HB3' ' A' ' 69' ' ' LEU . 8.1 mt -62.11 -45.88 91.54 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.2 mp -50.62 -51.04 52.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.233 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -51.31 -55.14 19.93 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.831 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -51.71 -42.24 62.09 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.136 0.493 . . . . 0.0 110.014 179.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -65.96 -59.56 3.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.646 179.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.3 m -48.41 -55.07 11.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.408 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.69 -35.97 15.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.163 179.28 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.501 ' CD2' ' CD2' ' A' ' 76' ' ' TYR . 3.2 t60 -84.9 5.68 27.98 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.591 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . 0.473 ' CE1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.47 17.29 1.17 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.562 0.22 . . . . 0.0 111.164 179.934 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.64 173.2 9.33 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.8 0.333 . . . . 0.0 110.864 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.873 179.936 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.883 0.373 . . . . 0.0 111.192 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.2 t -78.65 35.37 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.963 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.441 ' O ' ' CD1' ' A' ' 47' ' ' TYR . 4.3 mm-40 -76.15 -39.0 56.01 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.891 0.377 . . . . 0.0 110.902 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.441 ' CD1' ' O ' ' A' ' 46' ' ' GLU . 65.7 m-85 -156.78 66.86 0.54 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.517 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 65.8 p -73.22 -45.83 53.86 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.012 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.419 ' O ' ' HD2' ' A' ' 53' ' ' LYS . 1.2 pt-20 166.06 -46.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.425 -179.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.93 -58.8 5.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.398 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.431 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 3.3 mm-40 -58.8 -39.53 81.4 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 50.6 mt -59.3 -53.58 56.63 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.315 178.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.722 ' HE2' ' CG ' ' A' ' 95' ' ' PHE . 0.1 OUTLIER -55.11 -46.11 75.55 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.438 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.9 m -58.53 -44.83 89.69 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.431 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 13.5 m-70 -61.65 -53.57 54.36 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.056 -0.975 . . . . 0.0 109.738 178.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 14.4 mt -57.26 -41.38 78.03 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.74 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.7 t -55.08 -74.9 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.237 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.3 mtpp -62.75 -69.39 0.26 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.007 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 145.52 37.69 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.698 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 73.9 p -100.79 -10.32 20.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.643 0.259 . . . . 0.0 111.036 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.415 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 22.8 tp -58.27 -22.45 52.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.847 0.356 . . . . 0.0 110.646 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -94.09 15.51 63.01 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.609 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.07 -56.24 3.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.95 0.405 . . . . 0.0 110.51 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -48.68 154.79 0.63 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.383 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 82.6 p -73.33 -170.51 0.8 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.584 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.503 ' HB ' ' HD3' ' A' ' 67' ' ' PRO . 65.9 t -77.89 -46.9 2.3 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.838 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.503 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 60.1 Cg_exo -50.83 -35.26 48.12 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.17 1.914 . . . . 0.0 111.972 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 34.8 mtm -79.99 -40.33 28.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.474 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.404 ' HB3' ' CB ' ' A' ' 87' ' ' LEU . 7.7 mt -60.42 -44.82 95.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.496 179.523 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.75 -34.08 37.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.666 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -57.02 -54.54 45.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.899 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -56.79 -50.12 73.29 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.993 0.425 . . . . 0.0 110.496 179.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 8.2 m -60.89 -40.01 91.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.509 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.32 -35.94 80.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.735 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.8 -29.86 40.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.901 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.498 ' CE2' ' CD2' ' A' ' 94' ' ' HIS . 3.2 m-85 -84.63 -26.95 27.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.04 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.89 25.03 23.67 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.661 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -81.21 -175.66 5.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.828 0.346 . . . . 0.0 110.905 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.02 -24.69 15.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.01 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 50.04 -176.62 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.916 0.389 . . . . 0.0 111.266 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -165.97 161.31 34.9 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.523 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 mp -80.38 -4.46 53.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.585 0.231 . . . . 0.0 111.411 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.1 2.24 28.2 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.673 -0.239 . . . . 0.0 111.57 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.9 ttmm 66.85 -73.98 0.07 Allowed 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.663 0.268 . . . . 0.0 110.962 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -47.74 -30.52 3.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.149 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -60.24 -35.57 75.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.792 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.404 ' CB ' ' HB3' ' A' ' 69' ' ' LEU . 1.5 mt -61.78 -42.32 98.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.048 0.452 . . . . 0.0 109.812 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.408 ' N ' ' CD1' ' A' ' 88' ' ' LEU . 3.9 mp -51.83 -55.63 18.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.333 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -50.55 -51.2 50.12 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.888 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -52.68 -45.1 66.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.018 0.437 . . . . 0.0 110.165 179.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.37 -57.86 5.84 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.598 179.16 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.401 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.3 m -50.44 -55.11 17.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.226 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.4 mtpt -48.05 -30.39 4.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.098 179.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.498 ' CD2' ' CE2' ' A' ' 76' ' ' TYR . 7.2 t60 -77.23 -15.9 59.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.983 -179.252 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . 0.722 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -147.19 33.11 0.89 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.782 0.325 . . . . 0.0 111.326 -179.819 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.401 ' N ' ' O ' ' A' ' 92' ' ' THR . 1.8 tp60 -72.62 118.28 15.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.861 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.912 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.5 tttt . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.798 0.332 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.451 ' CG1' ' CZ ' ' A' ' 47' ' ' TYR . 16.8 t -73.68 -50.47 29.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.062 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 76.66 69.27 0.06 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.083 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.451 ' CZ ' ' CG1' ' A' ' 45' ' ' VAL . 81.4 m-85 -81.72 67.44 7.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.729 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.488 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 0.8 OUTLIER -72.51 -54.57 8.87 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.424 179.898 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.488 ' HB3' ' O ' ' A' ' 48' ' ' SER . 1.2 pt-20 168.11 -35.04 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.129 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.97 -59.43 5.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 179.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -59.83 -38.3 81.66 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.444 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 79.5 mt -61.3 -51.3 69.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.124 178.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.489 ' HE3' ' CD1' ' A' ' 95' ' ' PHE . 16.4 tttt -55.1 -47.84 74.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.988 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 91.6 m -57.83 -42.45 84.35 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.849 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.425 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 16.7 m-70 -59.64 -48.38 81.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.814 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.6 mt -57.5 -48.96 81.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.981 179.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.0 p -53.43 -62.84 1.39 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.714 -179.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.1 mttm -60.7 -34.65 74.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.257 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 108.64 19.98 8.4 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.557 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 61.8 p -97.95 -18.21 18.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.472 0.177 . . . . 0.0 110.888 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.425 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 2.6 tm? -57.28 -36.76 71.43 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.417 ' HA2' ' HB3' ' A' ' 88' ' ' LEU . . . -90.06 51.78 3.49 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.057 178.405 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -139.56 -46.11 0.45 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.888 0.375 . . . . 0.0 110.835 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -47.07 152.85 0.5 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.53 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 30.7 p -74.12 -169.56 0.8 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.992 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.502 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 63.3 t -76.12 -57.34 1.44 Allowed Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.469 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.502 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 4.4 Cg_endo -47.34 -34.23 18.36 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.47 2.113 . . . . 0.0 112.284 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 40.8 mtm -80.2 -38.13 31.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.335 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.466 ' HB3' ' HB3' ' A' ' 87' ' ' LEU . 5.2 mt -61.31 -39.93 92.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.846 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.42 -45.75 55.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.227 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -55.52 -52.2 64.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.027 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.38 -44.2 84.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.883 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.93 -41.31 91.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.512 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.6 ttt85 -61.78 -36.12 80.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.623 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.72 -30.54 51.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.789 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.444 ' CZ ' HD11 ' A' ' 52' ' ' LEU . 3.2 m-30 -84.45 -22.26 30.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.017 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.44 12.35 61.34 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.65 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.8 mt -81.11 -176.05 5.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.759 0.314 . . . . 0.0 110.873 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.9 38.44 1.46 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.866 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.46 -173.11 2.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.839 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 126.64 162.1 11.11 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.736 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 5.1 mt 68.02 26.71 7.25 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.693 0.283 . . . . 0.0 111.413 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.49 -6.08 0.08 Allowed 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.404 ' CG ' ' CG2' ' A' ' 66' ' ' VAL . 66.5 mttm 61.75 -85.25 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.598 0.237 . . . . 0.0 110.716 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.08 -43.39 30.64 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.941 0.4 . . . . 0.0 110.957 179.722 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -47.92 -46.54 32.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.793 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.466 ' HB3' ' HB3' ' A' ' 69' ' ' LEU . 1.8 mt -61.68 -50.15 73.63 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.463 HD23 ' CD1' ' A' ' 69' ' ' LEU . 19.7 mt -51.83 -52.82 46.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.047 178.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.36 -50.86 64.16 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.656 179.256 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.41 ' HA ' ' HG2' ' A' ' 93' ' ' LYS . . . -52.35 -42.9 64.3 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.624 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.1 -56.68 11.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.472 179.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.2 m -49.3 -60.4 2.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.494 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.41 ' HG2' ' HA ' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -48.72 -29.59 4.64 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.097 179.306 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.425 ' HB3' ' CE2' ' A' ' 76' ' ' TYR . 1.8 t60 -69.31 -19.24 63.89 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.557 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . 0.489 ' CD1' ' HE3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -146.3 37.9 1.04 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.905 0.383 . . . . 0.0 110.896 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -72.52 117.27 13.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.799 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 25.1 t0 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.192 -0.909 . . . . 0.0 110.898 -179.989 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 19.0 pttp . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.767 0.318 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.9 p 42.04 33.19 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.643 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 47.89 38.76 9.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.705 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 50.27 75.85 0.16 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.461 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.498 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 83.3 p -73.99 -55.3 6.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.326 179.401 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.498 ' HB3' ' O ' ' A' ' 48' ' ' SER . 2.9 pt-20 167.49 -36.23 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.084 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -57.13 -56.48 21.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.98 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.411 ' O ' ' CD2' ' A' ' 55' ' ' HIS . 0.1 OUTLIER -60.67 -41.03 94.24 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.269 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.453 ' CD1' ' CE1' ' A' ' 76' ' ' TYR . 39.9 mt -60.12 -50.64 72.91 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.081 178.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.459 ' CE ' ' CD1' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.74 -48.83 69.27 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.126 179.053 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.0 m -59.37 -43.11 92.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.054 179.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.411 ' CD2' ' O ' ' A' ' 51' ' ' GLU . 24.8 m-70 -59.57 -48.7 80.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.969 179.189 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 16.3 mt -56.63 -48.08 81.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.903 179.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.67 -63.29 1.2 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.42 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.5 mtmt -61.04 -45.91 92.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.235 -179.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 118.36 20.48 4.32 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.702 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 40.6 p -97.57 -10.07 25.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.568 0.223 . . . . 0.0 111.059 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -58.52 -24.21 60.01 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.795 0.331 . . . . 0.0 110.176 179.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.401 ' O ' HD12 ' A' ' 88' ' ' LEU . . . -87.38 16.58 48.22 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.94 -0.647 . . . . 0.0 112.281 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.34 -46.1 6.86 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.874 0.369 . . . . 0.0 111.2 -179.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -45.45 143.87 1.69 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.27 -179.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.8 p -74.87 -172.38 1.58 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.748 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.506 ' N ' ' CD ' ' A' ' 67' ' ' PRO . 85.4 t -75.85 -44.46 3.96 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.206 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.506 ' CD ' ' N ' ' A' ' 66' ' ' VAL . 36.3 Cg_exo -60.86 -38.46 69.82 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.264 1.976 . . . . 0.0 112.15 179.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -80.03 -31.41 39.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.799 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.537 ' HB3' ' HB3' ' A' ' 87' ' ' LEU . 5.7 mt -60.97 -43.83 98.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.003 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.7 -39.46 51.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.099 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -56.13 -52.66 63.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.144 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.09 -49.42 75.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.861 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.79 -36.13 76.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.518 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -37.69 86.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.545 179.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -80.9 -30.03 35.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.894 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.453 ' CE1' ' CD1' ' A' ' 52' ' ' LEU . 2.7 m-85 -83.63 -22.25 32.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.023 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.19 21.02 53.78 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.523 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -81.49 169.94 16.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.839 0.352 . . . . 0.0 111.014 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.13 -38.06 9.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.613 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 46.21 -166.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.425 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -152.38 -118.47 0.76 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.743 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -159.3 72.79 0.56 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.935 0.398 . . . . 0.0 110.801 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -156.03 11.43 0.29 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.695 -179.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.408 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 54.4 tttt 67.43 -83.87 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.797 -179.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.403 ' HA ' HD11 ' A' ' 88' ' ' LEU . 16.1 tt0 -45.34 -40.89 8.3 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.786 0.327 . . . . 0.0 111.108 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.441 ' HA ' ' HG2' ' A' ' 89' ' ' GLU . 1.7 tp10 -57.83 -46.71 84.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.652 179.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.537 ' HB3' ' HB3' ' A' ' 69' ' ' LEU . 0.8 OUTLIER -62.87 -46.64 86.93 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 178.571 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.454 HD23 ' CD1' ' A' ' 69' ' ' LEU . 24.9 mt -53.51 -56.63 15.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.519 179.05 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.441 ' HG2' ' HA ' ' A' ' 86' ' ' GLU . 11.1 pt-20 -55.89 -44.42 78.18 Favored 'General case' 0 CA--C 1.523 -0.08 0 CA-C-O 120.831 0.348 . . . . 0.0 110.375 179.274 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -52.3 -42.08 63.47 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 121.037 0.446 . . . . 0.0 110.237 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.6 mt -64.86 -62.98 1.24 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.655 179.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 49.7 m -47.47 -53.43 14.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.483 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.76 -36.55 16.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.976 178.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 33.4 t60 -73.26 -8.28 55.15 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.738 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . 0.459 ' CD1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.36 33.47 0.88 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.818 0.342 . . . . 0.0 110.803 -179.912 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.4 112.28 0.71 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.886 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.6 t70 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.176 -0.916 . . . . 0.0 110.896 -179.985 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.1 mttp . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.754 0.312 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.4 p 41.44 32.03 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.192 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.841 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.429 ' O ' ' CD1' ' A' ' 47' ' ' TYR . 8.3 mt-10 -75.84 -44.3 41.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.816 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.44 ' CD1' HD22 ' A' ' 52' ' ' LEU . 11.9 m-85 -158.11 72.07 0.62 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.465 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.476 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 58.5 p -73.44 -53.78 9.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.615 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.476 ' HB3' ' O ' ' A' ' 48' ' ' SER . 2.5 pt-20 167.54 -39.07 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.123 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.01 -57.6 11.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.241 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.454 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.5 tp10 -59.15 -40.51 85.79 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 179.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.44 HD22 ' CD1' ' A' ' 47' ' ' TYR . 30.7 mt -59.7 -51.78 68.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.236 178.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.547 ' HD2' ' CZ ' ' A' ' 95' ' ' PHE . 37.8 tttm -53.56 -48.26 69.29 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.1 0.476 . . . . 0.0 109.835 178.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 78.4 m -56.55 -42.12 78.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.556 178.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.454 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 7.4 m-70 -60.49 -49.65 76.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.573 178.588 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.6 mt -57.45 -49.31 80.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.159 179.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.49 -70.8 0.08 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.544 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 74.6 mttt -61.01 -77.12 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.135 -179.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 151.94 35.72 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.777 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.9 p -100.89 -13.65 18.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.715 0.293 . . . . 0.0 110.93 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.427 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 14.8 tp -58.71 -26.82 64.28 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.92 0.391 . . . . 0.0 110.47 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -87.21 5.32 85.33 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.512 179.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -91.03 -54.46 3.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.983 0.42 . . . . 0.0 110.185 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -48.82 148.91 1.98 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.188 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.8 p -73.35 -166.02 0.3 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.96 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.505 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 52.4 t -75.5 -57.34 1.64 Allowed Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.056 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.505 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 4.4 Cg_endo -47.37 -27.87 7.63 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.247 1.965 . . . . 0.0 111.869 179.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -79.24 -50.16 11.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.842 179.076 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.452 ' HB3' ' HB3' ' A' ' 87' ' ' LEU . 14.4 mt -61.5 -39.04 89.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.163 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -52.25 -44.47 64.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.989 179.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -53.76 -52.11 61.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.946 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.99 -43.09 86.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.643 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -40.26 88.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.641 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.12 -35.58 79.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.795 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.08 -32.63 44.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.202 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -84.92 -28.85 25.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.2 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.83 33.81 50.04 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.53 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.39 178.16 8.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.833 0.349 . . . . 0.0 111.286 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -102.34 76.74 1.59 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.004 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 24.1 t -161.35 -163.06 0.95 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.749 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.491 ' HA2' HD22 ' A' ' 87' ' ' LEU . . . 134.8 -32.1 2.64 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.729 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mt -80.6 -73.18 0.38 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.973 0.416 . . . . 0.0 111.284 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.2 mtmm -80.45 110.16 15.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.575 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 87' ' ' LEU . 10.0 ptmm? -47.06 -52.92 13.85 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.907 179.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -49.12 -37.67 22.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.134 0.492 . . . . 0.0 110.054 179.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -70.54 -33.16 70.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.932 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.491 HD22 ' HA2' ' A' ' 81' ' ' GLY . 62.5 mt -61.8 -43.48 98.76 Favored 'General case' 0 CA--C 1.52 -0.18 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.7 mp -52.93 -60.39 3.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.28 178.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -48.72 -47.53 41.15 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.645 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.423 ' HA ' ' HG2' ' A' ' 93' ' ' LYS . . . -53.62 -46.31 70.41 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.059 0.457 . . . . 0.0 110.286 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.15 -56.13 11.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.44 179.055 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -50.04 -56.96 8.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.555 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.423 ' HG2' ' HA ' ' A' ' 90' ' ' ALA . 0.0 OUTLIER -50.05 -28.29 6.85 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.161 179.537 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.412 ' N ' ' HG3' ' A' ' 93' ' ' LYS . 3.0 t60 -89.86 5.35 46.61 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.818 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . 0.547 ' CZ ' ' HD2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -146.14 11.31 1.18 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 121.02 -0.272 . . . . 0.0 111.442 179.973 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.91 118.17 16.56 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.804 0.335 . . . . 0.0 110.881 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.4 t0 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.245 -0.884 . . . . 0.0 110.86 -179.984 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.81 0.338 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 26.5 t -74.04 -44.54 50.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.035 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.418 ' O ' ' CD1' ' A' ' 47' ' ' TYR . 2.3 tt0 -165.42 -69.72 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.132 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.422 ' CD1' HD22 ' A' ' 52' ' ' LEU . 68.9 m-85 -157.42 73.89 0.74 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.792 -179.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.511 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 35.6 p -74.12 -55.15 6.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.462 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.511 ' HB3' ' O ' ' A' ' 48' ' ' SER . 10.8 pt-20 170.25 -40.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.114 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -55.78 -55.24 34.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.962 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.464 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.9 tt0 -59.88 -41.6 91.95 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.152 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.422 HD22 ' CD1' ' A' ' 47' ' ' TYR . 30.4 mt -58.54 -53.42 58.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.205 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.473 ' HG2' ' CE2' ' A' ' 95' ' ' PHE . 0.8 OUTLIER -53.1 -47.56 68.48 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.068 0.461 . . . . 0.0 109.888 179.105 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.0 m -58.7 -44.76 90.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.615 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.464 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 12.8 m-70 -59.26 -50.82 72.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.815 178.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 40.9 mt -57.18 -46.26 84.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.98 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.5 m -52.45 -73.91 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.511 -179.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp -61.35 -69.01 0.26 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.956 -179.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 143.44 37.29 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.658 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 19.3 p -100.92 -13.69 18.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.545 0.212 . . . . 0.0 111.015 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.438 ' N ' ' HB3' ' A' ' 55' ' ' HIS . 14.5 tp -59.07 -32.06 69.44 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.009 0.433 . . . . 0.0 110.236 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -80.16 6.15 60.81 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.73 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.31 -50.29 6.21 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 120.927 0.394 . . . . 0.0 110.403 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -49.11 149.22 2.06 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.348 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 31.5 p -73.71 -162.86 0.14 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.663 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.48 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 24.6 t -75.67 -59.17 1.26 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.884 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 5.4 Cg_endo -47.48 -29.39 10.11 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.275 1.984 . . . . 0.0 111.877 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -79.69 -44.84 20.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.89 179.183 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.528 ' HB3' ' HB3' ' A' ' 87' ' ' LEU . 15.9 mt -61.32 -48.87 79.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.129 179.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.6 mmmt -52.64 -34.11 49.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.298 179.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -56.3 -55.84 28.39 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.855 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.63 -45.55 85.27 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.994 0.426 . . . . 0.0 110.317 179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 91.3 m -60.59 -43.12 97.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.239 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -35.08 78.36 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.546 179.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.19 -37.93 72.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.741 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.404 ' OH ' ' CE2' ' A' ' 95' ' ' PHE . 2.6 m-85 -83.88 -23.28 31.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.132 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.3 24.21 29.62 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.341 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.4 mt -81.17 -174.27 4.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.788 0.327 . . . . 0.0 110.989 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.16 71.3 1.39 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.063 0.459 . . . . 0.0 110.505 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.0 m -76.52 -170.9 1.65 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.024 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.413 ' O ' ' CD1' ' A' ' 82' ' ' LEU . . . -116.69 -129.04 4.26 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.691 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.436 ' HA ' HD11 ' A' ' 82' ' ' LEU . 2.5 mm? -147.03 9.8 0.99 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.498 0.189 . . . . 0.0 111.143 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.5 tptm -84.04 6.0 23.78 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.599 0.238 . . . . 0.0 111.23 179.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.7 mtmm 72.13 -78.34 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.518 -179.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -51.1 -32.15 21.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.901 0.381 . . . . 0.0 111.008 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -64.16 -40.03 95.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.919 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.528 ' HB3' ' HB3' ' A' ' 69' ' ' LEU . 1.2 mt -61.11 -42.78 99.16 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 179.314 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -50.72 -53.65 29.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.502 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -50.85 -53.23 34.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.872 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -53.24 -43.29 67.2 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.133 0.492 . . . . 0.0 110.261 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.11 -58.11 6.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.264 179.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.426 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.9 m -50.74 -59.13 4.41 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.018 179.701 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.4 tptm -47.63 -31.51 4.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.235 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -75.33 -44.19 46.65 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.367 -179.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . 0.473 ' CE2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -92.81 3.68 55.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.623 -179.641 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' A' ' 92' ' ' THR . 1.4 tp-100 -73.02 143.1 47.65 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.788 0.328 . . . . 0.0 110.726 179.746 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.872 -179.988 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.798 0.332 . . . . 0.0 111.13 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.45 ' CG2' ' CE1' ' A' ' 47' ' ' TYR . 11.5 p -74.25 60.61 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.027 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -77.22 -41.06 42.76 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.232 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.45 ' CE1' ' CG2' ' A' ' 45' ' ' VAL . 5.3 m-30 65.7 120.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.253 0.549 . . . . 0.0 110.251 -179.189 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.8 p -163.61 -33.11 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.218 -179.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.469 ' HG2' ' CE2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER 169.07 -56.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.287 179.576 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.0 -53.79 44.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.695 0.284 . . . . 0.0 110.835 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.418 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.1 tp10 -61.11 -40.77 95.02 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.449 HD21 ' CB ' ' A' ' 72' ' ' ALA . 45.2 mt -59.7 -52.33 65.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.182 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.465 ' HG2' ' CE2' ' A' ' 95' ' ' PHE . 1.2 mmtp -52.76 -47.97 67.11 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.016 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.8 m -57.23 -45.7 83.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.271 178.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.418 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 12.9 m-70 -60.94 -52.93 62.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.828 178.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 24.7 mt -57.75 -38.45 65.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.057 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.4 t -52.31 -75.21 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.408 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -61.52 -70.48 0.19 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.946 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 150.53 34.93 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.774 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.8 p -101.96 -15.07 16.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.742 0.306 . . . . 0.0 111.022 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.43 ' HA ' ' CE2' ' A' ' 64' ' ' PHE . 2.8 tm? -58.57 -26.72 63.9 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.895 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.406 ' HA2' ' CG ' ' A' ' 88' ' ' LEU . . . -93.09 2.56 71.95 Favored Glycine 0 C--N 1.33 0.242 0 C-N-CA 120.766 -0.731 . . . . 0.0 113.034 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.5 mtmm -91.87 -38.67 12.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.929 0.395 . . . . 0.0 110.586 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.43 ' CE2' ' HA ' ' A' ' 61' ' ' LEU . 28.6 m-85 -47.08 152.66 0.52 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.511 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.64 -171.56 1.06 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.014 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.486 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 69.2 t -75.83 -58.25 1.38 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.696 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.486 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 9.3 Cg_endo -52.31 -28.32 34.17 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.047 1.831 . . . . 0.0 111.489 179.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.7 mtm -79.57 -45.94 18.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.9 179.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.452 ' CB ' ' CD1' ' A' ' 87' ' ' LEU . 27.2 mt -61.67 -44.05 97.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.346 179.175 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.71 -36.38 46.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.732 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -55.51 -53.1 60.52 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.637 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.449 ' CB ' HD21 ' A' ' 52' ' ' LEU . . . -58.05 -44.92 87.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.575 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.7 m -58.83 -40.69 84.96 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.935 179.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.79 -36.53 83.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.191 179.127 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.68 -32.56 65.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.642 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.481 ' CD1' ' CE1' ' A' ' 94' ' ' HIS . 1.5 m-85 -82.92 -34.21 26.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.773 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 97.61 15.63 36.73 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.584 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.41 159.83 24.2 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.794 0.331 . . . . 0.0 110.891 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.49 28.19 6.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.161 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.75 -173.38 3.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.874 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.409 ' O ' ' HB2' ' A' ' 82' ' ' LEU . . . 117.0 -145.67 18.73 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.767 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 81' ' ' GLY . 5.2 mt 68.3 -67.77 0.19 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.022 0.439 . . . . 0.0 110.847 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -83.73 -95.63 0.06 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.909 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.44 -61.34 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.9 0.381 . . . . 0.0 109.995 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.433 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.2 OUTLIER -55.13 -46.61 75.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.702 179.128 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -44.13 -35.85 2.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.073 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.452 ' CD1' ' CB ' ' A' ' 69' ' ' LEU . 15.9 mt -63.04 -43.93 97.32 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 85' ' ' GLN . 1.8 mp -51.76 -55.4 19.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.161 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.54 -52.13 41.58 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.817 179.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -52.68 -42.7 65.0 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 121.188 0.518 . . . . 0.0 110.055 179.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.19 -60.32 2.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.48 178.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.1 m -50.03 -54.95 16.82 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.273 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 30.6 mttm -49.61 -33.06 14.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.035 179.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.481 ' CE1' ' CD1' ' A' ' 76' ' ' TYR . 2.1 t-160 -83.89 1.1 44.92 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.676 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . 0.469 ' CE2' ' HG2' ' A' ' 49' ' ' GLU . 0.1 OUTLIER -148.75 22.4 1.0 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.749 0.309 . . . . 0.0 111.05 179.751 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.17 174.33 7.33 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.891 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.944 179.995 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.833 0.349 . . . . 0.0 111.186 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.8 t -73.62 -38.58 52.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.018 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 67.85 14.03 9.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.428 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.448 ' CD2' ' HB3' ' A' ' 71' ' ' GLU . 30.2 m-85 52.82 83.34 0.06 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.046 0.451 . . . . 0.0 111.031 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 90.5 p -74.02 -52.65 12.07 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.661 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.427 ' HG3' ' CE1' ' A' ' 76' ' ' TYR . 3.4 mt-10 164.31 -36.45 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.348 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -60.16 3.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.258 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.472 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.2 OUTLIER -58.72 -40.48 83.85 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.402 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.491 HD12 ' CZ ' ' A' ' 76' ' ' TYR . 68.1 mt -59.47 -51.89 67.96 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.247 178.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.435 ' HD2' ' CE1' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.5 -48.09 69.27 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.152 0.501 . . . . 0.0 109.872 179.115 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.2 m -57.8 -42.24 83.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.708 178.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.472 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 8.4 m-70 -60.07 -48.94 79.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.916 178.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 55.6 mt -57.24 -47.72 83.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.143 179.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -53.08 -73.76 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.542 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.83 -70.81 0.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.279 -179.441 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 144.34 36.18 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.868 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.88 -10.49 21.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.705 0.288 . . . . 0.0 110.898 179.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.42 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 28.8 tp -59.05 -21.27 58.85 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.829 0.347 . . . . 0.0 110.507 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -90.77 16.86 57.23 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.435 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.8 mtpt -89.66 -47.25 8.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.008 0.433 . . . . 0.0 110.356 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -48.17 153.41 0.7 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.489 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 55.0 m -74.94 -81.62 0.07 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.602 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.481 ' HB ' ' CD ' ' A' ' 67' ' ' PRO . 3.8 t -160.42 -64.84 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.131 -178.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.481 ' CD ' ' HB ' ' A' ' 66' ' ' VAL . 10.2 Cg_endo -50.63 -26.11 16.29 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.264 1.976 . . . . 0.0 110.912 178.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.7 mtm -78.6 -43.2 26.98 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.535 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.467 ' HB3' ' HB3' ' A' ' 87' ' ' LEU . 19.8 mt -62.63 -44.34 96.54 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.457 179.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.3 mmtt -51.3 -34.56 33.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.656 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.448 ' HB3' ' CD2' ' A' ' 47' ' ' TYR . 2.3 tp10 -55.8 -55.44 32.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.799 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.94 88.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.96 0.41 . . . . 0.0 110.36 179.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 80.5 m -60.4 -40.94 92.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.248 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.6 ttm-85 -61.69 -36.9 82.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.133 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.43 -28.52 56.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.541 179.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.491 ' CZ ' HD12 ' A' ' 52' ' ' LEU . 3.3 m-85 -83.02 -32.6 26.81 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.705 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.67 16.71 59.58 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.62 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.0 mt -81.85 -165.61 1.02 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.877 0.37 . . . . 0.0 111.115 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -133.96 74.98 1.57 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.321 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.406 ' CB ' ' HA ' ' A' ' 87' ' ' LEU . 4.3 p -74.54 -176.44 2.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.288 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -113.18 165.52 12.05 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.842 -179.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -81.83 1.38 35.12 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.07 -75.54 0.24 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.721 0.296 . . . . 0.0 110.686 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 166.82 -71.41 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.593 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -51.06 -30.76 16.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.852 0.358 . . . . 0.0 111.106 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -58.92 -39.68 82.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.746 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.467 ' HB3' ' HB3' ' A' ' 69' ' ' LEU . 1.1 mt -61.58 -43.94 97.94 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.0 mp -51.78 -53.91 34.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.134 178.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -50.23 -53.15 30.2 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.867 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -51.89 -44.01 63.58 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.145 0.498 . . . . 0.0 110.341 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.39 -57.15 7.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.352 178.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.2 m -50.46 -56.64 10.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.544 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.52 -31.06 9.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.052 179.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 19.1 t60 -75.76 -9.28 58.46 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.655 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . 0.435 ' CE1' ' HD2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.21 29.98 0.95 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.862 0.363 . . . . 0.0 110.955 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -72.85 178.53 4.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.807 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.9 t0 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.845 179.945 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.426 ' O ' ' CG2' ' A' ' 45' ' ' VAL . 10.7 tptt . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.778 0.323 . . . . 0.0 111.126 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.426 ' CG2' ' O ' ' A' ' 44' ' ' LYS . 61.6 t -159.97 76.34 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.583 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -75.69 -35.03 60.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.021 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -81.71 64.08 6.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.899 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.12 -46.74 40.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.719 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 166.91 -43.02 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.386 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.1 -55.97 25.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.016 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.457 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 3.5 tt0 -59.72 -40.89 89.51 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.128 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.412 ' CD2' ' CD2' ' A' ' 91' ' ' LEU . 26.8 mt -59.24 -52.81 64.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.245 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.612 ' O ' HG21 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -53.89 -46.38 71.38 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 121.256 0.551 . . . . 0.0 110.126 179.2 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.9 m -59.48 -43.53 93.26 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.457 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 11.1 m-70 -60.49 -51.65 68.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.99 178.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.612 HG21 ' O ' ' A' ' 53' ' ' LYS . 8.8 tt -58.54 -44.85 90.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-O 120.841 0.353 . . . . 0.0 110.617 179.48 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.434 ' N ' HG23 ' A' ' 56' ' ' ILE . 68.2 m -56.59 -63.48 1.18 Allowed 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.869 179.626 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.403 ' N ' ' CD ' ' A' ' 58' ' ' LYS . 8.9 mptt -62.19 -50.52 71.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.953 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.8 23.63 4.59 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.495 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 38.2 p -101.07 1.08 39.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.498 0.19 . . . . 0.0 111.512 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.414 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 47.5 tp -59.63 -26.85 65.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.778 0.323 . . . . 0.0 110.923 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -92.87 12.89 68.92 Favored Glycine 0 CA--C 1.518 0.267 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.738 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -91.67 -51.55 5.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.851 0.358 . . . . 0.0 110.676 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -46.78 158.11 0.13 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.166 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 26.4 p -72.84 -167.83 0.41 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.886 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.462 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 55.9 t -76.76 -59.58 0.95 Allowed Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.209 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.496 ' HA ' ' CD ' ' A' ' 70' ' ' LYS . 3.8 Cg_endo -46.42 -29.68 7.42 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.526 2.151 . . . . 0.0 112.144 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 29.4 mtm -79.2 -44.72 21.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.167 0.508 . . . . 0.0 109.993 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.446 ' HB3' ' CB ' ' A' ' 87' ' ' LEU . 29.6 mt -64.73 -55.64 18.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.071 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.496 ' CD ' ' HA ' ' A' ' 67' ' ' PRO . 0.0 OUTLIER -51.19 -27.3 8.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.748 0.309 . . . . 0.0 110.784 179.865 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -57.53 -53.05 62.54 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.586 179.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -59.01 -48.32 82.0 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.986 0.422 . . . . 0.0 110.357 179.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 90.8 m -61.33 -40.73 95.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.666 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -61.77 -36.22 80.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.675 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.19 -44.87 64.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.611 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -88.71 10.02 22.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.574 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.37 44.67 76.56 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.86 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -81.33 -177.95 6.71 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.827 0.346 . . . . 0.0 110.919 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.44 -43.87 7.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.826 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.2 p 45.99 -164.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.367 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.405 ' N ' ' HB3' ' A' ' 86' ' ' GLU . . . -137.88 -108.71 0.86 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.727 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -160.49 -31.35 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -65.96 0.88 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.689 0.281 . . . . 0.0 111.205 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 173.36 -64.57 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.102 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -46.9 -34.89 5.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.876 0.37 . . . . 0.0 111.189 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.405 ' HB3' ' N ' ' A' ' 81' ' ' GLY . 3.7 mm-40 -59.91 -44.57 94.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.565 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.446 ' CB ' ' HB3' ' A' ' 69' ' ' LEU . 1.3 mt -61.78 -43.04 99.64 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.8 mt -50.64 -50.99 53.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.425 178.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -51.05 -54.61 23.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.105 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.448 ' O ' ' HG3' ' A' ' 93' ' ' LYS . . . -55.12 -43.4 74.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.95 0.405 . . . . 0.0 110.909 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.412 ' CD2' ' CD2' ' A' ' 52' ' ' LEU . 0.8 OUTLIER -69.12 -49.02 60.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.498 179.438 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.402 ' CG2' ' N ' ' A' ' 93' ' ' LYS . 0.7 OUTLIER -52.4 -61.32 2.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.711 -179.988 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 0.0 OUTLIER -48.87 -28.38 3.72 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.731 0.301 . . . . 0.0 111.058 179.557 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 -72.89 -23.6 60.74 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.262 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . 0.478 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.06 45.13 1.08 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.889 0.376 . . . . 0.0 111.014 -179.856 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -167.36 98.91 0.51 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.937 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.956 -179.99 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.423 ' O ' ' CG2' ' A' ' 45' ' ' VAL . 19.8 mtmt . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.792 0.329 . . . . 0.0 111.141 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.423 ' CG2' ' O ' ' A' ' 44' ' ' LYS . 52.7 t -160.15 -53.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.547 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 75.59 9.15 3.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.343 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 51.04 63.73 2.12 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.987 0.422 . . . . 0.0 111.128 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.503 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 91.2 p -72.28 -52.83 14.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.283 179.642 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.503 ' HB3' ' O ' ' A' ' 48' ' ' SER . 1.8 pt-20 165.4 -34.68 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.009 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -60.13 4.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.062 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.431 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.1 OUTLIER -59.23 -39.75 83.71 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.251 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.439 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 22.3 mt -60.21 -51.56 69.07 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.155 178.767 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.484 ' CE ' ' CD1' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.72 -48.39 69.65 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.86 179.045 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.1 m -57.89 -45.09 86.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.605 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.431 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 14.8 m-70 -59.56 -51.01 71.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.808 178.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 20.3 mt -56.84 -45.12 83.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.844 179.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.4 m -52.94 -70.74 0.08 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.352 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.6 mttp -61.56 -79.75 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.029 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 157.49 33.26 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.885 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 17.0 p -102.77 -12.46 17.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.734 0.302 . . . . 0.0 111.037 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.425 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 3.1 tm? -59.65 -27.09 66.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.802 0.334 . . . . 0.0 110.81 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -90.22 11.13 71.98 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.755 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.74 -47.01 7.59 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.879 0.371 . . . . 0.0 110.557 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -47.43 146.6 1.99 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.388 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 32.6 p -73.71 -169.84 0.77 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.118 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.512 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 78.8 t -76.4 -56.24 1.54 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.507 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.512 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 5.5 Cg_endo -48.29 -35.94 28.53 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.341 2.027 . . . . 0.0 112.233 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 26.9 mtp -81.69 -34.34 30.72 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.78 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.424 ' HB3' ' CB ' ' A' ' 87' ' ' LEU . 7.5 mt -63.04 -52.89 61.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.572 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.473 ' CD ' ' HA ' ' A' ' 67' ' ' PRO . 0.5 OUTLIER -49.45 -29.87 7.22 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.868 0.366 . . . . 0.0 111.026 -179.663 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.413 ' N ' ' HG2' ' A' ' 70' ' ' LYS . 2.0 tt0 -57.32 -55.34 36.08 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.357 179.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.91 -40.2 83.81 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.29 179.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 7.7 m -60.12 -40.58 90.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.391 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.94 -36.43 81.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.466 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.87 -32.74 59.84 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.63 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.499 ' CD2' ' CG ' ' A' ' 94' ' ' HIS . 3.2 m-30 -84.17 -23.91 30.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.971 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 82.36 23.76 55.87 Favored Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.492 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.4 mt -81.81 170.48 15.65 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.922 0.392 . . . . 0.0 111.155 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -111.47 81.16 1.4 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.76 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -159.5 -171.22 3.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.084 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.401 ' HA2' ' CD2' ' A' ' 87' ' ' LEU . . . 109.38 48.54 0.8 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.667 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -158.51 19.24 0.22 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.586 0.232 . . . . 0.0 111.576 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.15 6.49 0.1 Allowed 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 16.5 ttpp 69.13 -82.4 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.604 0.24 . . . . 0.0 110.895 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.455 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 34.1 tt0 -49.04 -45.38 42.65 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.897 0.379 . . . . 0.0 111.249 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.28 -39.38 14.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.902 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.424 ' CB ' ' HB3' ' A' ' 69' ' ' LEU . 1.7 mt -62.57 -43.93 97.58 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.27 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.455 ' HB2' ' O ' ' A' ' 85' ' ' GLN . 1.2 mp -51.97 -53.55 40.09 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.139 178.79 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -50.79 -52.97 35.83 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.812 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -52.85 -43.83 66.34 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.02 0.438 . . . . 0.0 110.496 179.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.29 -54.87 19.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.425 179.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.401 ' CG2' ' NE2' ' A' ' 96' ' ' GLN . 0.9 OUTLIER -50.58 -59.41 4.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.373 179.802 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.5 ptmm? -48.24 -31.2 5.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.214 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.499 ' CG ' ' CD2' ' A' ' 76' ' ' TYR . 51.3 t-80 -74.26 -17.9 60.8 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.712 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . 0.484 ' CD1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -146.87 38.04 0.99 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.945 0.402 . . . . 0.0 110.855 -179.831 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.401 ' NE2' ' CG2' ' A' ' 92' ' ' THR . 1.7 tt0 -72.31 -167.05 0.29 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.876 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.4 t70 . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.895 179.945 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.2 ptpt . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.495 0.188 . . . . 0.0 111.099 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.425 HG22 ' CZ ' ' A' ' 47' ' ' TYR . 13.2 p 43.24 30.27 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.14 0 CA-C-O 120.996 0.427 . . . . 0.0 111.375 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.97 -33.89 59.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.087 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.425 ' CZ ' HG22 ' A' ' 45' ' ' VAL . 28.0 m-85 59.13 46.4 13.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.988 0.423 . . . . 0.0 110.718 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.405 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 1.1 p -72.05 -42.83 65.81 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.637 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.405 ' CB ' ' O ' ' A' ' 48' ' ' SER . 3.4 mt-10 163.79 -43.94 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.536 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.0 -56.28 21.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.173 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.455 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.0 OUTLIER -60.02 -40.33 88.94 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.327 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.439 HD12 ' CZ ' ' A' ' 76' ' ' TYR . 19.8 mt -59.9 -51.73 68.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.247 178.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.459 ' HG2' ' CD2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -54.07 -47.84 71.25 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-O 121.073 0.463 . . . . 0.0 109.938 179.071 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.5 m -57.81 -42.61 84.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.685 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.455 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 11.7 m-70 -59.61 -49.29 78.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.829 178.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 6.9 mt -57.36 -48.36 82.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.988 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 2.4 m -53.78 -63.54 1.12 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.54 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 30.4 mttm -60.85 -46.45 90.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.254 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 116.98 20.78 4.76 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.692 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 21.8 p -97.87 -8.44 28.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.613 0.244 . . . . 0.0 111.047 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.454 ' O ' ' CD2' ' A' ' 88' ' ' LEU . 3.4 tm? -58.87 -29.37 66.94 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.654 0.264 . . . . 0.0 110.378 179.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.407 ' HA2' ' HB3' ' A' ' 88' ' ' LEU . . . -85.0 10.67 62.29 Favored Glycine 0 CA--C 1.52 0.387 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.536 179.52 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -95.48 -40.71 9.33 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.781 0.324 . . . . 0.0 111.641 -179.547 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -44.74 144.74 1.06 Allowed 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -179.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.405 ' O ' ' CD1' ' A' ' 69' ' ' LEU . 15.8 p -74.24 -171.68 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.54 179.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.501 ' HB ' ' HD3' ' A' ' 67' ' ' PRO . 70.6 t -76.81 -46.23 3.0 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.65 -179.625 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.501 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 39.6 Cg_exo -60.42 -30.28 90.54 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.13 1.887 . . . . 0.0 111.952 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' MET . . . . . 0.404 ' HE1' ' N ' ' A' ' 68' ' ' MET . 0.0 OUTLIER -81.45 -39.15 25.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.301 179.656 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.547 ' HB3' ' HB3' ' A' ' 87' ' ' LEU . 11.5 mt -61.01 -40.96 95.53 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.147 179.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -52.33 -42.0 63.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.949 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.39 -53.52 56.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.411 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -56.26 -50.36 71.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.942 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -59.58 -37.43 78.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.194 179.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -62.46 -37.74 87.08 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.161 179.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.88 -27.99 49.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.744 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.439 ' CZ ' HD12 ' A' ' 52' ' ' LEU . 2.8 m-30 -82.09 -37.94 25.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.939 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 100.75 18.19 21.29 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.923 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 21.0 mt -81.15 -166.71 1.21 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.696 0.284 . . . . 0.0 110.737 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.428 ' O ' ' O ' ' A' ' 80' ' ' SER . 0.2 OUTLIER -96.26 -43.85 7.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.774 179.813 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.428 ' O ' ' O ' ' A' ' 79' ' ' LYS . 0.0 OUTLIER 57.71 138.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.434 179.527 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.415 ' O ' ' HB2' ' A' ' 82' ' ' LEU . . . 147.17 -165.93 28.55 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.231 -0.985 . . . . 0.0 113.086 179.57 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 81' ' ' GLY . 4.7 mp 68.83 -67.4 0.21 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.961 0.41 . . . . 0.0 110.793 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.65 152.85 16.43 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.248 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.37 -54.61 5.68 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.895 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -46.19 -43.65 15.4 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.014 0.435 . . . . 0.0 110.3 179.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -60.91 -42.2 97.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.504 178.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.547 ' HB3' ' HB3' ' A' ' 69' ' ' LEU . 26.6 mt -62.72 -54.25 42.12 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 178.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.454 ' CD2' ' O ' ' A' ' 61' ' ' LEU . 4.3 mt -53.44 -52.07 60.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.679 178.369 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.37 -49.21 70.36 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.572 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -51.83 -42.69 62.75 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 121.128 0.49 . . . . 0.0 110.01 179.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.82 -62.46 1.55 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.247 178.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 18.0 m -49.55 -57.51 6.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.101 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -47.06 -30.8 2.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.138 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -65.83 -52.92 46.45 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.627 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . 0.459 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -90.91 -9.82 44.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.799 -179.386 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -73.3 64.18 0.78 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.863 0.363 . . . . 0.0 110.908 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.017 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.824 0.345 . . . . 0.0 111.161 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 22.0 t -74.53 62.47 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.165 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -75.75 -58.79 3.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.859 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -81.88 68.43 8.25 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.729 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.55 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 78.9 p -71.18 -55.54 7.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.424 179.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.55 ' HB3' ' O ' ' A' ' 48' ' ' SER . 4.6 pt-20 170.38 -37.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.446 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -57.46 -55.28 36.9 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.703 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.444 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 2.1 tt0 -61.35 -41.56 97.25 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.006 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.433 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 43.3 mt -59.65 -50.58 73.29 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.14 178.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.47 ' HG2' ' CD2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -52.58 -49.86 64.16 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.011 178.957 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 94.5 m -59.3 -42.42 91.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.012 179.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.444 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 12.5 m-70 -58.44 -50.04 75.13 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 36.8 mt -58.27 -56.86 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.514 178.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.9 p -67.36 46.59 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.117 179.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -175.6 -58.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.744 0.307 . . . . 0.0 111.019 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 125.25 24.2 1.65 Allowed Glycine 0 CA--C 1.518 0.257 0 C-N-CA 120.659 -0.782 . . . . 0.0 113.036 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.7 -11.92 20.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.599 0.238 . . . . 0.0 111.097 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.415 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 17.8 tp -58.81 -22.61 58.87 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.815 0.34 . . . . 0.0 110.602 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -91.05 19.37 46.62 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.343 179.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.41 -58.34 2.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.037 0.446 . . . . 0.0 110.214 179.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -49.54 152.32 1.4 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.397 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 22.4 p -74.14 -167.09 0.47 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.881 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.5 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 55.3 t -77.14 -57.42 1.12 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.276 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 6.2 Cg_endo -48.89 -31.42 19.95 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.358 2.039 . . . . 0.0 112.139 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 45.8 mtm -79.46 -39.54 31.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.249 179.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.464 ' HB3' ' CB ' ' A' ' 87' ' ' LEU . 8.8 mt -61.12 -39.69 90.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.631 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.418 ' N ' HD21 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -52.74 -36.77 58.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.891 179.725 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -55.52 -52.49 63.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.925 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.58 -42.85 83.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.731 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 8.8 m -59.84 -38.91 83.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.681 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 mtt-85 -62.07 -36.33 81.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.671 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -81.14 -29.89 34.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.082 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CD2' ' CG ' ' A' ' 94' ' ' HIS . 2.8 m-30 -84.82 -25.64 27.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.105 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.59 21.73 49.88 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.592 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.8 mt -81.27 -175.93 5.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.866 0.365 . . . . 0.0 110.961 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.2 tmtt? -97.47 -40.35 8.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.029 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 69.68 173.52 0.3 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.768 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -138.23 -130.27 2.78 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.588 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 12.3 mt -159.18 53.1 0.39 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.004 0.43 . . . . 0.0 110.744 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.15 10.16 0.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.803 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 75.03 -71.94 0.12 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.816 0.341 . . . . 0.0 110.755 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -47.33 -34.81 7.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.405 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -62.04 -45.29 94.24 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.057 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.464 ' CB ' ' HB3' ' A' ' 69' ' ' LEU . 1.2 mt -60.96 -42.62 98.63 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.8 mt -52.61 -53.28 48.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.273 178.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.78 -52.47 40.54 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.799 179.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -53.12 -45.03 68.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.005 0.431 . . . . 0.0 110.52 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.1 mt -66.52 -53.8 30.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.347 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -51.5 -60.49 3.08 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.448 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.422 ' HG3' ' N ' ' A' ' 94' ' ' HIS . 1.6 pttt -48.12 -28.96 3.21 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.801 0.334 . . . . 0.0 110.975 179.48 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.5 ' CG ' ' CD2' ' A' ' 76' ' ' TYR . 27.5 t-80 -67.54 -58.49 4.62 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.673 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . 0.47 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -95.82 22.4 7.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.256 179.887 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -72.13 141.06 49.14 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.809 0.338 . . . . 0.0 110.72 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.877 -179.933 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.438 ' O ' ' CG2' ' A' ' 45' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.668 0.27 . . . . 0.0 111.194 . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.438 ' CG2' ' O ' ' A' ' 44' ' ' LYS . 63.4 t -160.49 84.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.667 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -75.38 -6.8 51.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.379 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.413 ' CD2' ' HB3' ' A' ' 71' ' ' GLU . 25.7 m-85 65.68 57.06 0.87 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.017 0.436 . . . . 0.0 110.811 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.518 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 5.6 p -72.4 -53.13 13.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.356 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.518 ' HB3' ' O ' ' A' ' 48' ' ' SER . 2.8 pt-20 169.01 -35.03 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.207 179.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.52 -58.29 8.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.812 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.45 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -60.07 -41.59 92.74 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.208 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 14.0 mt -60.36 -49.52 77.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.013 178.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.452 ' HG2' ' CD2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.29 -49.27 67.32 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.096 179.208 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.52 -44.76 89.65 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.553 179.032 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.45 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 8.1 m-70 -60.13 -51.12 70.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.815 178.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.7 mt -56.66 -45.49 82.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.939 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -53.61 -73.96 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.221 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 48.3 mttt -62.18 -75.56 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.078 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 149.77 37.71 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.738 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.2 p -100.89 -8.81 22.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.656 0.265 . . . . 0.0 111.066 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.405 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 16.1 tp -58.79 -23.77 60.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.812 0.339 . . . . 0.0 110.694 179.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -91.42 14.07 64.82 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.367 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.2 tttt -92.28 -55.81 3.28 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.934 0.397 . . . . 0.0 110.407 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -48.0 154.54 0.53 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.307 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.3 p -73.67 -167.32 0.45 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.929 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.493 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 56.0 t -77.03 -57.94 1.08 Allowed Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.256 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 5.2 Cg_endo -47.83 -30.25 12.9 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.34 2.026 . . . . 0.0 112.054 179.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 33.1 mtm -80.33 -46.88 15.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.271 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.467 ' HB3' ' CB ' ' A' ' 87' ' ' LEU . 36.1 mt -61.14 -46.11 91.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.449 179.381 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.95 -32.1 31.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.54 179.272 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.413 ' HB3' ' CD2' ' A' ' 47' ' ' TYR . 0.0 OUTLIER -56.76 -54.92 40.71 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.891 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.12 -46.9 82.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.974 0.416 . . . . 0.0 110.372 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 57.3 m -61.01 -44.06 97.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.338 179.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.1 mmt180 -63.15 -34.3 77.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.67 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.86 -38.08 73.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.846 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.503 ' CD1' ' CE1' ' A' ' 94' ' ' HIS . 4.5 m-85 -84.28 -28.63 27.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.035 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.94 26.57 11.33 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.605 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -81.09 176.41 9.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.793 0.33 . . . . 0.0 110.912 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.92 -33.07 11.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.799 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.9 p 48.33 -173.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.418 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -124.92 160.4 19.55 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.47 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 35.4 mt -80.85 -4.5 54.98 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -80.38 -73.55 0.36 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.677 0.275 . . . . 0.0 110.768 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 167.84 -67.32 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.978 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.0 OUTLIER -54.5 -38.13 66.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.041 0.448 . . . . 0.0 110.681 179.76 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -45.13 -31.64 1.5 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.432 -179.065 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.467 ' CB ' ' HB3' ' A' ' 69' ' ' LEU . 2.3 mt -62.46 -40.72 97.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.099 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' A' ' 85' ' ' GLN . 5.1 mp -50.92 -53.64 30.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.38 178.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -49.74 -54.52 18.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.956 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -51.49 -44.54 62.52 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.199 0.524 . . . . 0.0 110.121 179.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.75 -58.2 5.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.755 179.16 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.416 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.3 m -49.35 -53.95 19.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.298 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.92 -31.12 4.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.12 179.264 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.503 ' CE1' ' CD1' ' A' ' 76' ' ' TYR . 2.5 t60 -76.44 -16.55 59.66 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.704 -179.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . 0.452 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -146.78 36.12 0.95 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.819 0.343 . . . . 0.0 110.998 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.416 ' N ' ' O ' ' A' ' 92' ' ' THR . 2.8 pt20 -77.89 24.13 0.24 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.985 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.904 179.979 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.584 ' HB3' HD21 ' A' ' 52' ' ' LEU . 27.6 m-85 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.987 0.423 . . . . 0.0 110.811 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.415 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 0.7 OUTLIER -71.82 -42.13 67.38 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.336 179.502 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.861 ' HA ' HD12 ' A' ' 52' ' ' LEU . 0.4 OUTLIER 163.11 -42.84 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.367 179.84 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.2 -58.7 6.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.311 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.449 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.4 tp10 -58.88 -39.1 80.4 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.861 HD12 ' HA ' ' A' ' 49' ' ' GLU . 22.1 mt -60.2 -52.94 63.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.222 178.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.523 ' HG2' ' CE2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.56 -48.21 69.35 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-O 121.033 0.444 . . . . 0.0 109.952 179.168 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.7 m -59.39 -45.6 91.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.954 179.039 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.477 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 15.3 m-70 -59.59 -49.07 79.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.258 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.711 HG13 HD12 ' A' ' 61' ' ' LEU . 58.7 mt -55.29 -40.56 57.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.946 179.553 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.4 t -53.26 -77.01 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.347 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -49.28 77.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.29 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 118.67 31.84 1.42 Allowed Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.743 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.478 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 2.9 m -98.25 -6.23 31.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.587 0.232 . . . . 0.0 111.099 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.757 ' C ' HD11 ' A' ' 88' ' ' LEU . 0.6 OUTLIER -59.86 -22.46 62.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.874 0.369 . . . . 0.0 110.337 179.352 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.501 ' N ' HD11 ' A' ' 88' ' ' LEU . . . -90.77 22.44 28.17 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.846 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 60' ' ' THR . 0.2 OUTLIER -90.4 -54.87 3.82 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.107 0.48 . . . . 0.0 109.987 179.47 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -49.42 158.27 0.43 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.563 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.444 ' H ' ' HE3' ' A' ' 68' ' ' MET . 65.3 p -73.89 -168.0 0.55 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.624 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.853 HG22 ' HA ' ' A' ' 84' ' ' LYS . 47.4 t -77.35 -47.51 2.53 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.656 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.537 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 51.7 Cg_exo -52.15 -34.14 57.16 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.187 1.924 . . . . 0.0 111.88 179.458 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' MET . . . . . 0.444 ' HE3' ' H ' ' A' ' 65' ' ' THR . 46.5 mtm -80.01 -40.48 27.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.497 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.57 ' HB2' HD13 ' A' ' 87' ' ' LEU . 9.6 mt -60.32 -41.52 93.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.491 179.528 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.93 -34.91 57.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.684 179.142 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.09 -54.86 39.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.966 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.836 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -56.94 -43.56 81.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.672 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 13.7 m -60.27 -41.26 92.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.442 179.46 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.85 -35.95 79.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.544 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.99 -30.29 50.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.817 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.429 ' CE1' ' HG3' ' A' ' 49' ' ' GLU . 2.7 m-85 -84.26 -29.11 26.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.006 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.77 24.02 47.47 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.573 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.414 HD13 ' HB1' ' A' ' 90' ' ' ALA . 2.9 mt -81.2 -170.79 2.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.796 0.331 . . . . 0.0 110.846 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -96.86 -37.58 10.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.881 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 68.23 176.58 0.26 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.857 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -137.37 146.22 18.07 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.483 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.2 mp -80.75 65.63 5.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.83 0.348 . . . . 0.0 111.015 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.561 ' O ' HG21 ' A' ' 66' ' ' VAL . 2.0 tptt -157.39 -73.38 0.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.029 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.853 ' HA ' HG22 ' A' ' 66' ' ' VAL . 35.8 tttm 168.9 -83.77 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.582 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -47.55 -31.77 4.72 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.159 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -52.37 -36.86 54.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.696 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.628 HD11 HG13 ' A' ' 66' ' ' VAL . 1.2 mt -62.39 -47.37 84.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.764 179.166 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.757 HD11 ' C ' ' A' ' 61' ' ' LEU . 4.3 mm? -51.2 -51.25 55.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.333 178.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.44 -53.2 39.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.816 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.414 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.91 -44.09 66.69 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.112 0.482 . . . . 0.0 110.117 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.836 HD21 ' HB1' ' A' ' 72' ' ' ALA . 2.0 mt -65.94 -57.3 8.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.696 179.274 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.1 m -49.76 -55.9 12.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.365 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.8 mmtm -48.61 -35.21 13.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.216 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.427 ' CD2' ' CD2' ' A' ' 76' ' ' TYR . 1.5 t-80 -79.17 -3.35 45.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.817 -179.494 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' PHE . . . . . 0.523 ' CE2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.5 27.66 0.9 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.663 0.268 . . . . 0.0 110.947 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.982 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.657 ' HB3' HD21 ' A' ' 52' ' ' LEU . 17.3 m-85 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 121.016 0.436 . . . . 0.0 110.696 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.512 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 85.3 p -71.52 -47.89 52.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.31 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.756 ' HA ' HD12 ' A' ' 52' ' ' LEU . 5.3 pt-20 167.39 -42.16 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.486 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -55.7 -56.1 24.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.251 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.458 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.3 OUTLIER -60.07 -40.73 90.55 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.395 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.756 HD12 ' HA ' ' A' ' 49' ' ' GLU . 23.7 mt -60.05 -50.98 71.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.208 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.634 ' HA ' HD12 ' A' ' 56' ' ' ILE . 41.5 tttm -53.04 -48.88 67.28 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.1 m -55.19 -43.12 74.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.313 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.516 ' HB2' HD12 ' A' ' 61' ' ' LEU . 4.7 m-70 -60.79 -49.81 75.98 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.686 178.467 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.634 HD12 ' HA ' ' A' ' 53' ' ' LYS . 34.3 mt -55.89 -46.74 80.31 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.905 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 58.5 m -53.7 -74.37 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.272 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -61.79 -74.77 0.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.133 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 145.66 37.39 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.857 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 63.2 p -100.41 -9.48 22.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.688 0.28 . . . . 0.0 111.034 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.62 HD22 ' HG ' ' A' ' 88' ' ' LEU . 0.7 OUTLIER -58.67 -24.84 62.05 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.843 0.354 . . . . 0.0 110.38 179.611 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.717 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -88.01 16.19 52.54 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.581 179.456 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.6 mtmt -91.38 -57.91 2.62 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.089 0.471 . . . . 0.0 110.125 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -49.92 155.8 0.84 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.361 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 73.6 p -74.4 -169.53 0.84 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.708 179.538 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.601 HG13 HD11 ' A' ' 87' ' ' LEU . 53.7 t -78.01 -46.69 2.25 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.748 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.516 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 52.6 Cg_exo -51.97 -34.69 57.64 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.192 1.928 . . . . 0.0 111.84 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 17.0 mtm -80.27 -39.26 29.24 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.404 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.647 ' CB ' HD13 ' A' ' 87' ' ' LEU . 7.9 mt -60.82 -46.89 88.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.393 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.453 ' HD3' HG12 ' A' ' 66' ' ' VAL . 0.2 OUTLIER -52.08 -33.14 37.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.628 179.256 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.402 ' O ' ' CG ' ' A' ' 74' ' ' ARG . 2.2 tm-20 -56.82 -53.76 54.12 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.865 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.689 ' CB ' HD21 ' A' ' 91' ' ' LEU . . . -57.68 -33.74 68.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.031 0.443 . . . . 0.0 110.38 179.58 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.779 ' HA ' HD12 ' A' ' 78' ' ' LEU . 34.8 m -61.45 -47.48 85.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.02 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.405 ' HG3' ' N ' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -61.99 -28.45 69.57 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.921 -179.849 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.405 ' N ' ' HG3' ' A' ' 74' ' ' ARG . . . -80.14 -34.29 37.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.986 0.422 . . . . 0.0 110.724 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.463 ' CE2' ' HB3' ' A' ' 94' ' ' HIS . 3.2 m-30 -84.8 -25.76 27.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.047 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.07 24.52 31.73 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.457 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.779 HD12 ' HA ' ' A' ' 73' ' ' CYS . 1.3 mt -81.13 -164.73 0.79 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.759 0.314 . . . . 0.0 110.821 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.64 24.4 2.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.006 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.83 -166.99 0.87 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.785 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.671 ' HA2' HD21 ' A' ' 87' ' ' LEU . . . 108.8 88.03 1.93 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.632 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.421 ' HA ' HD23 ' A' ' 82' ' ' LEU . 19.2 mt -158.86 -86.17 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.675 0.274 . . . . 0.0 110.667 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 3.1 mmtm -82.0 -66.01 0.94 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.841 0.353 . . . . 0.0 110.642 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.605 ' HA ' HD12 ' A' ' 87' ' ' LEU . 0.8 OUTLIER 169.13 -65.63 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.019 179.931 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.68 -37.48 28.89 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.248 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.87 -40.12 69.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.067 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.741 ' O ' HD12 ' A' ' 91' ' ' LEU . 1.9 mt -61.54 -47.16 86.84 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.717 HD21 ' CA ' ' A' ' 62' ' ' GLY . 9.4 mp -51.42 -53.02 41.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.227 178.66 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -51.12 -52.75 40.71 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.879 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.545 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.88 -43.24 66.0 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.103 0.478 . . . . 0.0 110.107 179.361 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.741 HD12 ' O ' ' A' ' 87' ' ' LEU . 0.4 OUTLIER -66.82 -58.52 4.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.695 179.187 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.41 ' OG1' HG23 ' A' ' 56' ' ' ILE . 1.2 m -49.37 -55.59 12.43 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.263 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.8 mtpp -46.31 -34.21 4.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.043 179.328 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.463 ' HB3' ' CE2' ' A' ' 76' ' ' TYR . 3.9 t60 -66.22 -55.42 16.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.143 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' PHE . . . . . 0.57 ' CZ ' ' HD2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -92.38 14.26 17.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.5 -179.629 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.408 ' N ' ' O ' ' A' ' 92' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.169 0 CA-C-O 120.729 0.3 . . . . 0.0 110.873 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.807 ' HB3' HD21 ' A' ' 52' ' ' LEU . 26.8 m-85 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.987 0.423 . . . . 0.0 110.911 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.46 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 13.1 p -71.87 -46.92 56.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.518 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.708 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.2 tt0 168.16 -43.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.537 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.33 -58.55 6.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.374 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.415 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.3 OUTLIER -59.06 -39.26 81.53 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.463 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.807 HD21 ' HB3' ' A' ' 47' ' ' TYR . 38.0 mt -60.33 -52.3 65.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.306 178.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.763 ' HA ' HD12 ' A' ' 56' ' ' ILE . 1.4 tmtp? -54.87 -47.34 74.37 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-O 121.107 0.479 . . . . 0.0 110.005 179.153 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.2 m -59.09 -44.04 91.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.9 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.417 ' CE1' ' HZ ' ' A' ' 64' ' ' PHE . 35.3 m170 -58.68 -49.73 76.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.889 179.077 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.763 HD12 ' HA ' ' A' ' 53' ' ' LYS . 8.2 mt -57.63 -48.21 83.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.014 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.91 -65.74 0.51 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.645 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 46.2 mttt -60.69 -39.01 86.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.166 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 111.29 23.67 5.68 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.527 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 44.5 p -97.65 -13.63 21.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.587 0.232 . . . . 0.0 111.001 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.824 ' O ' HD22 ' A' ' 88' ' ' LEU . 3.1 tm? -59.09 -28.53 66.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.746 0.308 . . . . 0.0 110.463 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.597 ' HA2' HD13 ' A' ' 88' ' ' LEU . . . -86.7 13.22 59.26 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.598 179.642 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.94 -45.68 6.84 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.815 0.341 . . . . 0.0 111.275 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.417 ' HZ ' ' CE1' ' A' ' 55' ' ' HIS . 30.0 m-85 -45.24 144.77 1.27 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.958 -179.385 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.647 ' O ' HD12 ' A' ' 69' ' ' LEU . 26.7 p -74.13 -168.2 0.6 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.82 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.518 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 55.5 t -76.1 -56.84 1.54 Allowed Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.626 -179.747 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.518 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 7.9 Cg_endo -50.28 -34.9 41.96 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.357 2.038 . . . . 0.0 112.416 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 47.1 mtm -80.1 -33.91 38.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.489 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.976 HD21 HD23 ' A' ' 88' ' ' LEU . 4.8 mt -61.43 -41.55 97.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.924 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.75 -37.68 43.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.839 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.61 -57.79 10.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.985 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.825 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.61 -44.29 85.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.872 0.368 . . . . 0.0 110.546 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.2 m -60.27 -37.26 79.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.436 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.0 mtt180 -62.47 -36.89 83.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.647 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -78.82 -32.16 46.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.005 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.465 ' CE1' ' HG3' ' A' ' 49' ' ' GLU . 2.7 m-85 -83.79 -25.99 29.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.187 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.7 24.45 55.9 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.617 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.4 mt -81.11 175.6 10.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.822 0.344 . . . . 0.0 110.842 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.01 -53.8 3.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.833 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.631 ' CB ' HD23 ' A' ' 87' ' ' LEU . 86.8 p 45.29 -166.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.35 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.53 ' C ' HD12 ' A' ' 82' ' ' LEU . . . -148.22 -112.23 0.66 Allowed Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.475 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.649 ' N ' HD12 ' A' ' 82' ' ' LEU . 0.1 OUTLIER -153.31 13.09 0.49 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.594 0.235 . . . . 0.0 111.395 -179.942 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.416 ' O ' ' HB3' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -84.97 8.05 19.09 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.764 -0.198 . . . . 0.0 111.292 179.476 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.416 ' HB3' ' O ' ' A' ' 83' ' ' LYS . 32.4 tttt 71.39 -79.35 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.57 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.855 ' HA ' HD12 ' A' ' 88' ' ' LEU . 0.5 OUTLIER -47.3 -40.44 16.92 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.88 0.372 . . . . 0.0 111.093 179.592 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.22 -49.78 66.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.692 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.84 ' HB2' HD13 ' A' ' 69' ' ' LEU . 2.4 mt -61.22 -49.58 76.56 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 178.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.976 HD23 HD21 ' A' ' 69' ' ' LEU . 15.4 mt -52.67 -50.55 63.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.941 178.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -54.5 -52.4 62.08 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.593 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -51.33 -41.4 60.53 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.099 0.476 . . . . 0.0 110.114 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.825 HD21 ' HB1' ' A' ' 72' ' ' ALA . 1.1 mt -65.67 -61.54 2.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.295 179.08 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.7 m -50.17 -56.67 10.05 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.086 179.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.4 mtpt -48.36 -33.41 8.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.095 179.06 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -71.6 -15.47 62.26 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.684 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' PHE . . . . . 0.447 ' CD1' ' HE3' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.19 34.84 0.89 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.839 0.352 . . . . 0.0 110.908 -179.867 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.88 -179.979 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.728 ' HB3' HD21 ' A' ' 52' ' ' LEU . 60.6 m-85 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 121.015 0.435 . . . . 0.0 110.482 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.529 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 85.3 p -73.67 -55.32 6.41 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.616 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.684 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.0 OUTLIER 168.66 -37.22 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.149 179.831 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -57.09 -54.79 42.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.765 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.46 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.0 OUTLIER -61.09 -42.92 99.4 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.022 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.728 HD21 ' HB3' ' A' ' 47' ' ' TYR . 33.1 mt -58.72 -50.99 71.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.077 178.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.476 ' CE ' ' CD1' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -52.42 -48.92 65.45 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.858 179.055 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.549 HG22 ' HD2' ' A' ' 58' ' ' LYS . 3.9 m -57.51 -42.34 82.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.643 178.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.669 ' HB2' HD12 ' A' ' 61' ' ' LEU . 4.7 m-70 -60.09 -48.9 79.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.859 178.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 74.7 mt -56.41 -47.95 80.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.859 179.366 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.48 -72.75 0.06 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.51 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.549 ' HD2' HG22 ' A' ' 54' ' ' THR . 4.1 mttt -61.53 -74.34 0.08 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.297 -179.443 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 145.53 35.24 0.07 OUTLIER Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.949 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.428 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 0.7 OUTLIER -99.82 -9.62 22.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.644 0.259 . . . . 0.0 110.85 179.603 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.669 HD12 ' HB2' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -59.32 -21.48 59.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.902 0.382 . . . . 0.0 110.379 179.544 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.705 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -90.66 15.12 61.16 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.934 -0.651 . . . . 0.0 112.535 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.428 ' HB2' ' O ' ' A' ' 60' ' ' THR . 0.1 OUTLIER -90.92 -55.95 3.36 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.025 0.44 . . . . 0.0 109.977 179.633 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -49.82 151.79 1.71 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.236 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.467 ' O ' HD12 ' A' ' 69' ' ' LEU . 17.8 p -73.87 -165.49 0.3 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.767 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.514 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 41.7 t -76.59 -57.55 1.26 Allowed Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.205 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 9.1 Cg_endo -50.95 -28.97 25.63 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.272 1.981 . . . . 0.0 112.101 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.4 mtp -79.98 -39.33 30.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.151 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.744 ' HB2' HD13 ' A' ' 87' ' ' LEU . 7.0 mt -61.16 -43.03 99.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.52 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.94 -33.4 37.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.854 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -56.02 -52.52 63.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.053 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.643 ' CB ' HD21 ' A' ' 91' ' ' LEU . . . -57.67 -53.01 63.04 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.687 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.97 -33.61 72.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.358 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -37.72 87.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.08 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.77 -26.83 31.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.715 179.507 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.459 ' CE1' ' CD1' ' A' ' 52' ' ' LEU . 3.0 m-85 -82.97 -30.92 27.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.817 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.97 14.6 59.05 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.809 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.574 HD21 ' CD2' ' A' ' 94' ' ' HIS . 4.4 mt -82.04 167.19 19.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.934 0.397 . . . . 0.0 111.103 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.29 75.58 1.82 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.662 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.695 ' OG ' HD23 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -75.85 -169.07 1.0 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.103 -179.697 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -140.91 -120.37 1.67 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.47 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.7 pp -155.4 11.23 0.32 Allowed 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.8 tptp -85.52 7.05 24.38 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.614 0.245 . . . . 0.0 111.095 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.4 ttmm 69.43 -76.82 0.06 Allowed 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.53 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -50.56 -36.36 34.21 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.876 0.37 . . . . 0.0 111.161 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -62.08 -38.28 88.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.062 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.744 HD13 ' HB2' ' A' ' 69' ' ' LEU . 1.2 mt -61.38 -42.44 98.72 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.54 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.705 HD21 ' CA ' ' A' ' 62' ' ' GLY . 9.2 mp -52.04 -54.48 29.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.34 178.655 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -50.37 -52.54 36.36 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.828 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.559 ' O ' HD13 ' A' ' 78' ' ' LEU . . . -51.4 -44.09 62.13 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.199 0.523 . . . . 0.0 109.814 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.643 HD21 ' CB ' ' A' ' 72' ' ' ALA . 0.4 OUTLIER -66.66 -61.09 2.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.653 179.016 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.0 m -48.88 -52.14 25.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.365 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 15.6 tptp -48.46 -34.64 11.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.168 179.157 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.574 ' CD2' HD21 ' A' ' 78' ' ' LEU . 20.6 t-80 -78.53 -5.55 52.98 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.923 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' PHE . . . . . 0.476 ' CD1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.65 27.96 0.98 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.799 0.333 . . . . 0.0 110.975 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.884 179.92 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.781 ' HB3' HD21 ' A' ' 52' ' ' LEU . 24.4 m-85 . . . . . 0 CA--C 1.522 -0.11 0 CA-C-O 120.971 0.415 . . . . 0.0 110.754 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.512 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 83.0 p -72.47 -52.99 13.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.342 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.858 ' HA ' HD12 ' A' ' 52' ' ' LEU . 2.5 pt-20 164.83 -39.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.001 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -56.13 -58.26 8.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.471 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.442 ' HG3' ' CE1' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -58.92 -37.5 76.81 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 179.61 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.858 HD12 ' HA ' ' A' ' 49' ' ' GLU . 36.2 mt -60.95 -53.6 55.31 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.22 178.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.643 ' HA ' HD12 ' A' ' 56' ' ' ILE . 20.8 tttm -54.7 -47.02 74.21 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-O 121.03 0.443 . . . . 0.0 110.096 178.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.9 m -56.97 -44.81 83.01 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.489 178.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.446 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 12.0 m-70 -60.42 -51.49 69.26 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.824 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.643 HD12 ' HA ' ' A' ' 53' ' ' LYS . 11.6 mt -56.96 -42.42 78.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.024 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.78 -76.11 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.643 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.9 pttt -60.97 -51.51 68.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.371 -179.317 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 123.98 52.18 0.2 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.564 -0.826 . . . . 0.0 112.805 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.661 HG22 ' HG3' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -124.18 -4.13 7.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.506 0.193 . . . . 0.0 111.097 179.792 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.481 HD11 HD13 ' A' ' 91' ' ' LEU . 60.7 tp -60.05 -20.89 60.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.843 0.354 . . . . 0.0 110.559 179.471 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.781 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -93.05 22.8 32.47 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.25 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.661 ' HG3' HG22 ' A' ' 60' ' ' THR . 0.3 OUTLIER -91.37 -57.59 2.73 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.018 0.437 . . . . 0.0 110.073 179.683 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -49.84 157.26 0.61 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.25 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 30.6 p -73.86 -169.4 0.73 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.037 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.529 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 75.2 t -76.77 -56.22 1.4 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.315 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 9.9 Cg_endo -52.31 -29.61 39.26 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.147 1.898 . . . . 0.0 112.027 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.71 -41.51 26.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.2 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.737 ' CB ' HD22 ' A' ' 87' ' ' LEU . 24.6 mt -61.4 -34.68 75.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.52 179.324 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.465 ' N ' HD22 ' A' ' 87' ' ' LEU . 12.4 mmtt -53.16 -38.21 62.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.097 179.636 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -54.98 -49.66 70.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.964 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.685 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.31 -48.81 77.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.733 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.76 -40.04 86.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.418 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -37.03 81.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.478 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.01 -30.39 44.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.734 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.636 ' HB3' HD23 ' A' ' 78' ' ' LEU . 2.7 m-85 -85.48 5.38 31.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.417 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.82 16.18 58.92 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.704 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.879 ' HG ' ' HB1' ' A' ' 90' ' ' ALA . 3.4 mm? -81.1 178.74 8.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.873 0.368 . . . . 0.0 110.868 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.17 -31.85 12.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.698 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.9 p 65.63 169.3 0.21 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.977 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -151.06 150.91 22.95 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.56 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.57 66.95 6.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.921 0.391 . . . . 0.0 110.864 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -155.88 8.33 0.24 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.938 -179.56 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.422 ' CA ' HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER 65.99 -76.48 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.725 0.298 . . . . 0.0 111.031 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.672 ' HA ' HD13 ' A' ' 88' ' ' LEU . 8.1 tt0 -47.83 -34.01 8.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.332 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 37.8 tp10 -59.72 -42.54 93.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.925 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.737 HD22 ' CB ' ' A' ' 69' ' ' LEU . 1.5 mp -61.11 -43.91 98.15 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.781 HD21 ' CA ' ' A' ' 62' ' ' GLY . 5.2 mp -51.51 -53.71 34.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.269 178.562 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -50.47 -53.25 31.21 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.97 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.879 ' HB1' ' HG ' ' A' ' 78' ' ' LEU . . . -52.19 -43.99 64.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.062 0.458 . . . . 0.0 110.128 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.721 ' CD2' HD22 ' A' ' 52' ' ' LEU . 0.4 OUTLIER -66.36 -58.54 5.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.424 179.094 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.9 m -50.23 -57.27 8.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.419 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.51 -31.87 11.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.279 179.388 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -85.43 0.49 52.09 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' PHE . . . . . 0.579 ' CZ ' ' HD2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -147.64 19.75 1.17 Allowed 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.036 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 . . . . . 0 C--N 1.333 -0.141 0 CA-C-O 120.799 0.333 . . . . 0.0 110.92 179.988 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.892 ' HB3' HD21 ' A' ' 52' ' ' LEU . 21.7 m-85 . . . . . 0 N--CA 1.461 0.084 0 CA-C-O 121.022 0.439 . . . . 0.0 110.967 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.512 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 2.7 p -73.34 -53.31 11.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.383 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.839 ' HA ' HD12 ' A' ' 52' ' ' LEU . 8.1 pt-20 168.24 -39.46 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.214 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -56.29 -55.61 31.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.036 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.476 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -59.97 -43.02 95.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.343 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.892 HD21 ' HB3' ' A' ' 47' ' ' TYR . 15.4 mt -58.9 -50.68 73.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.055 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.741 ' HA ' HD12 ' A' ' 56' ' ' ILE . 0.5 OUTLIER -52.61 -49.05 65.84 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.878 178.976 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.9 m -58.05 -43.45 86.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.727 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.476 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 17.0 m170 -59.73 -49.33 78.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.84 178.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.741 HD12 ' HA ' ' A' ' 53' ' ' LYS . 16.4 mt -56.22 -47.73 80.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.988 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.54 -75.7 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.344 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -61.74 -72.28 0.13 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.148 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 143.33 39.47 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.582 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -99.52 -9.95 22.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.704 0.288 . . . . 0.0 111.068 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.619 HD12 HG13 ' A' ' 56' ' ' ILE . 0.4 OUTLIER -59.7 -21.46 60.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.862 0.363 . . . . 0.0 110.648 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.755 ' HA2' HD11 ' A' ' 88' ' ' LEU . . . -94.84 17.11 59.88 Favored Glycine 0 C--N 1.333 0.363 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.514 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.87 -57.44 2.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.992 0.425 . . . . 0.0 110.272 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -48.62 161.95 0.11 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.181 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 52.8 p -73.25 -174.63 1.65 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.816 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.674 HG22 ' HB3' ' A' ' 84' ' ' LYS . 82.7 t -75.86 -56.3 1.74 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.227 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.532 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 7.4 Cg_endo -50.08 -28.32 19.06 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.201 1.934 . . . . 0.0 111.89 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.47 -42.35 25.48 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.026 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.852 ' CB ' HD13 ' A' ' 87' ' ' LEU . 11.9 mt -60.87 -42.65 98.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.061 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.47 ' HD3' HD21 ' A' ' 87' ' ' LEU . 6.5 mmtp -54.06 -33.71 58.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.29 178.651 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -55.42 31.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.919 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.639 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.11 -44.57 83.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.02 0.438 . . . . 0.0 110.378 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 86.3 m -60.89 -43.26 98.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.426 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -35.74 78.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.469 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.67 -31.51 59.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.609 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -84.22 -23.45 30.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.972 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 92.47 15.4 53.3 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.57 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.482 HD13 ' HB1' ' A' ' 90' ' ' ALA . 4.5 mt -81.21 172.98 12.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.753 0.311 . . . . 0.0 110.856 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.68 -50.07 4.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.654 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.835 ' CB ' HD23 ' A' ' 87' ' ' LEU . 59.0 p 45.44 -166.15 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.593 179.591 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.58 164.88 17.91 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.368 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.1 mt 76.51 118.62 0.05 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.071 0.462 . . . . 0.0 111.031 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.419 ' O ' ' HB3' ' A' ' 84' ' ' LYS . 0.3 OUTLIER 62.53 -79.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.635 179.627 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.674 ' HB3' HG22 ' A' ' 66' ' ' VAL . 3.9 ptpt 163.68 -46.71 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.945 0.403 . . . . 0.0 110.14 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -47.24 -39.78 15.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.904 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -48.81 -36.42 16.72 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.56 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.852 HD13 ' CB ' ' A' ' 69' ' ' LEU . 9.6 mt -62.43 -51.66 66.65 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 178.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.755 HD11 ' HA2' ' A' ' 62' ' ' GLY . 4.0 mp -52.35 -54.29 33.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.844 178.225 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -51.5 -49.31 62.12 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.663 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.482 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.41 -45.24 65.82 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.161 0.505 . . . . 0.0 109.884 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.846 ' CD2' HD22 ' A' ' 52' ' ' LEU . 0.3 OUTLIER -66.61 -60.38 2.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.554 179.048 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.4 m -50.24 -52.96 31.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.368 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -48.88 -32.01 8.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.869 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -93.09 13.84 19.7 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.531 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' PHE . . . . . 0.505 ' HB3' HD13 ' A' ' 56' ' ' ILE . 0.1 OUTLIER -145.44 -6.09 0.64 Allowed 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.914 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.821 0.343 . . . . 0.0 110.893 179.911 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.901 ' HB3' HD21 ' A' ' 52' ' ' LEU . 3.1 m-85 . . . . . 0 N--CA 1.462 0.127 0 CA-C-O 121.056 0.455 . . . . 0.0 110.955 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.487 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 79.8 p -72.73 -44.24 61.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.703 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.889 ' HA ' HD12 ' A' ' 52' ' ' LEU . 26.7 tt0 165.22 -45.89 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.223 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.1 -56.55 16.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.22 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.468 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.1 OUTLIER -59.1 -40.28 84.81 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 179.29 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.901 HD21 ' HB3' ' A' ' 47' ' ' TYR . 28.0 mt -59.04 -53.66 55.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.285 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.48 ' HG2' ' CD2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.77 -47.28 70.87 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 121.065 0.459 . . . . 0.0 109.942 179.131 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.1 m -58.2 -42.17 85.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.697 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.468 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 29.3 m170 -60.53 -47.76 84.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.181 179.033 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.539 HD11 ' HA ' ' A' ' 92' ' ' THR . 0.8 OUTLIER -55.51 -44.48 76.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.977 179.628 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 m -52.93 -73.13 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.307 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.2 mttm -62.13 -52.9 61.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.997 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 117.71 32.63 1.41 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.503 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.31 -3.14 34.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.613 0.244 . . . . 0.0 111.297 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.676 ' C ' HD21 ' A' ' 88' ' ' LEU . 0.6 OUTLIER -60.21 -23.0 63.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.723 0.297 . . . . 0.0 110.871 179.883 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.617 ' N ' HD21 ' A' ' 88' ' ' LEU . . . -96.62 20.72 49.33 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.818 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.69 -56.64 2.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.949 0.404 . . . . 0.0 110.325 179.657 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -48.43 154.17 0.66 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.345 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 72.1 p -73.09 -163.05 0.13 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.623 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.555 ' HB ' ' HD3' ' A' ' 67' ' ' PRO . 11.9 t -77.41 -51.69 1.89 Allowed Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.518 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.555 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 78.5 Cg_exo -46.43 -33.15 12.2 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.271 1.98 . . . . 0.0 111.966 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 9.4 mmm -80.18 -51.18 9.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.552 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.971 ' HB2' HD13 ' A' ' 87' ' ' LEU . 55.8 mt -60.43 -39.31 87.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.574 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.401 ' HD3' ' HA3' ' A' ' 81' ' ' GLY . 0.3 OUTLIER -52.14 -41.94 62.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.75 179.371 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.81 -55.15 29.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.22 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.572 ' HB2' ' CB ' ' A' ' 47' ' ' TYR . . . -57.32 -47.95 80.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.961 0.41 . . . . 0.0 110.499 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.729 ' SG ' HD23 ' A' ' 87' ' ' LEU . 31.9 m -61.41 -40.11 93.21 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.648 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.53 -35.55 80.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.944 0.402 . . . . 0.0 110.524 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.43 -43.27 70.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.854 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CE1' ' CE1' ' A' ' 94' ' ' HIS . 8.8 m-85 -84.87 -16.52 40.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.43 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 73' ' ' CYS . . . 59.39 46.27 94.17 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.571 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.587 ' CB ' ' HB1' ' A' ' 90' ' ' ALA . 1.5 mt -84.65 14.34 4.76 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? 61.91 8.12 2.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.315 -0.402 . . . . 0.0 112.006 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.89 -168.74 1.9 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.853 0.359 . . . . 0.0 110.906 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.611 ' HA2' HD21 ' A' ' 87' ' ' LEU . . . 93.6 88.5 1.62 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.629 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -159.76 -80.19 0.05 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.79 0.329 . . . . 0.0 110.932 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -80.54 -69.21 0.61 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.822 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.407 ' HA ' HG22 ' A' ' 66' ' ' VAL . 9.4 ttmm 173.97 -81.25 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.461 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.501 ' HG3' HD12 ' A' ' 88' ' ' LEU . 5.0 tt0 -47.8 -29.8 3.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.177 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.73 -36.33 62.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.784 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.971 HD13 ' HB2' ' A' ' 69' ' ' LEU . 2.3 mt -62.29 -44.94 95.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.276 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.676 HD21 ' C ' ' A' ' 61' ' ' LEU . 42.4 mt -50.87 -52.89 37.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.4 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -49.73 -52.13 33.71 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.861 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.587 ' HB1' ' CB ' ' A' ' 78' ' ' LEU . . . -53.67 -48.28 69.61 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.941 0.4 . . . . 0.0 110.663 179.593 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.856 HD22 HD22 ' A' ' 52' ' ' LEU . 2.3 mt -66.86 -49.2 66.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.62 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.549 HG22 ' N ' ' A' ' 93' ' ' LYS . 0.6 OUTLIER -52.15 -58.71 5.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.604 179.822 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.549 ' N ' HG22 ' A' ' 92' ' ' THR . 3.6 ptmt -47.85 -30.48 4.11 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.261 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.5 ' CE1' ' CE1' ' A' ' 76' ' ' TYR . 37.9 t-80 -73.32 -21.54 60.54 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.411 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' PHE . . . . . 0.48 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.46 43.21 1.1 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.944 0.402 . . . . 0.0 111.054 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.819 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.783 ' HB3' HD21 ' A' ' 52' ' ' LEU . 6.3 m-85 . . . . . 0 C--O 1.232 0.138 0 CA-C-O 121.01 0.433 . . . . 0.0 110.95 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.519 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 88.0 p -73.07 -47.78 41.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.268 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.886 ' HA ' HD12 ' A' ' 52' ' ' LEU . 6.4 pt-20 166.18 -41.72 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.898 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.17 -54.78 41.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.979 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.496 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.5 OUTLIER -59.58 -43.11 93.73 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.281 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.886 HD12 ' HA ' ' A' ' 49' ' ' GLU . 16.5 mt -59.04 -51.61 69.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.194 178.811 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.758 ' O ' HG22 ' A' ' 56' ' ' ILE . 1.3 mmtt -54.2 -45.15 72.12 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-O 121.273 0.559 . . . . 0.0 110.224 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.424 HG22 ' O ' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -61.11 -41.45 96.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.862 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.496 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 7.7 m-70 -60.75 -50.63 72.68 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.402 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.758 HG22 ' O ' ' A' ' 53' ' ' LYS . 8.7 tt -58.21 -42.35 83.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 121.064 0.459 . . . . 0.0 110.67 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.7 t -54.29 -76.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.172 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 9.8 mttt -62.43 -68.86 0.29 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.023 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 141.08 39.61 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.729 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 60.7 p -101.18 -10.45 20.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.676 0.274 . . . . 0.0 111.165 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.559 HD21 HD13 ' A' ' 91' ' ' LEU . 0.4 OUTLIER -59.09 -23.86 62.44 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.811 0.338 . . . . 0.0 110.586 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.649 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -90.58 11.99 69.86 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.414 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.1 mmtp -92.17 -54.4 3.84 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.931 0.396 . . . . 0.0 110.473 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -47.95 152.15 0.82 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.274 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 24.0 p -73.56 -166.66 0.37 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.852 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.503 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 53.2 t -76.96 -57.83 1.11 Allowed Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.437 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 5.7 Cg_endo -48.34 -29.97 14.31 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.275 1.983 . . . . 0.0 112.105 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.2 mtp -80.27 -41.45 24.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.26 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.92 ' CB ' HD13 ' A' ' 87' ' ' LEU . 11.9 mt -61.15 -49.86 75.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.555 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.598 ' HG3' HD21 ' A' ' 87' ' ' LEU . 2.0 mttt -51.32 -31.34 21.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.542 179.346 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -56.58 -53.57 56.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.796 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.783 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.83 -46.38 84.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.543 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 42.0 m -60.22 -40.67 90.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.561 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.9 ttt-85 -61.23 -36.52 80.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.51 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.3 -36.35 61.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.692 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.602 ' HB3' HD23 ' A' ' 78' ' ' LEU . 2.9 m-30 -85.49 5.97 28.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.481 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.93 33.59 64.0 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.546 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.602 HD23 ' HB3' ' A' ' 76' ' ' TYR . 1.4 mm? -80.66 -170.18 2.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.798 0.332 . . . . 0.0 110.884 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.6 35.68 1.63 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.859 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.706 ' HB3' HD23 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -77.21 -162.5 0.29 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.736 179.892 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 100.95 104.98 2.75 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.487 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -160.26 -39.16 0.05 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.872 0.368 . . . . 0.0 110.97 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -157.74 -52.96 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.768 -179.924 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 83' ' ' LYS . 3.1 ttpt 175.24 -76.67 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.472 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -47.83 -29.95 3.63 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.297 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -57.54 -38.67 75.11 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.811 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.92 HD13 ' CB ' ' A' ' 69' ' ' LEU . 8.1 mt -62.11 -45.88 91.54 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.649 HD21 ' CA ' ' A' ' 62' ' ' GLY . 3.2 mp -50.62 -51.04 52.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.233 178.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -51.31 -55.14 19.93 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.831 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -51.71 -42.24 62.09 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.136 0.493 . . . . 0.0 110.014 179.276 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.783 HD21 ' HB1' ' A' ' 72' ' ' ALA . 0.7 OUTLIER -65.96 -59.56 3.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.646 179.136 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.594 ' HA ' HD12 ' A' ' 56' ' ' ILE . 2.3 m -48.41 -55.07 11.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.408 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.69 -35.97 15.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.163 179.28 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.434 ' CD2' HD21 ' A' ' 78' ' ' LEU . 10.2 t-80 -84.9 5.68 27.98 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.591 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' PHE . . . . . 0.473 ' CE1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.47 17.29 1.17 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.562 0.22 . . . . 0.0 111.164 179.934 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.333 -0.135 0 CA-C-O 120.8 0.333 . . . . 0.0 110.864 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.85 ' HB3' HD21 ' A' ' 52' ' ' LEU . 65.7 m-85 . . . . . 0 C--O 1.231 0.131 0 CA-C-O 121.11 0.481 . . . . 0.0 110.517 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 65.8 p -73.22 -45.83 53.86 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.012 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.795 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.2 pt-20 166.06 -46.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.425 -179.678 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.93 -58.8 5.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.398 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.431 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 3.3 mm-40 -58.8 -39.53 81.4 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.91 HD22 ' CD2' ' A' ' 91' ' ' LEU . 50.6 mt -59.3 -53.58 56.63 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.315 178.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.717 ' HE2' ' CG ' ' A' ' 95' ' ' PHE . 0.1 OUTLIER -55.11 -46.11 75.55 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.438 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.9 m -58.53 -44.83 89.69 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.432 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 13.5 m-70 -61.65 -53.57 54.36 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.056 -0.975 . . . . 0.0 109.738 178.507 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.489 HD12 ' HE3' ' A' ' 53' ' ' LYS . 14.4 mt -57.26 -41.38 78.03 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.74 179.152 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.7 t -55.08 -74.9 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.237 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.3 mtpp -62.75 -69.39 0.26 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.007 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 145.52 37.69 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.698 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 73.9 p -100.79 -10.32 20.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.643 0.259 . . . . 0.0 111.036 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.933 HD11 HD13 ' A' ' 91' ' ' LEU . 22.8 tp -58.27 -22.45 52.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.847 0.356 . . . . 0.0 110.646 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.552 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -94.09 15.51 63.01 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.609 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.07 -56.24 3.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.95 0.405 . . . . 0.0 110.51 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -48.68 154.79 0.63 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.383 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 82.6 p -73.33 -170.51 0.8 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.584 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.653 HG13 HD11 ' A' ' 87' ' ' LEU . 65.9 t -77.89 -46.9 2.3 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.838 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.526 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 60.1 Cg_exo -50.83 -35.26 48.12 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.17 1.914 . . . . 0.0 111.972 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 34.8 mtm -79.99 -40.33 28.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.474 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.684 ' CB ' HD13 ' A' ' 87' ' ' LEU . 7.7 mt -60.42 -44.82 95.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.496 179.523 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.75 -34.08 37.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.666 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -57.02 -54.54 45.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.899 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.702 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -56.79 -50.12 73.29 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.993 0.425 . . . . 0.0 110.496 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 8.2 m -60.89 -40.01 91.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.509 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.32 -35.94 80.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.735 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.8 -29.86 40.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.901 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.445 ' OH ' HD12 ' A' ' 52' ' ' LEU . 3.2 m-85 -84.63 -26.95 27.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.04 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.89 25.03 23.67 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.661 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.756 ' HG ' ' HB1' ' A' ' 90' ' ' ALA . 3.8 mm? -81.21 -175.66 5.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.828 0.346 . . . . 0.0 110.905 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.02 -24.69 15.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.01 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.519 ' HB3' HD23 ' A' ' 87' ' ' LEU . 0.3 OUTLIER 50.04 -176.62 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.916 0.389 . . . . 0.0 111.266 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -165.97 161.31 34.9 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.523 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 mp -80.38 -4.46 53.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.585 0.231 . . . . 0.0 111.411 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.1 2.24 28.2 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.673 -0.239 . . . . 0.0 111.57 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.737 ' HA ' HD12 ' A' ' 87' ' ' LEU . 17.9 ttmm 66.85 -73.98 0.07 Allowed 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.663 0.268 . . . . 0.0 110.962 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -47.74 -30.52 3.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.149 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -60.24 -35.57 75.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.792 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.737 HD12 ' HA ' ' A' ' 84' ' ' LYS . 1.5 mt -61.78 -42.32 98.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.048 0.452 . . . . 0.0 109.812 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.552 HD21 ' CA ' ' A' ' 62' ' ' GLY . 3.9 mp -51.83 -55.63 18.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.333 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -50.55 -51.2 50.12 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.888 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.756 ' HB1' ' HG ' ' A' ' 78' ' ' LEU . . . -52.68 -45.1 66.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.018 0.437 . . . . 0.0 110.165 179.39 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.933 HD13 HD11 ' A' ' 61' ' ' LEU . 0.5 OUTLIER -67.37 -57.86 5.84 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.598 179.16 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.401 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.3 m -50.44 -55.11 17.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.226 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.4 mtpt -48.05 -30.39 4.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.098 179.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 6.1 t-80 -77.23 -15.9 59.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.983 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' PHE . . . . . 0.717 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -147.19 33.11 0.89 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.782 0.325 . . . . 0.0 111.326 -179.819 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.401 ' N ' ' O ' ' A' ' 92' ' ' THR . 1.8 tp60 . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.861 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.993 0.425 . . . . 0.0 110.729 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.492 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 0.8 OUTLIER -72.51 -54.57 8.87 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.424 179.898 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.521 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.2 pt-20 168.11 -35.04 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.129 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.97 -59.43 5.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -59.83 -38.3 81.66 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.551 HD12 ' CE1' ' A' ' 76' ' ' TYR . 79.5 mt -61.3 -51.3 69.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.124 178.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.895 ' HA ' HD12 ' A' ' 56' ' ' ILE . 16.4 tttt -55.1 -47.84 74.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.988 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 91.6 m -57.83 -42.45 84.35 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.849 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.443 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 16.7 m-70 -59.64 -48.38 81.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.814 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.895 HD12 ' HA ' ' A' ' 53' ' ' LYS . 8.6 mt -57.5 -48.96 81.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.981 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.0 p -53.43 -62.84 1.39 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.714 -179.553 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.1 mttm -60.7 -34.65 74.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.257 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 108.64 19.98 8.4 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.557 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 61.8 p -97.95 -18.21 18.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.472 0.177 . . . . 0.0 110.888 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.852 ' O ' HD22 ' A' ' 88' ' ' LEU . 2.6 tm? -57.28 -36.76 71.43 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.627 ' HA2' HD13 ' A' ' 88' ' ' LEU . . . -90.06 51.78 3.49 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.057 178.405 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -139.56 -46.11 0.45 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.888 0.375 . . . . 0.0 110.835 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -47.07 152.85 0.5 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.53 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.674 ' O ' HD12 ' A' ' 69' ' ' LEU . 30.7 p -74.12 -169.56 0.8 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.992 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.679 HG23 ' HG2' ' A' ' 84' ' ' LYS . 63.3 t -76.12 -57.34 1.44 Allowed Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.469 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.511 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 4.4 Cg_endo -47.34 -34.23 18.36 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.47 2.113 . . . . 0.0 112.284 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 40.8 mtm -80.2 -38.13 31.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.335 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.975 HD21 HD23 ' A' ' 88' ' ' LEU . 5.2 mt -61.31 -39.93 92.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.846 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.42 -45.75 55.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.227 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -55.52 -52.2 64.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.027 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.971 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.38 -44.2 84.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.883 179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.93 -41.31 91.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.512 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.6 ttt85 -61.78 -36.12 80.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.623 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.72 -30.54 51.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.789 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.551 ' CE1' HD12 ' A' ' 52' ' ' LEU . 3.2 m-30 -84.45 -22.26 30.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.017 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.44 12.35 61.34 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.65 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.991 HD13 ' HB1' ' A' ' 90' ' ' ALA . 15.8 mt -81.11 -176.05 5.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.759 0.314 . . . . 0.0 110.873 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.9 38.44 1.46 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.866 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.715 ' HB3' HD23 ' A' ' 87' ' ' LEU . 0.7 OUTLIER -77.46 -173.11 2.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.839 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.402 ' HA2' HD11 ' A' ' 87' ' ' LEU . . . 126.64 162.1 11.11 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.736 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 5.1 mt 68.02 26.71 7.25 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.693 0.283 . . . . 0.0 111.413 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.41 ' HB3' ' CB ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -158.49 -6.08 0.08 Allowed 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.679 ' HG2' HG23 ' A' ' 66' ' ' VAL . 66.5 mttm 61.75 -85.25 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.598 0.237 . . . . 0.0 110.716 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.717 ' HA ' HD12 ' A' ' 88' ' ' LEU . 0.0 OUTLIER -48.08 -43.39 30.64 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.941 0.4 . . . . 0.0 110.957 179.722 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.41 ' CB ' ' HB3' ' A' ' 83' ' ' LYS . 1.3 tp10 -47.92 -46.54 32.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.793 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.715 HD23 ' HB3' ' A' ' 80' ' ' SER . 1.8 mt -61.68 -50.15 73.63 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.659 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.975 HD23 HD21 ' A' ' 69' ' ' LEU . 19.7 mt -51.83 -52.82 46.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.047 178.698 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.36 -50.86 64.16 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.656 179.256 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.991 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.35 -42.9 64.3 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.624 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.971 HD21 ' HB1' ' A' ' 72' ' ' ALA . 0.6 OUTLIER -65.1 -56.68 11.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.472 179.326 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.2 m -49.3 -60.4 2.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.494 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.433 ' HG2' ' HA ' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -48.72 -29.59 4.64 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.097 179.306 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.43 ' HB3' ' CE2' ' A' ' 76' ' ' TYR . 1.8 t60 -69.31 -19.24 63.89 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.557 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' PHE . . . . . 0.499 ' CD1' ' HE3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -146.3 37.9 1.04 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.905 0.383 . . . . 0.0 110.896 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.799 179.811 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.653 ' HB3' HD21 ' A' ' 52' ' ' LEU . 53.5 m-85 . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.867 0.365 . . . . 0.0 111.461 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.504 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 83.3 p -73.99 -55.3 6.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.326 179.401 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.639 ' HA ' HD12 ' A' ' 52' ' ' LEU . 2.9 pt-20 167.49 -36.23 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.084 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -57.13 -56.48 21.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.98 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.411 ' O ' ' CD2' ' A' ' 55' ' ' HIS . 0.1 OUTLIER -60.67 -41.03 94.24 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.269 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.653 HD21 ' HB3' ' A' ' 47' ' ' TYR . 39.9 mt -60.12 -50.64 72.91 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.081 178.778 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.685 ' HA ' HD12 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -53.74 -48.83 69.27 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.126 179.053 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.0 m -59.37 -43.11 92.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.054 179.2 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.414 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 24.8 m-70 -59.57 -48.7 80.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.969 179.189 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.685 HD12 ' HA ' ' A' ' 53' ' ' LYS . 16.3 mt -56.63 -48.08 81.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.903 179.275 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.67 -63.29 1.2 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.42 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.5 mtmt -61.04 -45.91 92.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.235 -179.47 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 118.36 20.48 4.32 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.702 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 40.6 p -97.57 -10.07 25.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.568 0.223 . . . . 0.0 111.059 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.937 HD21 HD13 ' A' ' 91' ' ' LEU . 2.4 tm? -58.52 -24.21 60.01 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.795 0.331 . . . . 0.0 110.176 179.406 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.61 ' CA ' HD13 ' A' ' 88' ' ' LEU . . . -87.38 16.58 48.22 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.94 -0.647 . . . . 0.0 112.281 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.34 -46.1 6.86 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.874 0.369 . . . . 0.0 111.2 -179.76 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -45.45 143.87 1.69 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.27 -179.27 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.593 ' O ' HD12 ' A' ' 69' ' ' LEU . 40.8 p -74.87 -172.38 1.58 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.748 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.51 HG22 ' N ' ' A' ' 84' ' ' LYS . 85.4 t -75.85 -44.46 3.96 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.206 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.506 ' CD ' ' N ' ' A' ' 66' ' ' VAL . 36.3 Cg_exo -60.86 -38.46 69.82 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.264 1.976 . . . . 0.0 112.15 179.834 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -80.03 -31.41 39.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.799 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.961 HD21 HD23 ' A' ' 88' ' ' LEU . 5.7 mt -60.97 -43.83 98.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.003 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.7 -39.46 51.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.099 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -56.13 -52.66 63.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.144 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.798 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.09 -49.42 75.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.861 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.79 -36.13 76.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.518 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -37.69 86.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.545 179.607 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -80.9 -30.03 35.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.894 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.606 ' CE1' HD12 ' A' ' 52' ' ' LEU . 2.7 m-85 -83.63 -22.25 32.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.023 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.19 21.02 53.78 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.523 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.606 HD23 ' HB3' ' A' ' 76' ' ' TYR . 3.4 mm? -81.49 169.94 16.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.839 0.352 . . . . 0.0 111.014 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.13 -38.06 9.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.613 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.668 ' OG ' HD23 ' A' ' 87' ' ' LEU . 0.3 OUTLIER 46.21 -166.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.425 179.764 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -152.38 -118.47 0.76 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.743 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -159.3 72.79 0.56 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.935 0.398 . . . . 0.0 110.801 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.405 ' O ' ' HB3' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -156.03 11.43 0.29 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.695 -179.549 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.51 ' N ' HG22 ' A' ' 66' ' ' VAL . 54.4 tttt 67.43 -83.87 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.797 -179.662 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.856 ' HA ' HD12 ' A' ' 88' ' ' LEU . 16.1 tt0 -45.34 -40.89 8.3 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.786 0.327 . . . . 0.0 111.108 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.441 ' HA ' ' HG2' ' A' ' 89' ' ' GLU . 1.7 tp10 -57.83 -46.71 84.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.652 179.788 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.939 ' HB2' HD13 ' A' ' 69' ' ' LEU . 0.8 OUTLIER -62.87 -46.64 86.93 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 178.571 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.961 HD23 HD21 ' A' ' 69' ' ' LEU . 24.9 mt -53.51 -56.63 15.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.519 179.05 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.441 ' HG2' ' HA ' ' A' ' 86' ' ' GLU . 11.1 pt-20 -55.89 -44.42 78.18 Favored 'General case' 0 CA--C 1.523 -0.08 0 CA-C-O 120.831 0.348 . . . . 0.0 110.375 179.274 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -52.3 -42.08 63.47 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 121.037 0.446 . . . . 0.0 110.237 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.937 HD13 HD21 ' A' ' 61' ' ' LEU . 1.6 mt -64.86 -62.98 1.24 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.655 179.346 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.52 HG23 HG23 ' A' ' 56' ' ' ILE . 49.7 m -47.47 -53.43 14.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.483 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.76 -36.55 16.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.976 178.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.529 ' ND1' HD21 ' A' ' 78' ' ' LEU . 33.4 t60 -73.26 -8.28 55.15 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.738 -179.649 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' PHE . . . . . 0.459 ' CD1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.36 33.47 0.88 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.818 0.342 . . . . 0.0 110.803 -179.912 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.886 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.531 ' CD1' HD21 ' A' ' 52' ' ' LEU . 11.9 m-85 . . . . . 0 C--O 1.231 0.094 0 CA-C-O 121.015 0.436 . . . . 0.0 110.465 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.477 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 58.5 p -73.44 -53.78 9.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.615 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.762 ' HA ' HD12 ' A' ' 52' ' ' LEU . 2.5 pt-20 167.54 -39.07 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.123 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.01 -57.6 11.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.241 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.454 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.5 tp10 -59.15 -40.51 85.79 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 179.495 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.762 HD12 ' HA ' ' A' ' 49' ' ' GLU . 30.7 mt -59.7 -51.78 68.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.236 178.755 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.838 ' HA ' HD12 ' A' ' 56' ' ' ILE . 37.8 tttm -53.56 -48.26 69.29 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.1 0.476 . . . . 0.0 109.835 178.973 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 78.4 m -56.55 -42.12 78.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.556 178.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.454 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 27.0 m170 -60.49 -49.65 76.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.573 178.588 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.838 HD12 ' HA ' ' A' ' 53' ' ' LYS . 8.6 mt -57.45 -49.31 80.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.159 179.323 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.49 -70.8 0.08 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.544 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 74.6 mttt -61.01 -77.12 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.135 -179.612 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 151.94 35.72 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.777 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.9 p -100.89 -13.65 18.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.715 0.293 . . . . 0.0 110.93 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.446 HD11 HD22 ' A' ' 91' ' ' LEU . 14.8 tp -58.71 -26.82 64.28 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.92 0.391 . . . . 0.0 110.47 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.721 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -87.21 5.32 85.33 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.512 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -91.03 -54.46 3.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.983 0.42 . . . . 0.0 110.185 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -48.82 148.91 1.98 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.188 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.8 p -73.35 -166.02 0.3 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.96 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.551 HG22 ' HB3' ' A' ' 84' ' ' LYS . 52.4 t -75.5 -57.34 1.64 Allowed Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.056 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.512 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 4.4 Cg_endo -47.37 -27.87 7.63 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.247 1.965 . . . . 0.0 111.869 179.679 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -79.24 -50.16 11.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.842 179.076 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.792 ' CB ' HD13 ' A' ' 87' ' ' LEU . 14.4 mt -61.5 -39.04 89.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.163 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -52.25 -44.47 64.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.989 179.397 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -53.76 -52.11 61.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.946 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.658 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.99 -43.09 86.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.643 179.536 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -40.26 88.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.641 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.12 -35.58 79.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.795 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.08 -32.63 44.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.202 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -84.92 -28.85 25.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.2 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.83 33.81 50.04 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.53 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.452 HD13 ' HB1' ' A' ' 90' ' ' ALA . 0.9 OUTLIER -82.39 178.16 8.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.833 0.349 . . . . 0.0 111.286 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -102.34 76.74 1.59 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.004 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.424 ' HB3' HD23 ' A' ' 87' ' ' LEU . 24.1 t -161.35 -163.06 0.95 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.749 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.764 ' HA2' HD21 ' A' ' 87' ' ' LEU . . . 134.8 -32.1 2.64 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.729 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mt -80.6 -73.18 0.38 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.973 0.416 . . . . 0.0 111.284 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.2 mtmm -80.45 110.16 15.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.575 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.739 ' HA ' HD12 ' A' ' 87' ' ' LEU . 10.0 ptmm? -47.06 -52.92 13.85 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.907 179.519 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -49.12 -37.67 22.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.134 0.492 . . . . 0.0 110.054 179.115 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -70.54 -33.16 70.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.932 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.792 HD13 ' CB ' ' A' ' 69' ' ' LEU . 62.5 mt -61.8 -43.48 98.76 Favored 'General case' 0 CA--C 1.52 -0.18 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.721 HD21 ' CA ' ' A' ' 62' ' ' GLY . 3.7 mp -52.93 -60.39 3.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.28 178.473 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -48.72 -47.53 41.15 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.645 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.452 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -53.62 -46.31 70.41 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.059 0.457 . . . . 0.0 110.286 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.729 HD12 ' O ' ' A' ' 87' ' ' LEU . 0.8 OUTLIER -67.15 -56.13 11.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.44 179.055 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.667 ' OG1' HG23 ' A' ' 56' ' ' ILE . 1.0 OUTLIER -50.04 -56.96 8.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.555 179.886 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.443 ' HG2' ' HA ' ' A' ' 90' ' ' ALA . 0.0 OUTLIER -50.05 -28.29 6.85 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.161 179.537 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.414 ' N ' ' HG3' ' A' ' 93' ' ' LYS . 3.0 t60 -89.86 5.35 46.61 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.818 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' PHE . . . . . 0.555 ' CZ ' ' HD2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -146.14 11.31 1.18 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 121.02 -0.272 . . . . 0.0 111.442 179.973 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.333 -0.145 0 CA-C-O 120.804 0.335 . . . . 0.0 110.881 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.657 ' HB3' HD21 ' A' ' 52' ' ' LEU . 68.9 m-85 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 121.091 0.472 . . . . 0.0 110.792 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.517 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 35.6 p -74.12 -55.15 6.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.462 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.846 ' HA ' HD12 ' A' ' 52' ' ' LEU . 10.8 pt-20 170.25 -40.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.114 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -55.78 -55.24 34.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.962 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.464 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.9 tt0 -59.88 -41.6 91.95 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.152 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.846 HD12 ' HA ' ' A' ' 49' ' ' GLU . 30.4 mt -58.54 -53.42 58.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.205 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.501 ' HG2' ' CE2' ' A' ' 95' ' ' PHE . 0.8 OUTLIER -53.1 -47.56 68.48 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.068 0.461 . . . . 0.0 109.888 179.105 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.0 m -58.7 -44.76 90.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.615 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.464 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 12.8 m-70 -59.26 -50.82 72.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.815 178.859 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.572 HG13 HD22 ' A' ' 61' ' ' LEU . 40.9 mt -57.18 -46.26 84.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.98 179.256 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.5 m -52.45 -73.91 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.511 -179.635 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp -61.35 -69.01 0.26 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.956 -179.593 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 143.44 37.29 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.658 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 19.3 p -100.92 -13.69 18.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.545 0.212 . . . . 0.0 111.015 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.822 ' C ' HD11 ' A' ' 88' ' ' LEU . 14.5 tp -59.07 -32.06 69.44 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.009 0.433 . . . . 0.0 110.236 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.54 ' N ' HD11 ' A' ' 88' ' ' LEU . . . -80.16 6.15 60.81 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.73 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.31 -50.29 6.21 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 120.927 0.394 . . . . 0.0 110.403 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -49.11 149.22 2.06 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.348 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 31.5 p -73.71 -162.86 0.14 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.663 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.489 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 24.6 t -75.67 -59.17 1.26 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.884 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 5.4 Cg_endo -47.48 -29.39 10.11 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.275 1.984 . . . . 0.0 111.877 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -79.69 -44.84 20.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.89 179.183 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.805 HD13 ' HB2' ' A' ' 87' ' ' LEU . 15.9 mt -61.32 -48.87 79.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.129 179.041 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.555 ' CD ' HD21 ' A' ' 87' ' ' LEU . 20.6 mmmt -52.64 -34.11 49.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.298 179.053 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -56.3 -55.84 28.39 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.855 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.64 ' CB ' HD21 ' A' ' 91' ' ' LEU . . . -57.63 -45.55 85.27 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.994 0.426 . . . . 0.0 110.317 179.422 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 91.3 m -60.59 -43.12 97.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.239 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -35.08 78.36 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.546 179.518 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.19 -37.93 72.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.741 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -83.88 -23.28 31.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.132 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.3 24.21 29.62 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.341 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.4 mt -81.17 -174.27 4.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.788 0.327 . . . . 0.0 110.989 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.16 71.3 1.39 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.063 0.459 . . . . 0.0 110.505 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.693 ' CB ' HD23 ' A' ' 87' ' ' LEU . 3.0 m -76.52 -170.9 1.65 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.024 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.854 ' C ' HD22 ' A' ' 82' ' ' LEU . . . -116.69 -129.04 4.26 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.691 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.854 HD22 ' C ' ' A' ' 81' ' ' GLY . 2.5 mm? -147.03 9.8 0.99 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.498 0.189 . . . . 0.0 111.143 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.5 tptm -84.04 6.0 23.78 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.599 0.238 . . . . 0.0 111.23 179.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.7 mtmm 72.13 -78.34 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.518 -179.552 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -51.1 -32.15 21.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.901 0.381 . . . . 0.0 111.008 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -64.16 -40.03 95.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.919 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.805 ' HB2' HD13 ' A' ' 69' ' ' LEU . 1.2 mt -61.11 -42.78 99.16 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 179.314 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.822 HD11 ' C ' ' A' ' 61' ' ' LEU . 4.5 mm? -50.72 -53.65 29.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.502 179.006 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -50.85 -53.23 34.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.872 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -53.24 -43.29 67.2 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.133 0.492 . . . . 0.0 110.261 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.64 HD21 ' CB ' ' A' ' 72' ' ' ALA . 0.6 OUTLIER -66.11 -58.11 6.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.264 179.143 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.426 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.9 m -50.74 -59.13 4.41 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.018 179.701 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.4 tptm -47.63 -31.51 4.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.235 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -75.33 -44.19 46.65 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.367 -179.654 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' PHE . . . . . 0.501 ' CE2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -92.81 3.68 55.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.623 -179.641 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' A' ' 92' ' ' THR . 1.4 tp-100 . . . . . 0 C--N 1.332 -0.181 0 CA-C-O 120.788 0.328 . . . . 0.0 110.726 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 . . . . . 0 N--CA 1.453 -0.295 0 CA-C-O 121.253 0.549 . . . . 0.0 110.251 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.8 p -163.61 -33.11 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.218 -179.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.636 ' HA ' HD12 ' A' ' 52' ' ' LEU . 0.0 OUTLIER 169.07 -56.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.287 179.576 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.0 -53.79 44.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.695 0.284 . . . . 0.0 110.835 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.443 ' HG3' ' CE1' ' A' ' 55' ' ' HIS . 1.1 tp10 -61.11 -40.77 95.02 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.886 HD22 ' CD2' ' A' ' 91' ' ' LEU . 45.2 mt -59.7 -52.33 65.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.182 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.49 ' HG2' ' CZ ' ' A' ' 95' ' ' PHE . 1.2 mmtp -52.76 -47.97 67.11 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.016 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.8 m -57.23 -45.7 83.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.271 178.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.443 ' CE1' ' HG3' ' A' ' 51' ' ' GLU . 27.1 m170 -60.94 -52.93 62.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.828 178.673 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 24.7 mt -57.75 -38.45 65.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.057 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.4 t -52.31 -75.21 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.408 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -61.52 -70.48 0.19 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.946 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 150.53 34.93 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.774 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.8 p -101.96 -15.07 16.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.742 0.306 . . . . 0.0 111.022 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.854 HD13 ' O ' ' A' ' 61' ' ' LEU . 2.8 tm? -58.57 -26.72 63.9 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.895 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.454 ' HA2' HD21 ' A' ' 88' ' ' LEU . . . -93.09 2.56 71.95 Favored Glycine 0 C--N 1.33 0.242 0 C-N-CA 120.766 -0.731 . . . . 0.0 113.034 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.5 mtmm -91.87 -38.67 12.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.929 0.395 . . . . 0.0 110.586 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.44 ' CE2' ' HA ' ' A' ' 61' ' ' LEU . 28.6 m-85 -47.08 152.66 0.52 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.511 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.64 -171.56 1.06 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.014 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.496 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 69.2 t -75.83 -58.25 1.38 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.696 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 9.3 Cg_endo -52.31 -28.32 34.17 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.047 1.831 . . . . 0.0 111.489 179.318 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.7 mtm -79.57 -45.94 18.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.9 179.157 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.896 ' CB ' HD13 ' A' ' 87' ' ' LEU . 27.2 mt -61.67 -44.05 97.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.346 179.175 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.71 -36.38 46.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.732 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -55.51 -53.1 60.52 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.637 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.688 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -58.05 -44.92 87.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.575 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.474 ' SG ' HD23 ' A' ' 87' ' ' LEU . 1.7 m -58.83 -40.69 84.96 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.935 179.336 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.79 -36.53 83.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.191 179.127 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.68 -32.56 65.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.642 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.483 ' CE2' HD13 ' A' ' 52' ' ' LEU . 1.5 m-85 -82.92 -34.21 26.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.773 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 97.61 15.63 36.73 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.584 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.039 HD13 ' HB1' ' A' ' 90' ' ' ALA . 0.9 OUTLIER -81.41 159.83 24.2 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.794 0.331 . . . . 0.0 110.891 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.49 28.19 6.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.161 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.75 -173.38 3.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.874 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.476 ' HA2' HD21 ' A' ' 87' ' ' LEU . . . 117.0 -145.67 18.73 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.767 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 81' ' ' GLY . 5.2 mt 68.3 -67.77 0.19 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.022 0.439 . . . . 0.0 110.847 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -83.73 -95.63 0.06 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.909 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.44 -61.34 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.9 0.381 . . . . 0.0 109.995 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.437 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 1.0 OUTLIER -55.13 -46.61 75.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.702 179.128 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -44.13 -35.85 2.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.073 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.896 HD13 ' CB ' ' A' ' 69' ' ' LEU . 15.9 mt -63.04 -43.93 97.32 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.454 HD21 ' HA2' ' A' ' 62' ' ' GLY . 1.8 mp -51.76 -55.4 19.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.161 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.54 -52.13 41.58 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.817 179.73 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 1.039 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.68 -42.7 65.0 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 121.188 0.518 . . . . 0.0 110.055 179.273 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.886 ' CD2' HD22 ' A' ' 52' ' ' LEU . 0.4 OUTLIER -67.19 -60.32 2.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.48 178.996 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.1 m -50.03 -54.95 16.82 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.273 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 30.6 mttm -49.61 -33.06 14.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.035 179.185 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.481 ' CE1' ' CD1' ' A' ' 76' ' ' TYR . 2.1 t-160 -83.89 1.1 44.92 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.676 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' PHE . . . . . 0.49 ' CZ ' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.75 22.4 1.0 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.749 0.309 . . . . 0.0 111.05 179.751 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.331 -0.201 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.891 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.732 ' HB3' HD21 ' A' ' 52' ' ' LEU . 30.2 m-85 . . . . . 0 C--O 1.231 0.107 0 CA-C-O 121.046 0.451 . . . . 0.0 111.031 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 90.5 p -74.02 -52.65 12.07 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.661 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.5 ' HA ' HD12 ' A' ' 52' ' ' LEU . 3.4 mt-10 164.31 -36.45 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.348 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -60.16 3.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.258 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.503 ' HG2' ' CE1' ' A' ' 55' ' ' HIS . 0.2 OUTLIER -58.72 -40.48 83.85 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.402 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.732 HD21 ' HB3' ' A' ' 47' ' ' TYR . 68.1 mt -59.47 -51.89 67.96 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.247 178.802 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.46 ' HG2' ' CD2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.5 -48.09 69.27 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.152 0.501 . . . . 0.0 109.872 179.115 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.2 m -57.8 -42.24 83.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.708 178.886 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.503 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 26.3 m170 -60.07 -48.94 79.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.916 178.96 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 55.6 mt -57.24 -47.72 83.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.143 179.419 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -53.08 -73.76 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.542 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.83 -70.81 0.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.279 -179.441 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 144.34 36.18 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.868 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.573 HG22 ' HD2' ' A' ' 63' ' ' LYS . 0.6 OUTLIER -99.88 -10.49 21.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.705 0.288 . . . . 0.0 110.898 179.583 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.83 HD11 HD22 ' A' ' 91' ' ' LEU . 28.8 tp -59.05 -21.27 58.85 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.829 0.347 . . . . 0.0 110.507 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.742 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -90.77 16.86 57.23 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.435 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.573 ' HD2' HG22 ' A' ' 60' ' ' THR . 10.8 mtpt -89.66 -47.25 8.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.008 0.433 . . . . 0.0 110.356 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.404 ' HB2' ' HG ' ' A' ' 69' ' ' LEU . 73.1 m-85 -48.17 153.41 0.7 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.489 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.592 ' O ' HG23 ' A' ' 66' ' ' VAL . 55.0 m -74.94 -81.62 0.07 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.602 -179.757 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.592 HG23 ' O ' ' A' ' 65' ' ' THR . 3.8 t -160.42 -64.84 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.131 -178.86 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.499 ' CD ' ' HB ' ' A' ' 66' ' ' VAL . 10.2 Cg_endo -50.63 -26.11 16.29 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.264 1.976 . . . . 0.0 110.912 178.855 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.7 mtm -78.6 -43.2 26.98 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.535 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.604 ' HB2' HD13 ' A' ' 87' ' ' LEU . 19.8 mt -62.63 -44.34 96.54 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.457 179.06 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.3 mmtt -51.3 -34.56 33.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.656 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.446 ' HB3' ' CD2' ' A' ' 47' ' ' TYR . 2.3 tp10 -55.8 -55.44 32.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.799 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.94 88.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.96 0.41 . . . . 0.0 110.36 179.402 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 80.5 m -60.4 -40.94 92.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.248 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.6 ttm-85 -61.69 -36.9 82.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.133 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.43 -28.52 56.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.541 179.351 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.445 ' CE1' ' HG3' ' A' ' 49' ' ' GLU . 3.3 m-85 -83.02 -32.6 26.81 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.705 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.67 16.71 59.58 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.62 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.504 HD13 ' O ' ' A' ' 90' ' ' ALA . 4.0 mt -81.85 -165.61 1.02 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.877 0.37 . . . . 0.0 111.115 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -133.96 74.98 1.57 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.321 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.462 ' HG ' HD23 ' A' ' 87' ' ' LEU . 4.3 p -74.54 -176.44 2.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.288 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -113.18 165.52 12.05 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.842 -179.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -81.83 1.38 35.12 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.07 -75.54 0.24 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.721 0.296 . . . . 0.0 110.686 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.665 ' HA ' HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER 166.82 -71.41 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.593 179.531 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.533 ' HA ' HD13 ' A' ' 88' ' ' LEU . 5.7 tp60 -51.06 -30.76 16.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.852 0.358 . . . . 0.0 111.106 179.651 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -58.92 -39.68 82.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.746 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.665 HD12 ' HA ' ' A' ' 84' ' ' LYS . 1.1 mt -61.58 -43.94 97.94 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.742 HD21 ' CA ' ' A' ' 62' ' ' GLY . 4.0 mp -51.78 -53.91 34.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.134 178.572 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -50.23 -53.15 30.2 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.867 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.504 ' O ' HD13 ' A' ' 78' ' ' LEU . . . -51.89 -44.01 63.58 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.145 0.498 . . . . 0.0 110.341 179.381 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.83 HD22 HD11 ' A' ' 61' ' ' LEU . 0.5 OUTLIER -67.39 -57.15 7.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.352 178.981 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.2 m -50.46 -56.64 10.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.544 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -49.52 -31.06 9.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.052 179.374 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 19.1 t60 -75.76 -9.28 58.46 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.655 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' PHE . . . . . 0.46 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.21 29.98 0.95 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.862 0.363 . . . . 0.0 110.955 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.807 179.764 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.899 ' HB3' HD21 ' A' ' 52' ' ' LEU . 15.7 m-85 . . . . . 0 C--O 1.232 0.134 0 CA-C-O 121.09 0.471 . . . . 0.0 110.899 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.12 -46.74 40.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.719 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.849 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.5 tt0 166.91 -43.02 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.386 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.1 -55.97 25.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.016 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.457 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 3.5 tt0 -59.72 -40.89 89.51 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.128 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.905 HD22 ' CD2' ' A' ' 91' ' ' LEU . 26.8 mt -59.24 -52.81 64.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.245 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.706 ' O ' HG22 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -53.89 -46.38 71.38 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 121.256 0.551 . . . . 0.0 110.126 179.2 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.9 m -59.48 -43.53 93.26 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.457 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 28.1 m170 -60.49 -51.65 68.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.99 178.814 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.706 HG22 ' O ' ' A' ' 53' ' ' LYS . 8.8 tt -58.54 -44.85 90.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-O 120.841 0.353 . . . . 0.0 110.617 179.48 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.2 m -56.59 -63.48 1.18 Allowed 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.869 179.626 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.403 ' N ' ' CD ' ' A' ' 58' ' ' LYS . 8.9 mptt -62.19 -50.52 71.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.953 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.8 23.63 4.59 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.495 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 38.2 p -101.07 1.08 39.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.498 0.19 . . . . 0.0 111.512 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.609 HD23 HD23 ' A' ' 88' ' ' LEU . 47.5 tp -59.63 -26.85 65.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.778 0.323 . . . . 0.0 110.923 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.684 ' HA3' HD11 ' A' ' 88' ' ' LEU . . . -92.87 12.89 68.92 Favored Glycine 0 CA--C 1.518 0.267 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.738 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -91.67 -51.55 5.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.851 0.358 . . . . 0.0 110.676 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -46.78 158.11 0.13 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.166 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 26.4 p -72.84 -167.83 0.41 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.886 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.873 HG12 ' HD3' ' A' ' 70' ' ' LYS . 55.9 t -76.76 -59.58 0.95 Allowed Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.209 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.522 ' HA ' ' CD ' ' A' ' 70' ' ' LYS . 3.8 Cg_endo -46.42 -29.68 7.42 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.526 2.151 . . . . 0.0 112.144 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 29.4 mtm -79.2 -44.72 21.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.167 0.508 . . . . 0.0 109.993 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.718 ' HB2' HD13 ' A' ' 87' ' ' LEU . 29.6 mt -64.73 -55.64 18.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.071 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.873 ' HD3' HG12 ' A' ' 66' ' ' VAL . 0.0 OUTLIER -51.19 -27.3 8.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.748 0.309 . . . . 0.0 110.784 179.865 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -57.53 -53.05 62.54 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.586 179.425 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.682 ' CB ' HD21 ' A' ' 91' ' ' LEU . . . -59.01 -48.32 82.0 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.986 0.422 . . . . 0.0 110.357 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.403 ' CB ' ' HB2' ' A' ' 78' ' ' LEU . 90.8 m -61.33 -40.73 95.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.666 179.45 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -61.77 -36.22 80.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.675 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.19 -44.87 64.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.611 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -88.71 10.02 22.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.574 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.37 44.67 76.56 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.86 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.696 HD12 ' HB1' ' A' ' 90' ' ' ALA . 3.6 mm? -81.33 -177.95 6.71 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.827 0.346 . . . . 0.0 110.919 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.44 -43.87 7.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.826 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.678 ' HB2' HD23 ' A' ' 87' ' ' LEU . 8.2 p 45.99 -164.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.367 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.42 ' N ' ' HB3' ' A' ' 86' ' ' GLU . . . -137.88 -108.71 0.86 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.727 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -160.49 -31.35 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.738 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -65.96 0.88 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.689 0.281 . . . . 0.0 111.205 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.821 ' HA ' HD12 ' A' ' 87' ' ' LEU . 0.8 OUTLIER 173.36 -64.57 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.102 179.99 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.543 ' HA ' HD12 ' A' ' 88' ' ' LEU . 29.8 tt0 -46.9 -34.89 5.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.876 0.37 . . . . 0.0 111.189 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.42 ' HB3' ' N ' ' A' ' 81' ' ' GLY . 3.7 mm-40 -59.91 -44.57 94.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.565 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.821 HD12 ' HA ' ' A' ' 84' ' ' LYS . 1.3 mt -61.78 -43.04 99.64 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.112 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.684 HD11 ' HA3' ' A' ' 62' ' ' GLY . 3.8 mt -50.64 -50.99 53.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.425 178.804 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -51.05 -54.61 23.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.105 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.696 ' HB1' HD12 ' A' ' 78' ' ' LEU . . . -55.12 -43.4 74.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.95 0.405 . . . . 0.0 110.909 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.905 ' CD2' HD22 ' A' ' 52' ' ' LEU . 0.8 OUTLIER -69.12 -49.02 60.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.498 179.438 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.574 HG22 ' N ' ' A' ' 93' ' ' LYS . 0.7 OUTLIER -52.4 -61.32 2.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.711 -179.988 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.654 ' HD2' HD11 ' A' ' 78' ' ' LEU . 0.0 OUTLIER -48.87 -28.38 3.72 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.731 0.301 . . . . 0.0 111.058 179.557 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 -72.89 -23.6 60.74 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.262 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' PHE . . . . . 0.506 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.06 45.13 1.08 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.889 0.376 . . . . 0.0 111.014 -179.856 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.466 ' HB2' HD11 ' A' ' 56' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.937 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.406 ' HB3' HD21 ' A' ' 52' ' ' LEU . 24.8 m-85 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.987 0.422 . . . . 0.0 111.128 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.508 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 91.2 p -72.28 -52.83 14.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.283 179.642 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.852 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.8 pt-20 165.4 -34.68 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.009 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -60.13 4.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.062 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.441 ' HG3' ' CE1' ' A' ' 55' ' ' HIS . 0.1 OUTLIER -59.23 -39.75 83.71 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.251 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.852 HD12 ' HA ' ' A' ' 49' ' ' GLU . 22.3 mt -60.21 -51.56 69.07 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.155 178.767 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.493 ' HA ' HD12 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -53.72 -48.39 69.65 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.86 179.045 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.1 m -57.89 -45.09 86.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.605 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.443 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 14.8 m-70 -59.56 -51.01 71.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.808 178.83 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.493 HD12 ' HA ' ' A' ' 53' ' ' LYS . 20.3 mt -56.84 -45.12 83.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.844 179.325 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.4 m -52.94 -70.74 0.08 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.352 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.6 mttp -61.56 -79.75 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.029 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 157.49 33.26 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.885 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 17.0 p -102.77 -12.46 17.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.734 0.302 . . . . 0.0 111.037 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.857 HD13 ' O ' ' A' ' 61' ' ' LEU . 3.1 tm? -59.65 -27.09 66.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.802 0.334 . . . . 0.0 110.81 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.499 ' HA2' HD21 ' A' ' 88' ' ' LEU . . . -90.22 11.13 71.98 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.755 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.74 -47.01 7.59 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.879 0.371 . . . . 0.0 110.557 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -47.43 146.6 1.99 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.388 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.57 ' O ' HD12 ' A' ' 69' ' ' LEU . 32.6 p -73.71 -169.84 0.77 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.118 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.563 HG22 ' CA ' ' A' ' 84' ' ' LYS . 78.8 t -76.4 -56.24 1.54 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.507 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.534 ' HA ' ' CD ' ' A' ' 70' ' ' LYS . 5.5 Cg_endo -48.29 -35.94 28.53 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.341 2.027 . . . . 0.0 112.233 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 26.9 mtp -81.69 -34.34 30.72 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.78 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.877 ' CB ' HD13 ' A' ' 87' ' ' LEU . 7.5 mt -63.04 -52.89 61.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.572 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.534 ' CD ' ' HA ' ' A' ' 67' ' ' PRO . 0.5 OUTLIER -49.45 -29.87 7.22 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.868 0.366 . . . . 0.0 111.026 -179.663 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.418 ' N ' ' HG2' ' A' ' 70' ' ' LYS . 2.0 tt0 -57.32 -55.34 36.08 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.357 179.415 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.426 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -58.91 -40.2 83.81 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.29 179.139 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.723 ' SG ' HD23 ' A' ' 87' ' ' LEU . 7.7 m -60.12 -40.58 90.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.391 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.94 -36.43 81.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.466 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.87 -32.74 59.84 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.63 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.499 ' CD2' ' CG ' ' A' ' 94' ' ' HIS . 3.2 m-30 -84.17 -23.91 30.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.971 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 82.36 23.76 55.87 Favored Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.492 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' A' ' 73' ' ' CYS . 1.4 mt -81.81 170.48 15.65 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.922 0.392 . . . . 0.0 111.155 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -111.47 81.16 1.4 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.76 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -159.5 -171.22 3.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.084 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.62 ' HA2' HD21 ' A' ' 87' ' ' LEU . . . 109.38 48.54 0.8 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.667 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -158.51 19.24 0.22 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.586 0.232 . . . . 0.0 111.576 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.432 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -159.15 6.49 0.1 Allowed 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -179.915 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.563 ' CA ' HG22 ' A' ' 66' ' ' VAL . 16.5 ttpp 69.13 -82.4 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.604 0.24 . . . . 0.0 110.895 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.673 ' HA ' HD22 ' A' ' 88' ' ' LEU . 34.1 tt0 -49.04 -45.38 42.65 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.897 0.379 . . . . 0.0 111.249 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.432 ' HB2' ' HB3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -47.28 -39.38 14.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.902 179.978 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.877 HD13 ' CB ' ' A' ' 69' ' ' LEU . 1.7 mt -62.57 -43.93 97.58 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.27 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.673 HD22 ' HA ' ' A' ' 85' ' ' GLN . 1.2 mp -51.97 -53.55 40.09 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.139 178.79 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -50.79 -52.97 35.83 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.812 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.48 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.85 -43.83 66.34 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.02 0.438 . . . . 0.0 110.496 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.724 HD13 HD11 ' A' ' 61' ' ' LEU . 0.7 OUTLIER -66.29 -54.87 19.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.425 179.341 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.419 HG22 ' N ' ' A' ' 93' ' ' LYS . 0.9 OUTLIER -50.58 -59.41 4.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.373 179.802 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.419 ' N ' HG22 ' A' ' 92' ' ' THR . 1.5 ptmm? -48.24 -31.2 5.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.214 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.499 ' CG ' ' CD2' ' A' ' 76' ' ' TYR . 51.3 t-80 -74.26 -17.9 60.8 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.712 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' PHE . . . . . 0.484 ' CD1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -146.87 38.04 0.99 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.945 0.402 . . . . 0.0 110.855 -179.831 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.401 ' NE2' ' CG2' ' A' ' 92' ' ' THR . 1.7 tt0 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.876 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.454 ' HB3' HD21 ' A' ' 52' ' ' LEU . 28.0 m-85 . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.988 0.423 . . . . 0.0 110.718 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.405 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 1.1 p -72.05 -42.83 65.81 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.637 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.866 ' HA ' HD12 ' A' ' 52' ' ' LEU . 3.4 mt-10 163.79 -43.94 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.536 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.0 -56.28 21.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.173 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.455 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.0 OUTLIER -60.02 -40.33 88.94 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.327 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.866 HD12 ' HA ' ' A' ' 49' ' ' GLU . 19.8 mt -59.9 -51.73 68.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.247 178.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.877 ' HA ' HD12 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -54.07 -47.84 71.25 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-O 121.073 0.463 . . . . 0.0 109.938 179.071 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.5 m -57.81 -42.61 84.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.685 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.456 ' CE1' ' HZ ' ' A' ' 64' ' ' PHE . 28.9 m170 -59.61 -49.29 78.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.829 178.935 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.877 HD12 ' HA ' ' A' ' 53' ' ' LYS . 6.9 mt -57.36 -48.36 82.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.988 179.313 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 2.4 m -53.78 -63.54 1.12 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.54 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 30.4 mttm -60.85 -46.45 90.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.254 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 116.98 20.78 4.76 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.692 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 21.8 p -97.87 -8.44 28.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.613 0.244 . . . . 0.0 111.047 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.729 ' O ' HD22 ' A' ' 88' ' ' LEU . 3.4 tm? -58.87 -29.37 66.94 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.654 0.264 . . . . 0.0 110.378 179.618 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.575 ' HA2' HD22 ' A' ' 88' ' ' LEU . . . -85.0 10.67 62.29 Favored Glycine 0 CA--C 1.52 0.387 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.536 179.52 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -95.48 -40.71 9.33 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.781 0.324 . . . . 0.0 111.641 -179.547 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.456 ' HZ ' ' CE1' ' A' ' 55' ' ' HIS . 86.0 m-85 -44.74 144.74 1.06 Allowed 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -179.061 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.629 ' O ' HD12 ' A' ' 69' ' ' LEU . 15.8 p -74.24 -171.68 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.54 179.334 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.516 ' HB ' ' HD3' ' A' ' 67' ' ' PRO . 70.6 t -76.81 -46.23 3.0 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.65 -179.625 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.516 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 39.6 Cg_exo -60.42 -30.28 90.54 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.13 1.887 . . . . 0.0 111.952 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' MET . . . . . 0.412 ' HE3' ' N ' ' A' ' 68' ' ' MET . 0.0 OUTLIER -81.45 -39.15 25.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.301 179.656 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.949 HD21 HD23 ' A' ' 88' ' ' LEU . 11.5 mt -61.01 -40.96 95.53 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.147 179.835 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -52.33 -42.0 63.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.949 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.39 -53.52 56.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.411 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.993 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -56.26 -50.36 71.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.942 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -59.58 -37.43 78.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.194 179.416 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -62.46 -37.74 87.08 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.161 179.269 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.88 -27.99 49.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.744 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -82.09 -37.94 25.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.939 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 100.75 18.19 21.29 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.923 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.48 HD13 ' HB1' ' A' ' 90' ' ' ALA . 21.0 mt -81.15 -166.71 1.21 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.696 0.284 . . . . 0.0 110.737 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.428 ' O ' ' O ' ' A' ' 80' ' ' SER . 0.2 OUTLIER -96.26 -43.85 7.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.774 179.813 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.428 ' O ' ' O ' ' A' ' 79' ' ' LYS . 0.0 OUTLIER 57.71 138.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.434 179.527 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.414 ' O ' ' HB2' ' A' ' 82' ' ' LEU . . . 147.17 -165.93 28.55 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.231 -0.985 . . . . 0.0 113.086 179.57 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.602 ' N ' HD12 ' A' ' 82' ' ' LEU . 4.7 mp 68.83 -67.4 0.21 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.961 0.41 . . . . 0.0 110.793 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.65 152.85 16.43 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.248 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.729 ' HA ' HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -44.37 -54.61 5.68 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.895 179.548 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.923 ' HA ' HD12 ' A' ' 88' ' ' LEU . 3.8 tt0 -46.19 -43.65 15.4 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.014 0.435 . . . . 0.0 110.3 179.238 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -60.91 -42.2 97.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.504 178.795 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.729 HD12 ' HA ' ' A' ' 84' ' ' LYS . 26.6 mt -62.72 -54.25 42.12 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 178.264 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.949 HD23 HD21 ' A' ' 69' ' ' LEU . 4.3 mt -53.44 -52.07 60.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.679 178.369 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.37 -49.21 70.36 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.572 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.48 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -51.83 -42.69 62.75 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 121.128 0.49 . . . . 0.0 110.01 179.303 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.993 HD21 ' HB1' ' A' ' 72' ' ' ALA . 0.4 OUTLIER -64.82 -62.46 1.55 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.247 178.887 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 18.0 m -49.55 -57.51 6.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.101 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -47.06 -30.8 2.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.138 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -65.83 -52.92 46.45 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.627 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' PHE . . . . . 0.486 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -90.91 -9.82 44.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.799 -179.386 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 C--N 1.33 -0.261 0 CA-C-O 120.863 0.363 . . . . 0.0 110.908 179.809 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.739 ' HB3' HD21 ' A' ' 52' ' ' LEU . 22.4 m-85 . . . . . 0 N--CA 1.457 -0.09 0 CA-C-O 120.998 0.428 . . . . 0.0 110.729 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.557 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 78.9 p -71.18 -55.54 7.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.424 179.755 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.64 ' HA ' HD12 ' A' ' 52' ' ' LEU . 4.6 pt-20 170.38 -37.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.446 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -57.46 -55.28 36.9 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.703 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.444 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 2.1 tt0 -61.35 -41.56 97.25 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.006 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.739 HD21 ' HB3' ' A' ' 47' ' ' TYR . 43.3 mt -59.65 -50.58 73.29 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.14 178.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.491 ' HG2' ' CD2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -52.58 -49.86 64.16 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.011 178.957 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 94.5 m -59.3 -42.42 91.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.012 179.082 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.444 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 29.4 m170 -58.44 -50.04 75.13 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 36.8 mt -58.27 -56.86 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.514 178.072 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.9 p -67.36 46.59 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.117 179.077 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -175.6 -58.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.744 0.307 . . . . 0.0 111.019 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 125.25 24.2 1.65 Allowed Glycine 0 CA--C 1.518 0.257 0 C-N-CA 120.659 -0.782 . . . . 0.0 113.036 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.7 -11.92 20.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.599 0.238 . . . . 0.0 111.097 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.963 HD11 HD13 ' A' ' 91' ' ' LEU . 17.8 tp -58.81 -22.61 58.87 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.815 0.34 . . . . 0.0 110.602 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -91.05 19.37 46.62 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.343 179.465 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.41 -58.34 2.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.037 0.446 . . . . 0.0 110.214 179.732 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -49.54 152.32 1.4 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.397 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 22.4 p -74.14 -167.09 0.47 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.881 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.569 HG13 HD11 ' A' ' 87' ' ' LEU . 55.3 t -77.14 -57.42 1.12 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.276 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.508 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 6.2 Cg_endo -48.89 -31.42 19.95 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.358 2.039 . . . . 0.0 112.139 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 45.8 mtm -79.46 -39.54 31.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.249 179.485 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.781 HD13 ' HB2' ' A' ' 87' ' ' LEU . 8.8 mt -61.12 -39.69 90.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.631 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.74 -36.77 58.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.891 179.725 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -55.52 -52.49 63.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.925 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.828 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.58 -42.85 83.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.731 179.763 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.54 ' HA ' HD12 ' A' ' 78' ' ' LEU . 8.8 m -59.84 -38.91 83.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.681 179.664 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 mtt-85 -62.07 -36.33 81.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.671 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -81.14 -29.89 34.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.082 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CD2' ' CG ' ' A' ' 94' ' ' HIS . 2.8 m-30 -84.82 -25.64 27.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.105 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.59 21.73 49.88 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.592 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.54 HD12 ' HA ' ' A' ' 73' ' ' CYS . 2.8 mt -81.27 -175.93 5.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.866 0.365 . . . . 0.0 110.961 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.2 tmtt? -97.47 -40.35 8.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.029 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.547 ' HB2' HD23 ' A' ' 87' ' ' LEU . 0.0 OUTLIER 69.68 173.52 0.3 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.768 -179.987 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -138.23 -130.27 2.78 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.588 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.431 ' HA ' HD23 ' A' ' 82' ' ' LEU . 12.3 mt -159.18 53.1 0.39 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.004 0.43 . . . . 0.0 110.744 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.15 10.16 0.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.803 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 75.03 -71.94 0.12 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.816 0.341 . . . . 0.0 110.755 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.401 ' HA ' ' HG ' ' A' ' 88' ' ' LEU . 0.5 OUTLIER -47.33 -34.81 7.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.405 179.947 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -62.04 -45.29 94.24 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.057 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.781 ' HB2' HD13 ' A' ' 69' ' ' LEU . 1.2 mt -60.96 -42.62 98.63 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.573 HD21 HD11 ' A' ' 69' ' ' LEU . 6.8 mt -52.61 -53.28 48.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.273 178.585 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.78 -52.47 40.54 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.799 179.696 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.417 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -53.12 -45.03 68.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.005 0.431 . . . . 0.0 110.52 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.963 HD13 HD11 ' A' ' 61' ' ' LEU . 3.1 mt -66.52 -53.8 30.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.347 179.202 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.45 HG22 ' N ' ' A' ' 93' ' ' LYS . 0.9 OUTLIER -51.5 -60.49 3.08 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.448 179.859 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.45 ' N ' HG22 ' A' ' 92' ' ' THR . 1.6 pttt -48.12 -28.96 3.21 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.801 0.334 . . . . 0.0 110.975 179.48 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.5 ' CG ' ' CD2' ' A' ' 76' ' ' TYR . 3.0 t60 -67.54 -58.49 4.62 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.673 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' PHE . . . . . 0.491 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -95.82 22.4 7.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.256 179.887 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 C--N 1.331 -0.229 0 CA-C-O 120.809 0.338 . . . . 0.0 110.72 179.935 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.678 ' HB3' HD21 ' A' ' 52' ' ' LEU . 25.7 m-85 . . . . . 0 C--O 1.231 0.129 0 CA-C-O 121.017 0.436 . . . . 0.0 110.811 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.524 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 5.6 p -72.4 -53.13 13.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.356 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.871 ' HA ' HD12 ' A' ' 52' ' ' LEU . 2.8 pt-20 169.01 -35.03 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.207 179.731 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.52 -58.29 8.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.812 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.45 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -60.07 -41.59 92.74 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.208 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.871 HD12 ' HA ' ' A' ' 49' ' ' GLU . 14.0 mt -60.36 -49.52 77.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.013 178.739 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.626 ' HA ' HD12 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -53.29 -49.27 67.32 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.096 179.208 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.52 -44.76 89.65 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.553 179.032 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.45 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 8.1 m-70 -60.13 -51.12 70.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.815 178.835 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.626 HD12 ' HA ' ' A' ' 53' ' ' LYS . 8.7 mt -56.66 -45.49 82.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.939 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -53.61 -73.96 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.221 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 48.3 mttt -62.18 -75.56 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.078 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 149.77 37.71 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.738 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.2 p -100.89 -8.81 22.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.656 0.265 . . . . 0.0 111.066 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.42 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 16.1 tp -58.79 -23.77 60.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.812 0.339 . . . . 0.0 110.694 179.864 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.796 ' HA2' HD11 ' A' ' 88' ' ' LEU . . . -91.42 14.07 64.82 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.367 179.542 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.2 tttt -92.28 -55.81 3.28 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.934 0.397 . . . . 0.0 110.407 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -48.0 154.54 0.53 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.307 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.3 p -73.67 -167.32 0.45 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.929 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.579 HG22 ' HA ' ' A' ' 84' ' ' LYS . 56.0 t -77.03 -57.94 1.08 Allowed Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.256 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.504 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 5.2 Cg_endo -47.83 -30.25 12.9 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.34 2.026 . . . . 0.0 112.054 179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 33.1 mtm -80.33 -46.88 15.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.271 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.912 ' HB2' HD13 ' A' ' 87' ' ' LEU . 36.1 mt -61.14 -46.11 91.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.449 179.381 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.437 ' N ' HD22 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -51.95 -32.1 31.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.54 179.272 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.42 ' HB3' ' CD2' ' A' ' 47' ' ' TYR . 0.0 OUTLIER -56.76 -54.92 40.71 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.891 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.675 ' CB ' HD21 ' A' ' 91' ' ' LEU . . . -57.12 -46.9 82.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.974 0.416 . . . . 0.0 110.372 179.522 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 57.3 m -61.01 -44.06 97.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.338 179.226 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.1 mmt180 -63.15 -34.3 77.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.67 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.86 -38.08 73.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.846 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.503 ' CD1' ' CE1' ' A' ' 94' ' ' HIS . 4.5 m-85 -84.28 -28.63 27.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.035 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.94 26.57 11.33 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.605 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.485 HD23 ' HB3' ' A' ' 76' ' ' TYR . 4.4 mm? -81.09 176.41 9.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.793 0.33 . . . . 0.0 110.912 -179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.92 -33.07 11.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.799 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.566 ' HB2' HD23 ' A' ' 87' ' ' LEU . 3.9 p 48.33 -173.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.418 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -124.92 160.4 19.55 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.47 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 35.4 mt -80.85 -4.5 54.98 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -80.38 -73.55 0.36 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.677 0.275 . . . . 0.0 110.768 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.749 ' O ' HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER 167.84 -67.32 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.978 179.851 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.573 ' HA ' HD13 ' A' ' 88' ' ' LEU . 0.0 OUTLIER -54.5 -38.13 66.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.041 0.448 . . . . 0.0 110.681 179.76 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -45.13 -31.64 1.5 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.432 -179.065 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.912 HD13 ' HB2' ' A' ' 69' ' ' LEU . 2.3 mt -62.46 -40.72 97.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.099 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.796 HD11 ' HA2' ' A' ' 62' ' ' GLY . 5.1 mp -50.92 -53.64 30.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.38 178.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -49.74 -54.52 18.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.956 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.475 ' HB1' ' HG ' ' A' ' 78' ' ' LEU . . . -51.49 -44.54 62.52 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.199 0.524 . . . . 0.0 110.121 179.303 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.833 ' CD2' HD22 ' A' ' 52' ' ' LEU . 0.4 OUTLIER -66.75 -58.2 5.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.755 179.16 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.416 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.3 m -49.35 -53.95 19.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.298 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.92 -31.12 4.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.12 179.264 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.503 ' CE1' ' CD1' ' A' ' 76' ' ' TYR . 2.5 t60 -76.44 -16.55 59.66 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.704 -179.452 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' PHE . . . . . 0.474 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -146.78 36.12 0.95 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.819 0.343 . . . . 0.0 110.998 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.416 ' N ' ' O ' ' A' ' 92' ' ' THR . 2.8 pt20 . . . . . 0 CA--C 1.532 0.251 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.985 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.8 mtmt . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.696 0.284 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.76 HG23 ' HG2' ' A' ' 51' ' ' GLU . 14.4 p 41.39 38.31 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.697 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.83 3.52 14.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.823 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.584 ' HB3' HD21 ' A' ' 52' ' ' LEU . 27.6 m-85 70.81 44.45 0.62 Allowed 'General case' 0 C--O 1.231 0.13 0 CA-C-O 120.987 0.423 . . . . 0.0 110.811 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.415 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 0.7 OUTLIER -71.82 -42.13 67.38 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.336 179.502 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.861 ' HA ' HD12 ' A' ' 52' ' ' LEU . 0.4 OUTLIER 163.11 -42.84 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.367 179.84 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.2 -58.7 6.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.311 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.76 ' HG2' HG23 ' A' ' 45' ' ' VAL . 1.4 tp10 -58.88 -39.1 80.4 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.861 HD12 ' HA ' ' A' ' 49' ' ' GLU . 22.1 mt -60.2 -52.94 63.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.222 178.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.523 ' HG2' ' CE2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.56 -48.21 69.35 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-O 121.033 0.444 . . . . 0.0 109.952 179.168 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.7 m -59.39 -45.6 91.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.954 179.039 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.477 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 15.3 m-70 -59.59 -49.07 79.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.258 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.711 HG13 HD12 ' A' ' 61' ' ' LEU . 58.7 mt -55.29 -40.56 57.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.946 179.553 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.4 t -53.26 -77.01 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.347 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -49.28 77.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.29 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 118.67 31.84 1.42 Allowed Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.743 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.478 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 2.9 m -98.25 -6.23 31.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.587 0.232 . . . . 0.0 111.099 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.757 ' C ' HD11 ' A' ' 88' ' ' LEU . 0.6 OUTLIER -59.86 -22.46 62.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.874 0.369 . . . . 0.0 110.337 179.352 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.501 ' N ' HD11 ' A' ' 88' ' ' LEU . . . -90.77 22.44 28.17 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.846 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 60' ' ' THR . 0.2 OUTLIER -90.4 -54.87 3.82 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.107 0.48 . . . . 0.0 109.987 179.47 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -49.42 158.27 0.43 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.563 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.444 ' H ' ' HE3' ' A' ' 68' ' ' MET . 65.3 p -73.89 -168.0 0.55 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.624 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.853 HG22 ' HA ' ' A' ' 84' ' ' LYS . 47.4 t -77.35 -47.51 2.53 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.656 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.537 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 51.7 Cg_exo -52.15 -34.14 57.16 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.187 1.924 . . . . 0.0 111.88 179.458 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' MET . . . . . 0.444 ' HE3' ' H ' ' A' ' 65' ' ' THR . 46.5 mtm -80.01 -40.48 27.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.497 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.57 ' HB2' HD13 ' A' ' 87' ' ' LEU . 9.6 mt -60.32 -41.52 93.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.491 179.528 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.93 -34.91 57.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.684 179.142 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.09 -54.86 39.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.966 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.836 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -56.94 -43.56 81.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.672 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 13.7 m -60.27 -41.26 92.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.442 179.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.85 -35.95 79.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.544 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.99 -30.29 50.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.817 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.429 ' CE1' ' HG3' ' A' ' 49' ' ' GLU . 2.7 m-85 -84.26 -29.11 26.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.006 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.77 24.02 47.47 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.573 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.414 HD13 ' HB1' ' A' ' 90' ' ' ALA . 2.9 mt -81.2 -170.79 2.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.796 0.331 . . . . 0.0 110.846 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -96.86 -37.58 10.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.881 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 68.23 176.58 0.26 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.857 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -137.37 146.22 18.07 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.483 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.2 mp -80.75 65.63 5.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.83 0.348 . . . . 0.0 111.015 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.561 ' O ' HG21 ' A' ' 66' ' ' VAL . 2.0 tptt -157.39 -73.38 0.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.029 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.853 ' HA ' HG22 ' A' ' 66' ' ' VAL . 35.8 tttm 168.9 -83.77 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.582 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -47.55 -31.77 4.72 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.159 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -52.37 -36.86 54.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.696 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.628 HD11 HG13 ' A' ' 66' ' ' VAL . 1.2 mt -62.39 -47.37 84.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.764 179.166 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.757 HD11 ' C ' ' A' ' 61' ' ' LEU . 4.3 mm? -51.2 -51.25 55.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.333 178.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.44 -53.2 39.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.816 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.414 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.91 -44.09 66.69 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.112 0.482 . . . . 0.0 110.117 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.836 HD21 ' HB1' ' A' ' 72' ' ' ALA . 2.0 mt -65.94 -57.3 8.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.696 179.274 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.1 m -49.76 -55.9 12.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.365 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.8 mmtm -48.61 -35.21 13.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.216 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.427 ' CD2' ' CD2' ' A' ' 76' ' ' TYR . 1.5 t-80 -79.17 -3.35 45.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.817 -179.494 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' PHE . . . . . 0.523 ' CE2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.5 27.66 0.9 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.663 0.268 . . . . 0.0 110.947 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -167.1 125.61 1.34 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.982 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.906 -179.933 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.9 mttt . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.808 0.337 . . . . 0.0 111.192 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.614 HG22 ' O ' ' A' ' 45' ' ' VAL . 13.0 p -78.43 34.71 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.979 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -78.59 2.91 17.71 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.657 ' HB3' HD21 ' A' ' 52' ' ' LEU . 17.3 m-85 70.42 50.99 0.37 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.016 0.436 . . . . 0.0 110.696 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.512 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 85.3 p -71.52 -47.89 52.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.31 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.756 ' HA ' HD12 ' A' ' 52' ' ' LEU . 5.3 pt-20 167.39 -42.16 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.486 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -55.7 -56.1 24.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.251 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.458 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.3 OUTLIER -60.07 -40.73 90.55 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.395 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.756 HD12 ' HA ' ' A' ' 49' ' ' GLU . 23.7 mt -60.05 -50.98 71.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.208 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.634 ' HA ' HD12 ' A' ' 56' ' ' ILE . 41.5 tttm -53.04 -48.88 67.28 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.1 m -55.19 -43.12 74.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.313 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.516 ' HB2' HD12 ' A' ' 61' ' ' LEU . 4.7 m-70 -60.79 -49.81 75.98 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.686 178.467 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.634 HD12 ' HA ' ' A' ' 53' ' ' LYS . 34.3 mt -55.89 -46.74 80.31 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.905 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 58.5 m -53.7 -74.37 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.272 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -61.79 -74.77 0.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.133 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 145.66 37.39 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.857 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 63.2 p -100.41 -9.48 22.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.688 0.28 . . . . 0.0 111.034 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.62 HD22 ' HG ' ' A' ' 88' ' ' LEU . 0.7 OUTLIER -58.67 -24.84 62.05 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.843 0.354 . . . . 0.0 110.38 179.611 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.717 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -88.01 16.19 52.54 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.581 179.456 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.6 mtmt -91.38 -57.91 2.62 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.089 0.471 . . . . 0.0 110.125 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -49.92 155.8 0.84 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.361 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 73.6 p -74.4 -169.53 0.84 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.708 179.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.601 HG13 HD11 ' A' ' 87' ' ' LEU . 53.7 t -78.01 -46.69 2.25 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.748 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.516 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 52.6 Cg_exo -51.97 -34.69 57.64 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.192 1.928 . . . . 0.0 111.84 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 17.0 mtm -80.27 -39.26 29.24 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.404 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.647 ' CB ' HD13 ' A' ' 87' ' ' LEU . 7.9 mt -60.82 -46.89 88.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.393 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.453 ' HD3' HG12 ' A' ' 66' ' ' VAL . 0.2 OUTLIER -52.08 -33.14 37.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.628 179.256 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.402 ' O ' ' CG ' ' A' ' 74' ' ' ARG . 2.2 tm-20 -56.82 -53.76 54.12 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.865 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.689 ' CB ' HD21 ' A' ' 91' ' ' LEU . . . -57.68 -33.74 68.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.031 0.443 . . . . 0.0 110.38 179.58 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.779 ' HA ' HD12 ' A' ' 78' ' ' LEU . 34.8 m -61.45 -47.48 85.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.02 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.405 ' HG3' ' N ' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -61.99 -28.45 69.57 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.921 -179.849 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.405 ' N ' ' HG3' ' A' ' 74' ' ' ARG . . . -80.14 -34.29 37.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.986 0.422 . . . . 0.0 110.724 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.463 ' CE2' ' HB3' ' A' ' 94' ' ' HIS . 3.2 m-30 -84.8 -25.76 27.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.047 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.07 24.52 31.73 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.457 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.779 HD12 ' HA ' ' A' ' 73' ' ' CYS . 1.3 mt -81.13 -164.73 0.79 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.759 0.314 . . . . 0.0 110.821 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.64 24.4 2.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.006 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.83 -166.99 0.87 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.785 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.671 ' HA2' HD21 ' A' ' 87' ' ' LEU . . . 108.8 88.03 1.93 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.632 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.421 ' HA ' HD23 ' A' ' 82' ' ' LEU . 19.2 mt -158.86 -86.17 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.675 0.274 . . . . 0.0 110.667 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 3.1 mmtm -82.0 -66.01 0.94 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.841 0.353 . . . . 0.0 110.642 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.605 ' HA ' HD12 ' A' ' 87' ' ' LEU . 0.8 OUTLIER 169.13 -65.63 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.019 179.931 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.68 -37.48 28.89 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.248 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.87 -40.12 69.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.067 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.741 ' O ' HD12 ' A' ' 91' ' ' LEU . 1.9 mt -61.54 -47.16 86.84 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.717 HD21 ' CA ' ' A' ' 62' ' ' GLY . 9.4 mp -51.42 -53.02 41.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.227 178.66 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -51.12 -52.75 40.71 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.879 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.545 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.88 -43.24 66.0 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.103 0.478 . . . . 0.0 110.107 179.361 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.741 HD12 ' O ' ' A' ' 87' ' ' LEU . 0.4 OUTLIER -66.82 -58.52 4.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.695 179.187 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.41 ' OG1' HG23 ' A' ' 56' ' ' ILE . 1.2 m -49.37 -55.59 12.43 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.263 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.8 mtpp -46.31 -34.21 4.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.043 179.328 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.463 ' HB3' ' CE2' ' A' ' 76' ' ' TYR . 3.9 t60 -66.22 -55.42 16.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.143 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' PHE . . . . . 0.57 ' CZ ' ' HD2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -92.38 14.26 17.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.5 -179.629 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.408 ' N ' ' O ' ' A' ' 92' ' ' THR . 0.0 OUTLIER -73.54 105.94 5.1 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.729 0.3 . . . . 0.0 110.873 179.692 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.242 -0.885 . . . . 0.0 110.929 -179.988 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.832 0.349 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.563 ' O ' HG12 ' A' ' 45' ' ' VAL . 20.0 t -76.16 2.41 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.998 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -73.38 -16.55 61.34 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.6 0.238 . . . . 0.0 111.345 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.807 ' HB3' HD21 ' A' ' 52' ' ' LEU . 26.8 m-85 65.14 55.0 1.15 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.987 0.423 . . . . 0.0 110.911 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.46 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 13.1 p -71.87 -46.92 56.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.518 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.708 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.2 tt0 168.16 -43.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.537 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.33 -58.55 6.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.374 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.415 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.3 OUTLIER -59.06 -39.26 81.53 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.463 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.807 HD21 ' HB3' ' A' ' 47' ' ' TYR . 38.0 mt -60.33 -52.3 65.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.306 178.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.763 ' HA ' HD12 ' A' ' 56' ' ' ILE . 1.4 tmtp? -54.87 -47.34 74.37 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-O 121.107 0.479 . . . . 0.0 110.005 179.153 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.2 m -59.09 -44.04 91.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.9 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.417 ' CE1' ' HZ ' ' A' ' 64' ' ' PHE . 35.3 m170 -58.68 -49.73 76.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.889 179.077 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.763 HD12 ' HA ' ' A' ' 53' ' ' LYS . 8.2 mt -57.63 -48.21 83.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.014 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.91 -65.74 0.51 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.645 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 46.2 mttt -60.69 -39.01 86.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.166 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 111.29 23.67 5.68 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.527 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 44.5 p -97.65 -13.63 21.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.587 0.232 . . . . 0.0 111.001 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.824 ' O ' HD22 ' A' ' 88' ' ' LEU . 3.1 tm? -59.09 -28.53 66.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.746 0.308 . . . . 0.0 110.463 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.597 ' HA2' HD13 ' A' ' 88' ' ' LEU . . . -86.7 13.22 59.26 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.598 179.642 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.94 -45.68 6.84 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.815 0.341 . . . . 0.0 111.275 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.417 ' HZ ' ' CE1' ' A' ' 55' ' ' HIS . 30.0 m-85 -45.24 144.77 1.27 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.958 -179.385 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.647 ' O ' HD12 ' A' ' 69' ' ' LEU . 26.7 p -74.13 -168.2 0.6 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.82 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.518 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 55.5 t -76.1 -56.84 1.54 Allowed Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.626 -179.747 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.518 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 7.9 Cg_endo -50.28 -34.9 41.96 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.357 2.038 . . . . 0.0 112.416 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 47.1 mtm -80.1 -33.91 38.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.489 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.976 HD21 HD23 ' A' ' 88' ' ' LEU . 4.8 mt -61.43 -41.55 97.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.924 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.75 -37.68 43.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.839 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.61 -57.79 10.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.985 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.825 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.61 -44.29 85.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.872 0.368 . . . . 0.0 110.546 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.2 m -60.27 -37.26 79.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.436 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.0 mtt180 -62.47 -36.89 83.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.647 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -78.82 -32.16 46.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.005 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.465 ' CE1' ' HG3' ' A' ' 49' ' ' GLU . 2.7 m-85 -83.79 -25.99 29.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.187 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.7 24.45 55.9 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.617 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.4 mt -81.11 175.6 10.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.822 0.344 . . . . 0.0 110.842 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.01 -53.8 3.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.833 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.631 ' CB ' HD23 ' A' ' 87' ' ' LEU . 86.8 p 45.29 -166.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.35 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.53 ' C ' HD12 ' A' ' 82' ' ' LEU . . . -148.22 -112.23 0.66 Allowed Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.475 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.649 ' N ' HD12 ' A' ' 82' ' ' LEU . 0.1 OUTLIER -153.31 13.09 0.49 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.594 0.235 . . . . 0.0 111.395 -179.942 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.416 ' O ' ' HB3' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -84.97 8.05 19.09 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.764 -0.198 . . . . 0.0 111.292 179.476 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.416 ' HB3' ' O ' ' A' ' 83' ' ' LYS . 32.4 tttt 71.39 -79.35 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.57 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.855 ' HA ' HD12 ' A' ' 88' ' ' LEU . 0.5 OUTLIER -47.3 -40.44 16.92 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.88 0.372 . . . . 0.0 111.093 179.592 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.22 -49.78 66.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.692 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.84 ' HB2' HD13 ' A' ' 69' ' ' LEU . 2.4 mt -61.22 -49.58 76.56 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 178.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.976 HD23 HD21 ' A' ' 69' ' ' LEU . 15.4 mt -52.67 -50.55 63.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.941 178.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -54.5 -52.4 62.08 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.593 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -51.33 -41.4 60.53 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.099 0.476 . . . . 0.0 110.114 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.825 HD21 ' HB1' ' A' ' 72' ' ' ALA . 1.1 mt -65.67 -61.54 2.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.295 179.08 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.7 m -50.17 -56.67 10.05 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.086 179.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.4 mtpt -48.36 -33.41 8.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.095 179.06 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -71.6 -15.47 62.26 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.684 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' PHE . . . . . 0.447 ' CD1' ' HE3' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.19 34.84 0.89 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.839 0.352 . . . . 0.0 110.908 -179.867 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -72.45 -177.83 2.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.88 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.5 t70 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.893 179.991 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.438 ' O ' ' CG2' ' A' ' 45' ' ' VAL . 19.9 mmtp . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.713 0.292 . . . . 0.0 111.116 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.438 ' CG2' ' O ' ' A' ' 44' ' ' LYS . 63.5 t -160.52 -54.16 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.752 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.415 ' O ' ' CD1' ' A' ' 47' ' ' TYR . 11.5 mm-40 -164.25 -70.49 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.832 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.728 ' HB3' HD21 ' A' ' 52' ' ' LEU . 60.6 m-85 -156.17 75.5 0.88 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.482 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.529 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 85.3 p -73.67 -55.32 6.41 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.616 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.684 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.0 OUTLIER 168.66 -37.22 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.149 179.831 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -57.09 -54.79 42.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.765 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.46 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.0 OUTLIER -61.09 -42.92 99.4 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.022 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.728 HD21 ' HB3' ' A' ' 47' ' ' TYR . 33.1 mt -58.72 -50.99 71.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.077 178.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.476 ' CE ' ' CD1' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -52.42 -48.92 65.45 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.858 179.055 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.549 HG22 ' HD2' ' A' ' 58' ' ' LYS . 3.9 m -57.51 -42.34 82.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.643 178.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.669 ' HB2' HD12 ' A' ' 61' ' ' LEU . 4.7 m-70 -60.09 -48.9 79.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.859 178.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 74.7 mt -56.41 -47.95 80.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.859 179.366 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.48 -72.75 0.06 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.51 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.549 ' HD2' HG22 ' A' ' 54' ' ' THR . 4.1 mttt -61.53 -74.34 0.08 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.297 -179.443 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 145.53 35.24 0.07 OUTLIER Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.949 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.428 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 0.7 OUTLIER -99.82 -9.62 22.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.644 0.259 . . . . 0.0 110.85 179.603 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.669 HD12 ' HB2' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -59.32 -21.48 59.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.902 0.382 . . . . 0.0 110.379 179.544 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.705 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -90.66 15.12 61.16 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.934 -0.651 . . . . 0.0 112.535 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.428 ' HB2' ' O ' ' A' ' 60' ' ' THR . 0.1 OUTLIER -90.92 -55.95 3.36 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.025 0.44 . . . . 0.0 109.977 179.633 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -49.82 151.79 1.71 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.236 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.467 ' O ' HD12 ' A' ' 69' ' ' LEU . 17.8 p -73.87 -165.49 0.3 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.767 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.514 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 41.7 t -76.59 -57.55 1.26 Allowed Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.205 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 9.1 Cg_endo -50.95 -28.97 25.63 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.272 1.981 . . . . 0.0 112.101 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.4 mtp -79.98 -39.33 30.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.151 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.744 ' HB2' HD13 ' A' ' 87' ' ' LEU . 7.0 mt -61.16 -43.03 99.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.52 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.94 -33.4 37.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.854 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -56.02 -52.52 63.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.053 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.643 ' CB ' HD21 ' A' ' 91' ' ' LEU . . . -57.67 -53.01 63.04 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.687 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.97 -33.61 72.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.358 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -37.72 87.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.08 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.77 -26.83 31.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.715 179.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.459 ' CE1' ' CD1' ' A' ' 52' ' ' LEU . 3.0 m-85 -82.97 -30.92 27.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.817 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.97 14.6 59.05 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.809 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.574 HD21 ' CD2' ' A' ' 94' ' ' HIS . 4.4 mt -82.04 167.19 19.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.934 0.397 . . . . 0.0 111.103 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.29 75.58 1.82 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.662 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.695 ' OG ' HD23 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -75.85 -169.07 1.0 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.103 -179.697 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -140.91 -120.37 1.67 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.47 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.7 pp -155.4 11.23 0.32 Allowed 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.8 tptp -85.52 7.05 24.38 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.614 0.245 . . . . 0.0 111.095 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.4 ttmm 69.43 -76.82 0.06 Allowed 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.53 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -50.56 -36.36 34.21 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.876 0.37 . . . . 0.0 111.161 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -62.08 -38.28 88.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.062 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.744 HD13 ' HB2' ' A' ' 69' ' ' LEU . 1.2 mt -61.38 -42.44 98.72 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.54 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.705 HD21 ' CA ' ' A' ' 62' ' ' GLY . 9.2 mp -52.04 -54.48 29.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.34 178.655 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -50.37 -52.54 36.36 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.828 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.559 ' O ' HD13 ' A' ' 78' ' ' LEU . . . -51.4 -44.09 62.13 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.199 0.523 . . . . 0.0 109.814 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.643 HD21 ' CB ' ' A' ' 72' ' ' ALA . 0.4 OUTLIER -66.66 -61.09 2.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.653 179.016 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.0 m -48.88 -52.14 25.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.365 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 15.6 tptp -48.46 -34.64 11.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.168 179.157 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.574 ' CD2' HD21 ' A' ' 78' ' ' LEU . 20.6 t-80 -78.53 -5.55 52.98 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.923 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' PHE . . . . . 0.476 ' CD1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.65 27.96 0.98 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.799 0.333 . . . . 0.0 110.975 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -72.71 98.17 2.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.884 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.847 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.8 mmpt? . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.866 0.365 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.9 p -73.57 -33.23 38.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.053 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -76.76 -0.42 23.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.671 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.781 ' HB3' HD21 ' A' ' 52' ' ' LEU . 24.4 m-85 64.42 83.05 0.17 Allowed 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.971 0.415 . . . . 0.0 110.754 -179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.512 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 83.0 p -72.47 -52.99 13.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.342 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.858 ' HA ' HD12 ' A' ' 52' ' ' LEU . 2.5 pt-20 164.83 -39.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.001 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -56.13 -58.26 8.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.471 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.442 ' HG3' ' CE1' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -58.92 -37.5 76.81 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 179.61 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.858 HD12 ' HA ' ' A' ' 49' ' ' GLU . 36.2 mt -60.95 -53.6 55.31 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.22 178.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.643 ' HA ' HD12 ' A' ' 56' ' ' ILE . 20.8 tttm -54.7 -47.02 74.21 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-O 121.03 0.443 . . . . 0.0 110.096 178.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.9 m -56.97 -44.81 83.01 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.489 178.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.446 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 12.0 m-70 -60.42 -51.49 69.26 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.824 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.643 HD12 ' HA ' ' A' ' 53' ' ' LYS . 11.6 mt -56.96 -42.42 78.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.024 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.78 -76.11 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.643 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.9 pttt -60.97 -51.51 68.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.371 -179.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 123.98 52.18 0.2 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.564 -0.826 . . . . 0.0 112.805 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.661 HG22 ' HG3' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -124.18 -4.13 7.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.506 0.193 . . . . 0.0 111.097 179.792 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.481 HD11 HD13 ' A' ' 91' ' ' LEU . 60.7 tp -60.05 -20.89 60.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.843 0.354 . . . . 0.0 110.559 179.471 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.781 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -93.05 22.8 32.47 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.25 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.661 ' HG3' HG22 ' A' ' 60' ' ' THR . 0.3 OUTLIER -91.37 -57.59 2.73 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.018 0.437 . . . . 0.0 110.073 179.683 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -49.84 157.26 0.61 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.25 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 30.6 p -73.86 -169.4 0.73 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.037 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.529 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 75.2 t -76.77 -56.22 1.4 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.315 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 9.9 Cg_endo -52.31 -29.61 39.26 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.147 1.898 . . . . 0.0 112.027 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.71 -41.51 26.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.2 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.737 ' CB ' HD22 ' A' ' 87' ' ' LEU . 24.6 mt -61.4 -34.68 75.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.52 179.324 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.465 ' N ' HD22 ' A' ' 87' ' ' LEU . 12.4 mmtt -53.16 -38.21 62.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.097 179.636 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -54.98 -49.66 70.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.964 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.685 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.31 -48.81 77.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.733 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.76 -40.04 86.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.418 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -37.03 81.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.478 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.01 -30.39 44.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.734 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.636 ' HB3' HD23 ' A' ' 78' ' ' LEU . 2.7 m-85 -85.48 5.38 31.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.417 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.82 16.18 58.92 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.704 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.879 ' HG ' ' HB1' ' A' ' 90' ' ' ALA . 3.4 mm? -81.1 178.74 8.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.873 0.368 . . . . 0.0 110.868 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.17 -31.85 12.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.698 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.9 p 65.63 169.3 0.21 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.977 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -151.06 150.91 22.95 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.56 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.57 66.95 6.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.921 0.391 . . . . 0.0 110.864 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -155.88 8.33 0.24 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.938 -179.56 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.422 ' CA ' HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER 65.99 -76.48 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.725 0.298 . . . . 0.0 111.031 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.672 ' HA ' HD13 ' A' ' 88' ' ' LEU . 8.1 tt0 -47.83 -34.01 8.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.332 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 37.8 tp10 -59.72 -42.54 93.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.925 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.737 HD22 ' CB ' ' A' ' 69' ' ' LEU . 1.5 mp -61.11 -43.91 98.15 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.781 HD21 ' CA ' ' A' ' 62' ' ' GLY . 5.2 mp -51.51 -53.71 34.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.269 178.562 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -50.47 -53.25 31.21 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.97 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.879 ' HB1' ' HG ' ' A' ' 78' ' ' LEU . . . -52.19 -43.99 64.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.062 0.458 . . . . 0.0 110.128 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.721 ' CD2' HD22 ' A' ' 52' ' ' LEU . 0.4 OUTLIER -66.36 -58.54 5.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.424 179.094 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.9 m -50.23 -57.27 8.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.419 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.51 -31.87 11.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.279 179.388 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -85.43 0.49 52.09 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' PHE . . . . . 0.579 ' CZ ' ' HD2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -147.64 19.75 1.17 Allowed 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.036 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -72.57 82.48 1.11 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.799 0.333 . . . . 0.0 110.92 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.897 179.987 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.0 mtpt . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.833 0.349 . . . . 0.0 111.196 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.625 HG21 ' OE1' ' A' ' 51' ' ' GLU . 16.3 t -73.65 -45.11 51.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.087 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 76.24 28.91 0.77 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.043 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.892 ' HB3' HD21 ' A' ' 52' ' ' LEU . 21.7 m-85 51.95 68.8 0.75 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.022 0.439 . . . . 0.0 110.967 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.512 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 2.7 p -73.34 -53.31 11.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.383 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.839 ' HA ' HD12 ' A' ' 52' ' ' LEU . 8.1 pt-20 168.24 -39.46 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.214 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -56.29 -55.61 31.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.036 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.625 ' OE1' HG21 ' A' ' 45' ' ' VAL . 0.4 OUTLIER -59.97 -43.02 95.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.343 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.892 HD21 ' HB3' ' A' ' 47' ' ' TYR . 15.4 mt -58.9 -50.68 73.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.055 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.741 ' HA ' HD12 ' A' ' 56' ' ' ILE . 0.5 OUTLIER -52.61 -49.05 65.84 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.878 178.976 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.9 m -58.05 -43.45 86.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.727 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.476 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 17.0 m170 -59.73 -49.33 78.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.84 178.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.741 HD12 ' HA ' ' A' ' 53' ' ' LYS . 16.4 mt -56.22 -47.73 80.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.988 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.54 -75.7 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.344 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -61.74 -72.28 0.13 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.148 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 143.33 39.47 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.582 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -99.52 -9.95 22.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.704 0.288 . . . . 0.0 111.068 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.619 HD12 HG13 ' A' ' 56' ' ' ILE . 0.4 OUTLIER -59.7 -21.46 60.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.862 0.363 . . . . 0.0 110.648 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.755 ' HA2' HD11 ' A' ' 88' ' ' LEU . . . -94.84 17.11 59.88 Favored Glycine 0 C--N 1.333 0.363 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.514 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.87 -57.44 2.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.992 0.425 . . . . 0.0 110.272 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -48.62 161.95 0.11 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.181 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 52.8 p -73.25 -174.63 1.65 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.816 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.674 HG22 ' HB3' ' A' ' 84' ' ' LYS . 82.7 t -75.86 -56.3 1.74 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.227 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.532 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 7.4 Cg_endo -50.08 -28.32 19.06 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.201 1.934 . . . . 0.0 111.89 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.47 -42.35 25.48 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.026 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.852 ' CB ' HD13 ' A' ' 87' ' ' LEU . 11.9 mt -60.87 -42.65 98.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.061 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.47 ' HD3' HD21 ' A' ' 87' ' ' LEU . 6.5 mmtp -54.06 -33.71 58.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.29 178.651 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -55.42 31.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.919 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.639 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.11 -44.57 83.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.02 0.438 . . . . 0.0 110.378 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 86.3 m -60.89 -43.26 98.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.426 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -35.74 78.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.469 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.67 -31.51 59.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.609 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -84.22 -23.45 30.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.972 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 92.47 15.4 53.3 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.57 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.482 HD13 ' HB1' ' A' ' 90' ' ' ALA . 4.5 mt -81.21 172.98 12.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.753 0.311 . . . . 0.0 110.856 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.68 -50.07 4.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.654 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.835 ' CB ' HD23 ' A' ' 87' ' ' LEU . 59.0 p 45.44 -166.15 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.593 179.591 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.58 164.88 17.91 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.368 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.1 mt 76.51 118.62 0.05 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.071 0.462 . . . . 0.0 111.031 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.419 ' O ' ' HB3' ' A' ' 84' ' ' LYS . 0.3 OUTLIER 62.53 -79.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.635 179.627 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.674 ' HB3' HG22 ' A' ' 66' ' ' VAL . 3.9 ptpt 163.68 -46.71 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.945 0.403 . . . . 0.0 110.14 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -47.24 -39.78 15.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.904 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -48.81 -36.42 16.72 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.56 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.852 HD13 ' CB ' ' A' ' 69' ' ' LEU . 9.6 mt -62.43 -51.66 66.65 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 178.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.755 HD11 ' HA2' ' A' ' 62' ' ' GLY . 4.0 mp -52.35 -54.29 33.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.844 178.225 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -51.5 -49.31 62.12 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.663 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.482 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.41 -45.24 65.82 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.161 0.505 . . . . 0.0 109.884 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.846 ' CD2' HD22 ' A' ' 52' ' ' LEU . 0.3 OUTLIER -66.61 -60.38 2.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.554 179.048 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.4 m -50.24 -52.96 31.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.368 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -48.88 -32.01 8.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.869 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -93.09 13.84 19.7 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.531 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' PHE . . . . . 0.505 ' HB3' HD13 ' A' ' 56' ' ' ILE . 0.1 OUTLIER -145.44 -6.09 0.64 Allowed 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.914 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -73.27 122.58 22.2 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.821 0.343 . . . . 0.0 110.893 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.892 -179.946 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 12.7 tptt . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.782 0.325 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.792 HG13 ' H ' ' A' ' 47' ' ' TYR . 8.3 p -73.63 -30.36 29.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.048 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 74.98 21.48 1.99 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.215 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.901 ' HB3' HD21 ' A' ' 52' ' ' LEU . 3.1 m-85 50.39 58.48 5.45 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.056 0.455 . . . . 0.0 110.955 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.487 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 79.8 p -72.73 -44.24 61.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.703 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.889 ' HA ' HD12 ' A' ' 52' ' ' LEU . 26.7 tt0 165.22 -45.89 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.223 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.1 -56.55 16.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.22 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.468 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.1 OUTLIER -59.1 -40.28 84.81 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 179.29 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.901 HD21 ' HB3' ' A' ' 47' ' ' TYR . 28.0 mt -59.04 -53.66 55.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.285 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.48 ' HG2' ' CD2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.77 -47.28 70.87 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 121.065 0.459 . . . . 0.0 109.942 179.131 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.1 m -58.2 -42.17 85.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.697 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.468 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 29.3 m170 -60.53 -47.76 84.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.181 179.033 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.539 HD11 ' HA ' ' A' ' 92' ' ' THR . 0.8 OUTLIER -55.51 -44.48 76.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.977 179.628 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 m -52.93 -73.13 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.307 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.2 mttm -62.13 -52.9 61.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.997 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 117.71 32.63 1.41 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.503 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.31 -3.14 34.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.613 0.244 . . . . 0.0 111.297 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.676 ' C ' HD21 ' A' ' 88' ' ' LEU . 0.6 OUTLIER -60.21 -23.0 63.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.723 0.297 . . . . 0.0 110.871 179.883 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.617 ' N ' HD21 ' A' ' 88' ' ' LEU . . . -96.62 20.72 49.33 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.818 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.69 -56.64 2.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.949 0.404 . . . . 0.0 110.325 179.657 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -48.43 154.17 0.66 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.345 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 72.1 p -73.09 -163.05 0.13 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.623 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.555 ' HB ' ' HD3' ' A' ' 67' ' ' PRO . 11.9 t -77.41 -51.69 1.89 Allowed Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.518 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.555 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 78.5 Cg_exo -46.43 -33.15 12.2 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.271 1.98 . . . . 0.0 111.966 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 9.4 mmm -80.18 -51.18 9.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.552 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.971 ' HB2' HD13 ' A' ' 87' ' ' LEU . 55.8 mt -60.43 -39.31 87.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.574 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.401 ' HD3' ' HA3' ' A' ' 81' ' ' GLY . 0.3 OUTLIER -52.14 -41.94 62.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.75 179.371 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.81 -55.15 29.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.22 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.572 ' HB2' ' CB ' ' A' ' 47' ' ' TYR . . . -57.32 -47.95 80.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.961 0.41 . . . . 0.0 110.499 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.729 ' SG ' HD23 ' A' ' 87' ' ' LEU . 31.9 m -61.41 -40.11 93.21 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.648 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.53 -35.55 80.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.944 0.402 . . . . 0.0 110.524 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.43 -43.27 70.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.854 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CE1' ' CE1' ' A' ' 94' ' ' HIS . 8.8 m-85 -84.87 -16.52 40.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.43 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 73' ' ' CYS . . . 59.39 46.27 94.17 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.571 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.587 ' CB ' ' HB1' ' A' ' 90' ' ' ALA . 1.5 mt -84.65 14.34 4.76 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? 61.91 8.12 2.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.315 -0.402 . . . . 0.0 112.006 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.89 -168.74 1.9 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.853 0.359 . . . . 0.0 110.906 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.611 ' HA2' HD21 ' A' ' 87' ' ' LEU . . . 93.6 88.5 1.62 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.629 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -159.76 -80.19 0.05 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.79 0.329 . . . . 0.0 110.932 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -80.54 -69.21 0.61 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.822 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.407 ' HA ' HG22 ' A' ' 66' ' ' VAL . 9.4 ttmm 173.97 -81.25 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.461 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.501 ' HG3' HD12 ' A' ' 88' ' ' LEU . 5.0 tt0 -47.8 -29.8 3.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.177 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.73 -36.33 62.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.784 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.971 HD13 ' HB2' ' A' ' 69' ' ' LEU . 2.3 mt -62.29 -44.94 95.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.276 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.676 HD21 ' C ' ' A' ' 61' ' ' LEU . 42.4 mt -50.87 -52.89 37.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.4 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -49.73 -52.13 33.71 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.861 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.587 ' HB1' ' CB ' ' A' ' 78' ' ' LEU . . . -53.67 -48.28 69.61 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.941 0.4 . . . . 0.0 110.663 179.593 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.856 HD22 HD22 ' A' ' 52' ' ' LEU . 2.3 mt -66.86 -49.2 66.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.62 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.549 HG22 ' N ' ' A' ' 93' ' ' LYS . 0.6 OUTLIER -52.15 -58.71 5.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.604 179.822 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.549 ' N ' HG22 ' A' ' 92' ' ' THR . 3.6 ptmt -47.85 -30.48 4.11 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.261 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.5 ' CE1' ' CE1' ' A' ' 76' ' ' TYR . 37.9 t-80 -73.32 -21.54 60.54 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.411 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' PHE . . . . . 0.48 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.46 43.21 1.1 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.944 0.402 . . . . 0.0 111.054 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.91 121.13 0.91 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.819 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.937 -179.951 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.2 mttp . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.837 0.351 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.757 HG21 ' OE2' ' A' ' 51' ' ' GLU . 14.5 t -73.86 -38.78 51.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.1 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 65.67 30.72 10.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.991 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.783 ' HB3' HD21 ' A' ' 52' ' ' LEU . 6.3 m-85 57.98 57.58 4.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.01 0.433 . . . . 0.0 110.95 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.548 ' H ' HG12 ' A' ' 45' ' ' VAL . 88.0 p -73.07 -47.78 41.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.268 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.886 ' HA ' HD12 ' A' ' 52' ' ' LEU . 6.4 pt-20 166.18 -41.72 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.898 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.17 -54.78 41.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.979 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.757 ' OE2' HG21 ' A' ' 45' ' ' VAL . 0.5 OUTLIER -59.58 -43.11 93.73 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.281 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.886 HD12 ' HA ' ' A' ' 49' ' ' GLU . 16.5 mt -59.04 -51.61 69.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.194 178.811 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.758 ' O ' HG22 ' A' ' 56' ' ' ILE . 1.3 mmtt -54.2 -45.15 72.12 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-O 121.273 0.559 . . . . 0.0 110.224 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.424 HG22 ' O ' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -61.11 -41.45 96.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.862 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.496 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 7.7 m-70 -60.75 -50.63 72.68 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.402 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.758 HG22 ' O ' ' A' ' 53' ' ' LYS . 8.7 tt -58.21 -42.35 83.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 121.064 0.459 . . . . 0.0 110.67 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.7 t -54.29 -76.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.172 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 9.8 mttt -62.43 -68.86 0.29 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.023 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 141.08 39.61 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.729 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 60.7 p -101.18 -10.45 20.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.676 0.274 . . . . 0.0 111.165 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.559 HD21 HD13 ' A' ' 91' ' ' LEU . 0.4 OUTLIER -59.09 -23.86 62.44 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.811 0.338 . . . . 0.0 110.586 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.649 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -90.58 11.99 69.86 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.414 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.1 mmtp -92.17 -54.4 3.84 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.931 0.396 . . . . 0.0 110.473 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -47.95 152.15 0.82 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.274 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 24.0 p -73.56 -166.66 0.37 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.852 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.503 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 53.2 t -76.96 -57.83 1.11 Allowed Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.437 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 5.7 Cg_endo -48.34 -29.97 14.31 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.275 1.983 . . . . 0.0 112.105 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.2 mtp -80.27 -41.45 24.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.26 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.92 ' CB ' HD13 ' A' ' 87' ' ' LEU . 11.9 mt -61.15 -49.86 75.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.555 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.598 ' HG3' HD21 ' A' ' 87' ' ' LEU . 2.0 mttt -51.32 -31.34 21.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.542 179.346 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -56.58 -53.57 56.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.796 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.783 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.83 -46.38 84.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.543 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 42.0 m -60.22 -40.67 90.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.561 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.9 ttt-85 -61.23 -36.52 80.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.51 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.3 -36.35 61.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.692 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.602 ' HB3' HD23 ' A' ' 78' ' ' LEU . 2.9 m-30 -85.49 5.97 28.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.481 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.93 33.59 64.0 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.546 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.602 HD23 ' HB3' ' A' ' 76' ' ' TYR . 1.4 mm? -80.66 -170.18 2.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.798 0.332 . . . . 0.0 110.884 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.6 35.68 1.63 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.859 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.706 ' HB3' HD23 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -77.21 -162.5 0.29 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.736 179.892 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 100.95 104.98 2.75 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.487 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -160.26 -39.16 0.05 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.872 0.368 . . . . 0.0 110.97 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -157.74 -52.96 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.768 -179.924 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 83' ' ' LYS . 3.1 ttpt 175.24 -76.67 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.472 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -47.83 -29.95 3.63 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.297 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -57.54 -38.67 75.11 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.811 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.92 HD13 ' CB ' ' A' ' 69' ' ' LEU . 8.1 mt -62.11 -45.88 91.54 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.649 HD21 ' CA ' ' A' ' 62' ' ' GLY . 3.2 mp -50.62 -51.04 52.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.233 178.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -51.31 -55.14 19.93 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.831 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -51.71 -42.24 62.09 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.136 0.493 . . . . 0.0 110.014 179.276 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.783 HD21 ' HB1' ' A' ' 72' ' ' ALA . 0.7 OUTLIER -65.96 -59.56 3.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.646 179.136 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.594 ' HA ' HD12 ' A' ' 56' ' ' ILE . 2.3 m -48.41 -55.07 11.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.408 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.69 -35.97 15.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.163 179.28 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.434 ' CD2' HD21 ' A' ' 78' ' ' LEU . 10.2 t-80 -84.9 5.68 27.98 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.591 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' PHE . . . . . 0.473 ' CE1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.47 17.29 1.17 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.562 0.22 . . . . 0.0 111.164 179.934 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.64 173.2 9.33 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.8 0.333 . . . . 0.0 110.864 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.873 179.936 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.883 0.373 . . . . 0.0 111.192 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.574 ' O ' HG12 ' A' ' 45' ' ' VAL . 14.2 t -78.65 35.37 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.963 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.441 ' O ' ' CD1' ' A' ' 47' ' ' TYR . 4.3 mm-40 -76.15 -39.0 56.01 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.891 0.377 . . . . 0.0 110.902 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.85 ' HB3' HD21 ' A' ' 52' ' ' LEU . 65.7 m-85 -156.78 66.86 0.54 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.517 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 65.8 p -73.22 -45.83 53.86 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.012 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.795 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.2 pt-20 166.06 -46.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.425 -179.678 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.93 -58.8 5.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.398 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.431 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 3.3 mm-40 -58.8 -39.53 81.4 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.91 HD22 ' CD2' ' A' ' 91' ' ' LEU . 50.6 mt -59.3 -53.58 56.63 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.315 178.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.717 ' HE2' ' CG ' ' A' ' 95' ' ' PHE . 0.1 OUTLIER -55.11 -46.11 75.55 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.438 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.9 m -58.53 -44.83 89.69 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.432 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 13.5 m-70 -61.65 -53.57 54.36 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.056 -0.975 . . . . 0.0 109.738 178.507 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.489 HD12 ' HE3' ' A' ' 53' ' ' LYS . 14.4 mt -57.26 -41.38 78.03 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.74 179.152 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.7 t -55.08 -74.9 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.237 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.3 mtpp -62.75 -69.39 0.26 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.007 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 145.52 37.69 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.698 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 73.9 p -100.79 -10.32 20.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.643 0.259 . . . . 0.0 111.036 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.933 HD11 HD13 ' A' ' 91' ' ' LEU . 22.8 tp -58.27 -22.45 52.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.847 0.356 . . . . 0.0 110.646 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.552 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -94.09 15.51 63.01 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.609 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.07 -56.24 3.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.95 0.405 . . . . 0.0 110.51 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -48.68 154.79 0.63 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.383 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 82.6 p -73.33 -170.51 0.8 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.584 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.653 HG13 HD11 ' A' ' 87' ' ' LEU . 65.9 t -77.89 -46.9 2.3 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.838 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.526 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 60.1 Cg_exo -50.83 -35.26 48.12 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.17 1.914 . . . . 0.0 111.972 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 34.8 mtm -79.99 -40.33 28.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.474 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.684 ' CB ' HD13 ' A' ' 87' ' ' LEU . 7.7 mt -60.42 -44.82 95.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.496 179.523 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.75 -34.08 37.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.666 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -57.02 -54.54 45.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.899 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.702 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -56.79 -50.12 73.29 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.993 0.425 . . . . 0.0 110.496 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 8.2 m -60.89 -40.01 91.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.509 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.32 -35.94 80.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.735 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.8 -29.86 40.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.901 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.445 ' OH ' HD12 ' A' ' 52' ' ' LEU . 3.2 m-85 -84.63 -26.95 27.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.04 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.89 25.03 23.67 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.661 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.756 ' HG ' ' HB1' ' A' ' 90' ' ' ALA . 3.8 mm? -81.21 -175.66 5.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.828 0.346 . . . . 0.0 110.905 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.02 -24.69 15.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.01 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.519 ' HB3' HD23 ' A' ' 87' ' ' LEU . 0.3 OUTLIER 50.04 -176.62 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.916 0.389 . . . . 0.0 111.266 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -165.97 161.31 34.9 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.523 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 mp -80.38 -4.46 53.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.585 0.231 . . . . 0.0 111.411 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.1 2.24 28.2 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.673 -0.239 . . . . 0.0 111.57 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.737 ' HA ' HD12 ' A' ' 87' ' ' LEU . 17.9 ttmm 66.85 -73.98 0.07 Allowed 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.663 0.268 . . . . 0.0 110.962 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -47.74 -30.52 3.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.149 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -60.24 -35.57 75.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.792 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.737 HD12 ' HA ' ' A' ' 84' ' ' LYS . 1.5 mt -61.78 -42.32 98.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.048 0.452 . . . . 0.0 109.812 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.552 HD21 ' CA ' ' A' ' 62' ' ' GLY . 3.9 mp -51.83 -55.63 18.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.333 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -50.55 -51.2 50.12 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.888 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.756 ' HB1' ' HG ' ' A' ' 78' ' ' LEU . . . -52.68 -45.1 66.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.018 0.437 . . . . 0.0 110.165 179.39 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.933 HD13 HD11 ' A' ' 61' ' ' LEU . 0.5 OUTLIER -67.37 -57.86 5.84 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.598 179.16 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.401 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.3 m -50.44 -55.11 17.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.226 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.4 mtpt -48.05 -30.39 4.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.098 179.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 6.1 t-80 -77.23 -15.9 59.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.983 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' PHE . . . . . 0.717 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -147.19 33.11 0.89 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.782 0.325 . . . . 0.0 111.326 -179.819 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.401 ' N ' ' O ' ' A' ' 92' ' ' THR . 1.8 tp60 -72.62 118.28 15.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.861 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.912 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.5 tttt . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.798 0.332 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.882 HG11 ' CZ ' ' A' ' 47' ' ' TYR . 16.8 t -73.68 -50.47 29.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.062 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 76.66 69.27 0.06 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.083 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.882 ' CZ ' HG11 ' A' ' 45' ' ' VAL . 81.4 m-85 -81.72 67.44 7.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.729 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.492 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 0.8 OUTLIER -72.51 -54.57 8.87 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.424 179.898 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.521 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.2 pt-20 168.11 -35.04 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.129 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.97 -59.43 5.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -59.83 -38.3 81.66 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.551 HD12 ' CE1' ' A' ' 76' ' ' TYR . 79.5 mt -61.3 -51.3 69.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.124 178.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.895 ' HA ' HD12 ' A' ' 56' ' ' ILE . 16.4 tttt -55.1 -47.84 74.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.988 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 91.6 m -57.83 -42.45 84.35 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.849 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.443 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 16.7 m-70 -59.64 -48.38 81.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.814 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.895 HD12 ' HA ' ' A' ' 53' ' ' LYS . 8.6 mt -57.5 -48.96 81.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.981 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.0 p -53.43 -62.84 1.39 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.714 -179.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.1 mttm -60.7 -34.65 74.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.257 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 108.64 19.98 8.4 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.557 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 61.8 p -97.95 -18.21 18.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.472 0.177 . . . . 0.0 110.888 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.852 ' O ' HD22 ' A' ' 88' ' ' LEU . 2.6 tm? -57.28 -36.76 71.43 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.627 ' HA2' HD13 ' A' ' 88' ' ' LEU . . . -90.06 51.78 3.49 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.057 178.405 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -139.56 -46.11 0.45 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.888 0.375 . . . . 0.0 110.835 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -47.07 152.85 0.5 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.53 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.674 ' O ' HD12 ' A' ' 69' ' ' LEU . 30.7 p -74.12 -169.56 0.8 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.992 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.679 HG23 ' HG2' ' A' ' 84' ' ' LYS . 63.3 t -76.12 -57.34 1.44 Allowed Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.469 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.511 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 4.4 Cg_endo -47.34 -34.23 18.36 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.47 2.113 . . . . 0.0 112.284 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 40.8 mtm -80.2 -38.13 31.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.335 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.975 HD21 HD23 ' A' ' 88' ' ' LEU . 5.2 mt -61.31 -39.93 92.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.846 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.42 -45.75 55.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.227 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -55.52 -52.2 64.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.027 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.971 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.38 -44.2 84.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.883 179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.93 -41.31 91.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.512 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.6 ttt85 -61.78 -36.12 80.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.623 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.72 -30.54 51.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.789 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.551 ' CE1' HD12 ' A' ' 52' ' ' LEU . 3.2 m-30 -84.45 -22.26 30.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.017 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.44 12.35 61.34 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.65 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.991 HD13 ' HB1' ' A' ' 90' ' ' ALA . 15.8 mt -81.11 -176.05 5.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.759 0.314 . . . . 0.0 110.873 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.9 38.44 1.46 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.866 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.715 ' HB3' HD23 ' A' ' 87' ' ' LEU . 0.7 OUTLIER -77.46 -173.11 2.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.839 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.402 ' HA2' HD11 ' A' ' 87' ' ' LEU . . . 126.64 162.1 11.11 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.736 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 5.1 mt 68.02 26.71 7.25 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.693 0.283 . . . . 0.0 111.413 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.41 ' HB3' ' CB ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -158.49 -6.08 0.08 Allowed 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.679 ' HG2' HG23 ' A' ' 66' ' ' VAL . 66.5 mttm 61.75 -85.25 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.598 0.237 . . . . 0.0 110.716 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.717 ' HA ' HD12 ' A' ' 88' ' ' LEU . 0.0 OUTLIER -48.08 -43.39 30.64 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.941 0.4 . . . . 0.0 110.957 179.722 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.41 ' CB ' ' HB3' ' A' ' 83' ' ' LYS . 1.3 tp10 -47.92 -46.54 32.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.793 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.715 HD23 ' HB3' ' A' ' 80' ' ' SER . 1.8 mt -61.68 -50.15 73.63 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.659 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.975 HD23 HD21 ' A' ' 69' ' ' LEU . 19.7 mt -51.83 -52.82 46.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.047 178.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.36 -50.86 64.16 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.656 179.256 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.991 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.35 -42.9 64.3 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.624 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.971 HD21 ' HB1' ' A' ' 72' ' ' ALA . 0.6 OUTLIER -65.1 -56.68 11.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.472 179.326 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.2 m -49.3 -60.4 2.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.494 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.433 ' HG2' ' HA ' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -48.72 -29.59 4.64 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.097 179.306 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.43 ' HB3' ' CE2' ' A' ' 76' ' ' TYR . 1.8 t60 -69.31 -19.24 63.89 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.557 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' PHE . . . . . 0.499 ' CD1' ' HE3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -146.3 37.9 1.04 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.905 0.383 . . . . 0.0 110.896 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -72.52 117.27 13.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.799 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 25.1 t0 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.192 -0.909 . . . . 0.0 110.898 -179.989 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.411 ' O ' HG12 ' A' ' 45' ' ' VAL . 19.0 pttp . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.767 0.318 . . . . 0.0 111.396 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.611 HG22 ' O ' ' A' ' 45' ' ' VAL . 12.9 p 42.04 33.19 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.643 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 47.89 38.76 9.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.705 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.653 ' HB3' HD21 ' A' ' 52' ' ' LEU . 53.5 m-85 50.27 75.85 0.16 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.461 179.589 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.504 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 83.3 p -73.99 -55.3 6.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.326 179.401 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.639 ' HA ' HD12 ' A' ' 52' ' ' LEU . 2.9 pt-20 167.49 -36.23 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.084 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -57.13 -56.48 21.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.98 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.411 ' O ' ' CD2' ' A' ' 55' ' ' HIS . 0.1 OUTLIER -60.67 -41.03 94.24 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.269 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.653 HD21 ' HB3' ' A' ' 47' ' ' TYR . 39.9 mt -60.12 -50.64 72.91 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.081 178.778 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.685 ' HA ' HD12 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -53.74 -48.83 69.27 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.126 179.053 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.0 m -59.37 -43.11 92.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.054 179.2 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.414 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 24.8 m-70 -59.57 -48.7 80.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.969 179.189 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.685 HD12 ' HA ' ' A' ' 53' ' ' LYS . 16.3 mt -56.63 -48.08 81.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.903 179.275 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.67 -63.29 1.2 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.42 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.5 mtmt -61.04 -45.91 92.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.235 -179.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 118.36 20.48 4.32 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.702 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 40.6 p -97.57 -10.07 25.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.568 0.223 . . . . 0.0 111.059 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.937 HD21 HD13 ' A' ' 91' ' ' LEU . 2.4 tm? -58.52 -24.21 60.01 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.795 0.331 . . . . 0.0 110.176 179.406 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.61 ' CA ' HD13 ' A' ' 88' ' ' LEU . . . -87.38 16.58 48.22 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.94 -0.647 . . . . 0.0 112.281 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.34 -46.1 6.86 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.874 0.369 . . . . 0.0 111.2 -179.76 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -45.45 143.87 1.69 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.27 -179.27 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.593 ' O ' HD12 ' A' ' 69' ' ' LEU . 40.8 p -74.87 -172.38 1.58 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.748 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.51 HG22 ' N ' ' A' ' 84' ' ' LYS . 85.4 t -75.85 -44.46 3.96 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.206 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.506 ' CD ' ' N ' ' A' ' 66' ' ' VAL . 36.3 Cg_exo -60.86 -38.46 69.82 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.264 1.976 . . . . 0.0 112.15 179.834 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -80.03 -31.41 39.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.799 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.961 HD21 HD23 ' A' ' 88' ' ' LEU . 5.7 mt -60.97 -43.83 98.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.003 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.7 -39.46 51.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.099 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -56.13 -52.66 63.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.144 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.798 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.09 -49.42 75.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.861 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.79 -36.13 76.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.518 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -37.69 86.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.545 179.607 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -80.9 -30.03 35.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.894 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.606 ' CE1' HD12 ' A' ' 52' ' ' LEU . 2.7 m-85 -83.63 -22.25 32.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.023 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.19 21.02 53.78 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.523 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.606 HD23 ' HB3' ' A' ' 76' ' ' TYR . 3.4 mm? -81.49 169.94 16.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.839 0.352 . . . . 0.0 111.014 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.13 -38.06 9.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.613 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.668 ' OG ' HD23 ' A' ' 87' ' ' LEU . 0.3 OUTLIER 46.21 -166.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.425 179.764 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -152.38 -118.47 0.76 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.743 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -159.3 72.79 0.56 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.935 0.398 . . . . 0.0 110.801 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.405 ' O ' ' HB3' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -156.03 11.43 0.29 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.695 -179.549 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.51 ' N ' HG22 ' A' ' 66' ' ' VAL . 54.4 tttt 67.43 -83.87 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.797 -179.662 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.856 ' HA ' HD12 ' A' ' 88' ' ' LEU . 16.1 tt0 -45.34 -40.89 8.3 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.786 0.327 . . . . 0.0 111.108 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.441 ' HA ' ' HG2' ' A' ' 89' ' ' GLU . 1.7 tp10 -57.83 -46.71 84.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.652 179.788 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.939 ' HB2' HD13 ' A' ' 69' ' ' LEU . 0.8 OUTLIER -62.87 -46.64 86.93 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 178.571 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.961 HD23 HD21 ' A' ' 69' ' ' LEU . 24.9 mt -53.51 -56.63 15.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.519 179.05 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.441 ' HG2' ' HA ' ' A' ' 86' ' ' GLU . 11.1 pt-20 -55.89 -44.42 78.18 Favored 'General case' 0 CA--C 1.523 -0.08 0 CA-C-O 120.831 0.348 . . . . 0.0 110.375 179.274 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -52.3 -42.08 63.47 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 121.037 0.446 . . . . 0.0 110.237 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.937 HD13 HD21 ' A' ' 61' ' ' LEU . 1.6 mt -64.86 -62.98 1.24 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.655 179.346 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.52 HG23 HG23 ' A' ' 56' ' ' ILE . 49.7 m -47.47 -53.43 14.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.483 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.76 -36.55 16.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.976 178.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.529 ' ND1' HD21 ' A' ' 78' ' ' LEU . 33.4 t60 -73.26 -8.28 55.15 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.738 -179.649 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' PHE . . . . . 0.459 ' CD1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.36 33.47 0.88 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.818 0.342 . . . . 0.0 110.803 -179.912 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.4 112.28 0.71 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.886 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.6 t70 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.176 -0.916 . . . . 0.0 110.896 -179.985 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.1 mttp . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.754 0.312 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.639 HG22 ' O ' ' A' ' 45' ' ' VAL . 14.4 p 41.44 32.03 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.192 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.841 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.429 ' O ' ' CD1' ' A' ' 47' ' ' TYR . 8.3 mt-10 -75.84 -44.3 41.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.816 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.531 ' CD1' HD21 ' A' ' 52' ' ' LEU . 11.9 m-85 -158.11 72.07 0.62 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.465 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.477 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 58.5 p -73.44 -53.78 9.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.615 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.762 ' HA ' HD12 ' A' ' 52' ' ' LEU . 2.5 pt-20 167.54 -39.07 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.123 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.01 -57.6 11.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.241 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.454 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.5 tp10 -59.15 -40.51 85.79 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 179.495 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.762 HD12 ' HA ' ' A' ' 49' ' ' GLU . 30.7 mt -59.7 -51.78 68.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.236 178.755 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.838 ' HA ' HD12 ' A' ' 56' ' ' ILE . 37.8 tttm -53.56 -48.26 69.29 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.1 0.476 . . . . 0.0 109.835 178.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 78.4 m -56.55 -42.12 78.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.556 178.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.454 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 27.0 m170 -60.49 -49.65 76.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.573 178.588 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.838 HD12 ' HA ' ' A' ' 53' ' ' LYS . 8.6 mt -57.45 -49.31 80.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.159 179.323 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.49 -70.8 0.08 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.544 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 74.6 mttt -61.01 -77.12 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.135 -179.612 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 151.94 35.72 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.777 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.9 p -100.89 -13.65 18.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.715 0.293 . . . . 0.0 110.93 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.446 HD11 HD22 ' A' ' 91' ' ' LEU . 14.8 tp -58.71 -26.82 64.28 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.92 0.391 . . . . 0.0 110.47 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.721 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -87.21 5.32 85.33 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.512 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -91.03 -54.46 3.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.983 0.42 . . . . 0.0 110.185 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -48.82 148.91 1.98 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.188 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.8 p -73.35 -166.02 0.3 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.96 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.551 HG22 ' HB3' ' A' ' 84' ' ' LYS . 52.4 t -75.5 -57.34 1.64 Allowed Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.056 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.512 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 4.4 Cg_endo -47.37 -27.87 7.63 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.247 1.965 . . . . 0.0 111.869 179.679 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -79.24 -50.16 11.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.842 179.076 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.792 ' CB ' HD13 ' A' ' 87' ' ' LEU . 14.4 mt -61.5 -39.04 89.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.163 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -52.25 -44.47 64.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.989 179.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -53.76 -52.11 61.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.946 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.658 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.99 -43.09 86.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.643 179.536 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -40.26 88.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.641 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.12 -35.58 79.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.795 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.08 -32.63 44.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.202 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -84.92 -28.85 25.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.2 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.83 33.81 50.04 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.53 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.452 HD13 ' HB1' ' A' ' 90' ' ' ALA . 0.9 OUTLIER -82.39 178.16 8.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.833 0.349 . . . . 0.0 111.286 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -102.34 76.74 1.59 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.004 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.424 ' HB3' HD23 ' A' ' 87' ' ' LEU . 24.1 t -161.35 -163.06 0.95 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.749 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.764 ' HA2' HD21 ' A' ' 87' ' ' LEU . . . 134.8 -32.1 2.64 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.729 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mt -80.6 -73.18 0.38 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.973 0.416 . . . . 0.0 111.284 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.2 mtmm -80.45 110.16 15.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.575 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.739 ' HA ' HD12 ' A' ' 87' ' ' LEU . 10.0 ptmm? -47.06 -52.92 13.85 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.907 179.519 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -49.12 -37.67 22.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.134 0.492 . . . . 0.0 110.054 179.115 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -70.54 -33.16 70.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.932 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.792 HD13 ' CB ' ' A' ' 69' ' ' LEU . 62.5 mt -61.8 -43.48 98.76 Favored 'General case' 0 CA--C 1.52 -0.18 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.721 HD21 ' CA ' ' A' ' 62' ' ' GLY . 3.7 mp -52.93 -60.39 3.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.28 178.473 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -48.72 -47.53 41.15 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.645 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.452 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -53.62 -46.31 70.41 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.059 0.457 . . . . 0.0 110.286 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.729 HD12 ' O ' ' A' ' 87' ' ' LEU . 0.8 OUTLIER -67.15 -56.13 11.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.44 179.055 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.667 ' OG1' HG23 ' A' ' 56' ' ' ILE . 1.0 OUTLIER -50.04 -56.96 8.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.555 179.886 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.443 ' HG2' ' HA ' ' A' ' 90' ' ' ALA . 0.0 OUTLIER -50.05 -28.29 6.85 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.161 179.537 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.414 ' N ' ' HG3' ' A' ' 93' ' ' LYS . 3.0 t60 -89.86 5.35 46.61 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.818 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' PHE . . . . . 0.555 ' CZ ' ' HD2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -146.14 11.31 1.18 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 121.02 -0.272 . . . . 0.0 111.442 179.973 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.91 118.17 16.56 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.804 0.335 . . . . 0.0 110.881 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.4 t0 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.245 -0.884 . . . . 0.0 110.86 -179.984 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.81 0.338 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 26.5 t -74.04 -44.54 50.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.035 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.418 ' O ' ' CD1' ' A' ' 47' ' ' TYR . 2.3 tt0 -165.42 -69.72 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.132 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.657 ' HB3' HD21 ' A' ' 52' ' ' LEU . 68.9 m-85 -157.42 73.89 0.74 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.792 -179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.517 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 35.6 p -74.12 -55.15 6.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.462 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.846 ' HA ' HD12 ' A' ' 52' ' ' LEU . 10.8 pt-20 170.25 -40.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.114 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -55.78 -55.24 34.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.962 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.464 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.9 tt0 -59.88 -41.6 91.95 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.152 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.846 HD12 ' HA ' ' A' ' 49' ' ' GLU . 30.4 mt -58.54 -53.42 58.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.205 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.501 ' HG2' ' CE2' ' A' ' 95' ' ' PHE . 0.8 OUTLIER -53.1 -47.56 68.48 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.068 0.461 . . . . 0.0 109.888 179.105 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.0 m -58.7 -44.76 90.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.615 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.464 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 12.8 m-70 -59.26 -50.82 72.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.815 178.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.572 HG13 HD22 ' A' ' 61' ' ' LEU . 40.9 mt -57.18 -46.26 84.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.98 179.256 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.5 m -52.45 -73.91 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.511 -179.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp -61.35 -69.01 0.26 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.956 -179.593 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 143.44 37.29 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.658 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 19.3 p -100.92 -13.69 18.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.545 0.212 . . . . 0.0 111.015 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.822 ' C ' HD11 ' A' ' 88' ' ' LEU . 14.5 tp -59.07 -32.06 69.44 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.009 0.433 . . . . 0.0 110.236 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.54 ' N ' HD11 ' A' ' 88' ' ' LEU . . . -80.16 6.15 60.81 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.73 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.31 -50.29 6.21 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 120.927 0.394 . . . . 0.0 110.403 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -49.11 149.22 2.06 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.348 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 31.5 p -73.71 -162.86 0.14 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.663 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.489 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 24.6 t -75.67 -59.17 1.26 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.884 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 5.4 Cg_endo -47.48 -29.39 10.11 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.275 1.984 . . . . 0.0 111.877 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -79.69 -44.84 20.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.89 179.183 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.805 HD13 ' HB2' ' A' ' 87' ' ' LEU . 15.9 mt -61.32 -48.87 79.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.129 179.041 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.555 ' CD ' HD21 ' A' ' 87' ' ' LEU . 20.6 mmmt -52.64 -34.11 49.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.298 179.053 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -56.3 -55.84 28.39 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.855 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.64 ' CB ' HD21 ' A' ' 91' ' ' LEU . . . -57.63 -45.55 85.27 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.994 0.426 . . . . 0.0 110.317 179.422 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 91.3 m -60.59 -43.12 97.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.239 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -35.08 78.36 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.546 179.518 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.19 -37.93 72.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.741 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -83.88 -23.28 31.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.132 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.3 24.21 29.62 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.341 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.4 mt -81.17 -174.27 4.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.788 0.327 . . . . 0.0 110.989 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.16 71.3 1.39 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.063 0.459 . . . . 0.0 110.505 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.693 ' CB ' HD23 ' A' ' 87' ' ' LEU . 3.0 m -76.52 -170.9 1.65 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.024 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.854 ' C ' HD22 ' A' ' 82' ' ' LEU . . . -116.69 -129.04 4.26 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.691 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.854 HD22 ' C ' ' A' ' 81' ' ' GLY . 2.5 mm? -147.03 9.8 0.99 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.498 0.189 . . . . 0.0 111.143 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.5 tptm -84.04 6.0 23.78 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.599 0.238 . . . . 0.0 111.23 179.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.7 mtmm 72.13 -78.34 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.518 -179.552 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -51.1 -32.15 21.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.901 0.381 . . . . 0.0 111.008 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -64.16 -40.03 95.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.919 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.805 ' HB2' HD13 ' A' ' 69' ' ' LEU . 1.2 mt -61.11 -42.78 99.16 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 179.314 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.822 HD11 ' C ' ' A' ' 61' ' ' LEU . 4.5 mm? -50.72 -53.65 29.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.502 179.006 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -50.85 -53.23 34.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.872 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -53.24 -43.29 67.2 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.133 0.492 . . . . 0.0 110.261 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.64 HD21 ' CB ' ' A' ' 72' ' ' ALA . 0.6 OUTLIER -66.11 -58.11 6.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.264 179.143 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.426 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.9 m -50.74 -59.13 4.41 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.018 179.701 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.4 tptm -47.63 -31.51 4.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.235 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -75.33 -44.19 46.65 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.367 -179.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' PHE . . . . . 0.501 ' CE2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -92.81 3.68 55.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.623 -179.641 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' A' ' 92' ' ' THR . 1.4 tp-100 -73.02 143.1 47.65 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.788 0.328 . . . . 0.0 110.726 179.746 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.872 -179.988 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.798 0.332 . . . . 0.0 111.13 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.767 HG23 ' CE1' ' A' ' 47' ' ' TYR . 11.5 p -74.25 60.61 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.027 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -77.22 -41.06 42.76 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.232 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.767 ' CE1' HG23 ' A' ' 45' ' ' VAL . 5.3 m-30 65.7 120.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.253 0.549 . . . . 0.0 110.251 -179.189 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.8 p -163.61 -33.11 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.218 -179.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.636 ' HA ' HD12 ' A' ' 52' ' ' LEU . 0.0 OUTLIER 169.07 -56.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.287 179.576 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.0 -53.79 44.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.695 0.284 . . . . 0.0 110.835 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.443 ' HG3' ' CE1' ' A' ' 55' ' ' HIS . 1.1 tp10 -61.11 -40.77 95.02 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.886 HD22 ' CD2' ' A' ' 91' ' ' LEU . 45.2 mt -59.7 -52.33 65.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.182 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.49 ' HG2' ' CZ ' ' A' ' 95' ' ' PHE . 1.2 mmtp -52.76 -47.97 67.11 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.016 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.8 m -57.23 -45.7 83.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.271 178.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.443 ' CE1' ' HG3' ' A' ' 51' ' ' GLU . 27.1 m170 -60.94 -52.93 62.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.828 178.673 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 24.7 mt -57.75 -38.45 65.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.057 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.4 t -52.31 -75.21 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.408 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -61.52 -70.48 0.19 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.946 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 150.53 34.93 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.774 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.8 p -101.96 -15.07 16.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.742 0.306 . . . . 0.0 111.022 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.854 HD13 ' O ' ' A' ' 61' ' ' LEU . 2.8 tm? -58.57 -26.72 63.9 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.895 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.454 ' HA2' HD21 ' A' ' 88' ' ' LEU . . . -93.09 2.56 71.95 Favored Glycine 0 C--N 1.33 0.242 0 C-N-CA 120.766 -0.731 . . . . 0.0 113.034 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.5 mtmm -91.87 -38.67 12.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.929 0.395 . . . . 0.0 110.586 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.44 ' CE2' ' HA ' ' A' ' 61' ' ' LEU . 28.6 m-85 -47.08 152.66 0.52 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.511 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.64 -171.56 1.06 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.014 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.496 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 69.2 t -75.83 -58.25 1.38 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.696 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 9.3 Cg_endo -52.31 -28.32 34.17 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.047 1.831 . . . . 0.0 111.489 179.318 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.7 mtm -79.57 -45.94 18.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.9 179.157 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.896 ' CB ' HD13 ' A' ' 87' ' ' LEU . 27.2 mt -61.67 -44.05 97.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.346 179.175 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.71 -36.38 46.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.732 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -55.51 -53.1 60.52 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.637 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.688 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -58.05 -44.92 87.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.575 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.474 ' SG ' HD23 ' A' ' 87' ' ' LEU . 1.7 m -58.83 -40.69 84.96 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.935 179.336 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.79 -36.53 83.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.191 179.127 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.68 -32.56 65.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.642 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.483 ' CE2' HD13 ' A' ' 52' ' ' LEU . 1.5 m-85 -82.92 -34.21 26.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.773 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 97.61 15.63 36.73 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.584 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.039 HD13 ' HB1' ' A' ' 90' ' ' ALA . 0.9 OUTLIER -81.41 159.83 24.2 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.794 0.331 . . . . 0.0 110.891 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.49 28.19 6.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.161 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.75 -173.38 3.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.874 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.476 ' HA2' HD21 ' A' ' 87' ' ' LEU . . . 117.0 -145.67 18.73 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.767 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 81' ' ' GLY . 5.2 mt 68.3 -67.77 0.19 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.022 0.439 . . . . 0.0 110.847 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -83.73 -95.63 0.06 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.909 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.44 -61.34 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.9 0.381 . . . . 0.0 109.995 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.437 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 1.0 OUTLIER -55.13 -46.61 75.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.702 179.128 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -44.13 -35.85 2.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.073 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.896 HD13 ' CB ' ' A' ' 69' ' ' LEU . 15.9 mt -63.04 -43.93 97.32 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.454 HD21 ' HA2' ' A' ' 62' ' ' GLY . 1.8 mp -51.76 -55.4 19.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.161 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.54 -52.13 41.58 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.817 179.73 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 1.039 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.68 -42.7 65.0 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 121.188 0.518 . . . . 0.0 110.055 179.273 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.886 ' CD2' HD22 ' A' ' 52' ' ' LEU . 0.4 OUTLIER -67.19 -60.32 2.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.48 178.996 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.1 m -50.03 -54.95 16.82 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.273 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 30.6 mttm -49.61 -33.06 14.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.035 179.185 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.481 ' CE1' ' CD1' ' A' ' 76' ' ' TYR . 2.1 t-160 -83.89 1.1 44.92 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.676 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' PHE . . . . . 0.49 ' CZ ' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.75 22.4 1.0 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.749 0.309 . . . . 0.0 111.05 179.751 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.17 174.33 7.33 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.891 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.944 179.995 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.833 0.349 . . . . 0.0 111.186 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.8 t -73.62 -38.58 52.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.018 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 67.85 14.03 9.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.428 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.732 ' HB3' HD21 ' A' ' 52' ' ' LEU . 30.2 m-85 52.82 83.34 0.06 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.046 0.451 . . . . 0.0 111.031 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 90.5 p -74.02 -52.65 12.07 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.661 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.5 ' HA ' HD12 ' A' ' 52' ' ' LEU . 3.4 mt-10 164.31 -36.45 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.348 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -60.16 3.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.258 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.503 ' HG2' ' CE1' ' A' ' 55' ' ' HIS . 0.2 OUTLIER -58.72 -40.48 83.85 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.402 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.732 HD21 ' HB3' ' A' ' 47' ' ' TYR . 68.1 mt -59.47 -51.89 67.96 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.247 178.802 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.46 ' HG2' ' CD2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.5 -48.09 69.27 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.152 0.501 . . . . 0.0 109.872 179.115 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.2 m -57.8 -42.24 83.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.708 178.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.503 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 26.3 m170 -60.07 -48.94 79.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.916 178.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 55.6 mt -57.24 -47.72 83.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.143 179.419 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -53.08 -73.76 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.542 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.83 -70.81 0.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.279 -179.441 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 144.34 36.18 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.868 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.573 HG22 ' HD2' ' A' ' 63' ' ' LYS . 0.6 OUTLIER -99.88 -10.49 21.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.705 0.288 . . . . 0.0 110.898 179.583 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.83 HD11 HD22 ' A' ' 91' ' ' LEU . 28.8 tp -59.05 -21.27 58.85 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.829 0.347 . . . . 0.0 110.507 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.742 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -90.77 16.86 57.23 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.435 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.573 ' HD2' HG22 ' A' ' 60' ' ' THR . 10.8 mtpt -89.66 -47.25 8.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.008 0.433 . . . . 0.0 110.356 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.404 ' HB2' ' HG ' ' A' ' 69' ' ' LEU . 73.1 m-85 -48.17 153.41 0.7 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.489 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.592 ' O ' HG23 ' A' ' 66' ' ' VAL . 55.0 m -74.94 -81.62 0.07 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.602 -179.757 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.592 HG23 ' O ' ' A' ' 65' ' ' THR . 3.8 t -160.42 -64.84 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.131 -178.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.499 ' CD ' ' HB ' ' A' ' 66' ' ' VAL . 10.2 Cg_endo -50.63 -26.11 16.29 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.264 1.976 . . . . 0.0 110.912 178.855 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.7 mtm -78.6 -43.2 26.98 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.535 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.604 ' HB2' HD13 ' A' ' 87' ' ' LEU . 19.8 mt -62.63 -44.34 96.54 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.457 179.06 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.3 mmtt -51.3 -34.56 33.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.656 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.446 ' HB3' ' CD2' ' A' ' 47' ' ' TYR . 2.3 tp10 -55.8 -55.44 32.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.799 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.94 88.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.96 0.41 . . . . 0.0 110.36 179.402 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 80.5 m -60.4 -40.94 92.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.248 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.6 ttm-85 -61.69 -36.9 82.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.133 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.43 -28.52 56.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.541 179.351 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.445 ' CE1' ' HG3' ' A' ' 49' ' ' GLU . 3.3 m-85 -83.02 -32.6 26.81 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.705 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.67 16.71 59.58 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.62 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.504 HD13 ' O ' ' A' ' 90' ' ' ALA . 4.0 mt -81.85 -165.61 1.02 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.877 0.37 . . . . 0.0 111.115 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -133.96 74.98 1.57 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.321 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.462 ' HG ' HD23 ' A' ' 87' ' ' LEU . 4.3 p -74.54 -176.44 2.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.288 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -113.18 165.52 12.05 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.842 -179.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -81.83 1.38 35.12 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.07 -75.54 0.24 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.721 0.296 . . . . 0.0 110.686 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.665 ' HA ' HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER 166.82 -71.41 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.593 179.531 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.533 ' HA ' HD13 ' A' ' 88' ' ' LEU . 5.7 tp60 -51.06 -30.76 16.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.852 0.358 . . . . 0.0 111.106 179.651 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -58.92 -39.68 82.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.746 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.665 HD12 ' HA ' ' A' ' 84' ' ' LYS . 1.1 mt -61.58 -43.94 97.94 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.742 HD21 ' CA ' ' A' ' 62' ' ' GLY . 4.0 mp -51.78 -53.91 34.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.134 178.572 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -50.23 -53.15 30.2 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.867 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.504 ' O ' HD13 ' A' ' 78' ' ' LEU . . . -51.89 -44.01 63.58 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.145 0.498 . . . . 0.0 110.341 179.381 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.83 HD22 HD11 ' A' ' 61' ' ' LEU . 0.5 OUTLIER -67.39 -57.15 7.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.352 178.981 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.2 m -50.46 -56.64 10.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.544 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -49.52 -31.06 9.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.052 179.374 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 19.1 t60 -75.76 -9.28 58.46 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.655 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' PHE . . . . . 0.46 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.21 29.98 0.95 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.862 0.363 . . . . 0.0 110.955 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -72.85 178.53 4.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.807 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.9 t0 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.845 179.945 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.426 ' O ' ' CG2' ' A' ' 45' ' ' VAL . 10.7 tptt . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.778 0.323 . . . . 0.0 111.126 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.426 ' CG2' ' O ' ' A' ' 44' ' ' LYS . 61.6 t -159.97 76.34 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.583 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -75.69 -35.03 60.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.021 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.899 ' HB3' HD21 ' A' ' 52' ' ' LEU . 15.7 m-85 -81.71 64.08 6.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.899 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.12 -46.74 40.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.719 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.849 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.5 tt0 166.91 -43.02 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.386 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.1 -55.97 25.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.016 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.457 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 3.5 tt0 -59.72 -40.89 89.51 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.128 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.905 HD22 ' CD2' ' A' ' 91' ' ' LEU . 26.8 mt -59.24 -52.81 64.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.245 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.706 ' O ' HG22 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -53.89 -46.38 71.38 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 121.256 0.551 . . . . 0.0 110.126 179.2 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.9 m -59.48 -43.53 93.26 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.457 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 28.1 m170 -60.49 -51.65 68.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.99 178.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.706 HG22 ' O ' ' A' ' 53' ' ' LYS . 8.8 tt -58.54 -44.85 90.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-O 120.841 0.353 . . . . 0.0 110.617 179.48 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.2 m -56.59 -63.48 1.18 Allowed 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.869 179.626 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.403 ' N ' ' CD ' ' A' ' 58' ' ' LYS . 8.9 mptt -62.19 -50.52 71.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.953 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.8 23.63 4.59 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.495 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 38.2 p -101.07 1.08 39.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.498 0.19 . . . . 0.0 111.512 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.609 HD23 HD23 ' A' ' 88' ' ' LEU . 47.5 tp -59.63 -26.85 65.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.778 0.323 . . . . 0.0 110.923 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.684 ' HA3' HD11 ' A' ' 88' ' ' LEU . . . -92.87 12.89 68.92 Favored Glycine 0 CA--C 1.518 0.267 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.738 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -91.67 -51.55 5.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.851 0.358 . . . . 0.0 110.676 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -46.78 158.11 0.13 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.166 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 26.4 p -72.84 -167.83 0.41 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.886 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.873 HG12 ' HD3' ' A' ' 70' ' ' LYS . 55.9 t -76.76 -59.58 0.95 Allowed Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.209 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.522 ' HA ' ' CD ' ' A' ' 70' ' ' LYS . 3.8 Cg_endo -46.42 -29.68 7.42 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.526 2.151 . . . . 0.0 112.144 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 29.4 mtm -79.2 -44.72 21.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.167 0.508 . . . . 0.0 109.993 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.718 ' HB2' HD13 ' A' ' 87' ' ' LEU . 29.6 mt -64.73 -55.64 18.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.071 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.873 ' HD3' HG12 ' A' ' 66' ' ' VAL . 0.0 OUTLIER -51.19 -27.3 8.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.748 0.309 . . . . 0.0 110.784 179.865 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -57.53 -53.05 62.54 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.586 179.425 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.682 ' CB ' HD21 ' A' ' 91' ' ' LEU . . . -59.01 -48.32 82.0 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.986 0.422 . . . . 0.0 110.357 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.403 ' CB ' ' HB2' ' A' ' 78' ' ' LEU . 90.8 m -61.33 -40.73 95.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.666 179.45 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -61.77 -36.22 80.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.675 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.19 -44.87 64.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.611 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -88.71 10.02 22.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.574 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.37 44.67 76.56 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.86 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.696 HD12 ' HB1' ' A' ' 90' ' ' ALA . 3.6 mm? -81.33 -177.95 6.71 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.827 0.346 . . . . 0.0 110.919 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.44 -43.87 7.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.826 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.678 ' HB2' HD23 ' A' ' 87' ' ' LEU . 8.2 p 45.99 -164.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.367 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.42 ' N ' ' HB3' ' A' ' 86' ' ' GLU . . . -137.88 -108.71 0.86 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.727 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -160.49 -31.35 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.738 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -65.96 0.88 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.689 0.281 . . . . 0.0 111.205 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.821 ' HA ' HD12 ' A' ' 87' ' ' LEU . 0.8 OUTLIER 173.36 -64.57 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.102 179.99 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.543 ' HA ' HD12 ' A' ' 88' ' ' LEU . 29.8 tt0 -46.9 -34.89 5.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.876 0.37 . . . . 0.0 111.189 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.42 ' HB3' ' N ' ' A' ' 81' ' ' GLY . 3.7 mm-40 -59.91 -44.57 94.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.565 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.821 HD12 ' HA ' ' A' ' 84' ' ' LYS . 1.3 mt -61.78 -43.04 99.64 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.112 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.684 HD11 ' HA3' ' A' ' 62' ' ' GLY . 3.8 mt -50.64 -50.99 53.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.425 178.804 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -51.05 -54.61 23.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.105 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.696 ' HB1' HD12 ' A' ' 78' ' ' LEU . . . -55.12 -43.4 74.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.95 0.405 . . . . 0.0 110.909 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.905 ' CD2' HD22 ' A' ' 52' ' ' LEU . 0.8 OUTLIER -69.12 -49.02 60.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.498 179.438 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.574 HG22 ' N ' ' A' ' 93' ' ' LYS . 0.7 OUTLIER -52.4 -61.32 2.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.711 -179.988 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.654 ' HD2' HD11 ' A' ' 78' ' ' LEU . 0.0 OUTLIER -48.87 -28.38 3.72 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.731 0.301 . . . . 0.0 111.058 179.557 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 -72.89 -23.6 60.74 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.262 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' PHE . . . . . 0.506 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.06 45.13 1.08 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.889 0.376 . . . . 0.0 111.014 -179.856 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.466 ' HB2' HD11 ' A' ' 56' ' ' ILE . 0.1 OUTLIER -167.36 98.91 0.51 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.937 179.885 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.956 -179.99 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.423 ' O ' ' CG2' ' A' ' 45' ' ' VAL . 19.8 mtmt . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.792 0.329 . . . . 0.0 111.141 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.423 ' CG2' ' O ' ' A' ' 44' ' ' LYS . 52.7 t -160.15 -53.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.547 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 75.59 9.15 3.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.343 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.406 ' HB3' HD21 ' A' ' 52' ' ' LEU . 24.8 m-85 51.04 63.73 2.12 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.987 0.422 . . . . 0.0 111.128 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.508 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 91.2 p -72.28 -52.83 14.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.283 179.642 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.852 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.8 pt-20 165.4 -34.68 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.009 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -60.13 4.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.062 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.441 ' HG3' ' CE1' ' A' ' 55' ' ' HIS . 0.1 OUTLIER -59.23 -39.75 83.71 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.251 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.852 HD12 ' HA ' ' A' ' 49' ' ' GLU . 22.3 mt -60.21 -51.56 69.07 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.155 178.767 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.493 ' HA ' HD12 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -53.72 -48.39 69.65 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.86 179.045 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.1 m -57.89 -45.09 86.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.605 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.443 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 14.8 m-70 -59.56 -51.01 71.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.808 178.83 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.493 HD12 ' HA ' ' A' ' 53' ' ' LYS . 20.3 mt -56.84 -45.12 83.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.844 179.325 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.4 m -52.94 -70.74 0.08 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.352 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.6 mttp -61.56 -79.75 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.029 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 157.49 33.26 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.885 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 17.0 p -102.77 -12.46 17.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.734 0.302 . . . . 0.0 111.037 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.857 HD13 ' O ' ' A' ' 61' ' ' LEU . 3.1 tm? -59.65 -27.09 66.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.802 0.334 . . . . 0.0 110.81 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.499 ' HA2' HD21 ' A' ' 88' ' ' LEU . . . -90.22 11.13 71.98 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.755 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.74 -47.01 7.59 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.879 0.371 . . . . 0.0 110.557 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -47.43 146.6 1.99 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.388 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.57 ' O ' HD12 ' A' ' 69' ' ' LEU . 32.6 p -73.71 -169.84 0.77 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.118 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.563 HG22 ' CA ' ' A' ' 84' ' ' LYS . 78.8 t -76.4 -56.24 1.54 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.507 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.534 ' HA ' ' CD ' ' A' ' 70' ' ' LYS . 5.5 Cg_endo -48.29 -35.94 28.53 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.341 2.027 . . . . 0.0 112.233 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 26.9 mtp -81.69 -34.34 30.72 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.78 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.877 ' CB ' HD13 ' A' ' 87' ' ' LEU . 7.5 mt -63.04 -52.89 61.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.572 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.534 ' CD ' ' HA ' ' A' ' 67' ' ' PRO . 0.5 OUTLIER -49.45 -29.87 7.22 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.868 0.366 . . . . 0.0 111.026 -179.663 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.418 ' N ' ' HG2' ' A' ' 70' ' ' LYS . 2.0 tt0 -57.32 -55.34 36.08 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.357 179.415 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.426 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -58.91 -40.2 83.81 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.29 179.139 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.723 ' SG ' HD23 ' A' ' 87' ' ' LEU . 7.7 m -60.12 -40.58 90.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.391 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.94 -36.43 81.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.466 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.87 -32.74 59.84 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.63 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.499 ' CD2' ' CG ' ' A' ' 94' ' ' HIS . 3.2 m-30 -84.17 -23.91 30.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.971 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 82.36 23.76 55.87 Favored Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.492 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' A' ' 73' ' ' CYS . 1.4 mt -81.81 170.48 15.65 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.922 0.392 . . . . 0.0 111.155 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -111.47 81.16 1.4 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.76 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -159.5 -171.22 3.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.084 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.62 ' HA2' HD21 ' A' ' 87' ' ' LEU . . . 109.38 48.54 0.8 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.667 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -158.51 19.24 0.22 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.586 0.232 . . . . 0.0 111.576 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.432 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -159.15 6.49 0.1 Allowed 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -179.915 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.563 ' CA ' HG22 ' A' ' 66' ' ' VAL . 16.5 ttpp 69.13 -82.4 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.604 0.24 . . . . 0.0 110.895 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.673 ' HA ' HD22 ' A' ' 88' ' ' LEU . 34.1 tt0 -49.04 -45.38 42.65 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.897 0.379 . . . . 0.0 111.249 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.432 ' HB2' ' HB3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -47.28 -39.38 14.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.902 179.978 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.877 HD13 ' CB ' ' A' ' 69' ' ' LEU . 1.7 mt -62.57 -43.93 97.58 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.27 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.673 HD22 ' HA ' ' A' ' 85' ' ' GLN . 1.2 mp -51.97 -53.55 40.09 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.139 178.79 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -50.79 -52.97 35.83 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.812 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.48 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.85 -43.83 66.34 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.02 0.438 . . . . 0.0 110.496 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.724 HD13 HD11 ' A' ' 61' ' ' LEU . 0.7 OUTLIER -66.29 -54.87 19.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.425 179.341 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.419 HG22 ' N ' ' A' ' 93' ' ' LYS . 0.9 OUTLIER -50.58 -59.41 4.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.373 179.802 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.419 ' N ' HG22 ' A' ' 92' ' ' THR . 1.5 ptmm? -48.24 -31.2 5.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.214 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.499 ' CG ' ' CD2' ' A' ' 76' ' ' TYR . 51.3 t-80 -74.26 -17.9 60.8 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.712 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' PHE . . . . . 0.484 ' CD1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -146.87 38.04 0.99 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.945 0.402 . . . . 0.0 110.855 -179.831 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.401 ' NE2' ' CG2' ' A' ' 92' ' ' THR . 1.7 tt0 -72.31 -167.05 0.29 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.876 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.4 t70 . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.895 179.945 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.45 ' O ' HG12 ' A' ' 45' ' ' VAL . 9.2 ptpt . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.495 0.188 . . . . 0.0 111.099 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.616 HG22 ' O ' ' A' ' 45' ' ' VAL . 13.2 p 43.24 30.27 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.14 0 CA-C-O 120.996 0.427 . . . . 0.0 111.375 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.97 -33.89 59.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.087 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.454 ' HB3' HD21 ' A' ' 52' ' ' LEU . 28.0 m-85 59.13 46.4 13.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.988 0.423 . . . . 0.0 110.718 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.405 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 1.1 p -72.05 -42.83 65.81 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.637 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.866 ' HA ' HD12 ' A' ' 52' ' ' LEU . 3.4 mt-10 163.79 -43.94 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.536 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.0 -56.28 21.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.173 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.455 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.0 OUTLIER -60.02 -40.33 88.94 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.327 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.866 HD12 ' HA ' ' A' ' 49' ' ' GLU . 19.8 mt -59.9 -51.73 68.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.247 178.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.877 ' HA ' HD12 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -54.07 -47.84 71.25 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-O 121.073 0.463 . . . . 0.0 109.938 179.071 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.5 m -57.81 -42.61 84.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.685 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.456 ' CE1' ' HZ ' ' A' ' 64' ' ' PHE . 28.9 m170 -59.61 -49.29 78.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.829 178.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.877 HD12 ' HA ' ' A' ' 53' ' ' LYS . 6.9 mt -57.36 -48.36 82.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.988 179.313 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 2.4 m -53.78 -63.54 1.12 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.54 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 30.4 mttm -60.85 -46.45 90.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.254 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 116.98 20.78 4.76 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.692 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 21.8 p -97.87 -8.44 28.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.613 0.244 . . . . 0.0 111.047 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.729 ' O ' HD22 ' A' ' 88' ' ' LEU . 3.4 tm? -58.87 -29.37 66.94 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.654 0.264 . . . . 0.0 110.378 179.618 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.575 ' HA2' HD22 ' A' ' 88' ' ' LEU . . . -85.0 10.67 62.29 Favored Glycine 0 CA--C 1.52 0.387 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.536 179.52 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -95.48 -40.71 9.33 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.781 0.324 . . . . 0.0 111.641 -179.547 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.456 ' HZ ' ' CE1' ' A' ' 55' ' ' HIS . 86.0 m-85 -44.74 144.74 1.06 Allowed 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -179.061 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.629 ' O ' HD12 ' A' ' 69' ' ' LEU . 15.8 p -74.24 -171.68 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.54 179.334 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.516 ' HB ' ' HD3' ' A' ' 67' ' ' PRO . 70.6 t -76.81 -46.23 3.0 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.65 -179.625 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.516 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 39.6 Cg_exo -60.42 -30.28 90.54 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.13 1.887 . . . . 0.0 111.952 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' MET . . . . . 0.412 ' HE3' ' N ' ' A' ' 68' ' ' MET . 0.0 OUTLIER -81.45 -39.15 25.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.301 179.656 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.949 HD21 HD23 ' A' ' 88' ' ' LEU . 11.5 mt -61.01 -40.96 95.53 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.147 179.835 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -52.33 -42.0 63.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.949 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.39 -53.52 56.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.411 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.993 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -56.26 -50.36 71.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.942 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -59.58 -37.43 78.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.194 179.416 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -62.46 -37.74 87.08 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.161 179.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.88 -27.99 49.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.744 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -82.09 -37.94 25.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.939 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 100.75 18.19 21.29 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.923 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.48 HD13 ' HB1' ' A' ' 90' ' ' ALA . 21.0 mt -81.15 -166.71 1.21 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.696 0.284 . . . . 0.0 110.737 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.428 ' O ' ' O ' ' A' ' 80' ' ' SER . 0.2 OUTLIER -96.26 -43.85 7.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.774 179.813 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.428 ' O ' ' O ' ' A' ' 79' ' ' LYS . 0.0 OUTLIER 57.71 138.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.434 179.527 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.414 ' O ' ' HB2' ' A' ' 82' ' ' LEU . . . 147.17 -165.93 28.55 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.231 -0.985 . . . . 0.0 113.086 179.57 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.602 ' N ' HD12 ' A' ' 82' ' ' LEU . 4.7 mp 68.83 -67.4 0.21 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.961 0.41 . . . . 0.0 110.793 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.65 152.85 16.43 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.248 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.729 ' HA ' HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -44.37 -54.61 5.68 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.895 179.548 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.923 ' HA ' HD12 ' A' ' 88' ' ' LEU . 3.8 tt0 -46.19 -43.65 15.4 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.014 0.435 . . . . 0.0 110.3 179.238 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -60.91 -42.2 97.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.504 178.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.729 HD12 ' HA ' ' A' ' 84' ' ' LYS . 26.6 mt -62.72 -54.25 42.12 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 178.264 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.949 HD23 HD21 ' A' ' 69' ' ' LEU . 4.3 mt -53.44 -52.07 60.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.679 178.369 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.37 -49.21 70.36 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.572 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.48 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -51.83 -42.69 62.75 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 121.128 0.49 . . . . 0.0 110.01 179.303 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.993 HD21 ' HB1' ' A' ' 72' ' ' ALA . 0.4 OUTLIER -64.82 -62.46 1.55 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.247 178.887 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 18.0 m -49.55 -57.51 6.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.101 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -47.06 -30.8 2.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.138 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -65.83 -52.92 46.45 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.627 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' PHE . . . . . 0.486 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -90.91 -9.82 44.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.799 -179.386 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -73.3 64.18 0.78 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.863 0.363 . . . . 0.0 110.908 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.017 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.824 0.345 . . . . 0.0 111.161 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 22.0 t -74.53 62.47 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.165 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -75.75 -58.79 3.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.859 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.739 ' HB3' HD21 ' A' ' 52' ' ' LEU . 22.4 m-85 -81.88 68.43 8.25 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.729 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.557 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 78.9 p -71.18 -55.54 7.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.424 179.755 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.64 ' HA ' HD12 ' A' ' 52' ' ' LEU . 4.6 pt-20 170.38 -37.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.446 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -57.46 -55.28 36.9 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.703 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.444 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 2.1 tt0 -61.35 -41.56 97.25 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.006 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.739 HD21 ' HB3' ' A' ' 47' ' ' TYR . 43.3 mt -59.65 -50.58 73.29 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.14 178.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.491 ' HG2' ' CD2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -52.58 -49.86 64.16 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.011 178.957 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 94.5 m -59.3 -42.42 91.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.012 179.082 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.444 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 29.4 m170 -58.44 -50.04 75.13 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 36.8 mt -58.27 -56.86 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.514 178.072 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.9 p -67.36 46.59 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.117 179.077 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -175.6 -58.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.744 0.307 . . . . 0.0 111.019 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 125.25 24.2 1.65 Allowed Glycine 0 CA--C 1.518 0.257 0 C-N-CA 120.659 -0.782 . . . . 0.0 113.036 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.7 -11.92 20.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.599 0.238 . . . . 0.0 111.097 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.963 HD11 HD13 ' A' ' 91' ' ' LEU . 17.8 tp -58.81 -22.61 58.87 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.815 0.34 . . . . 0.0 110.602 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -91.05 19.37 46.62 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.343 179.465 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.41 -58.34 2.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.037 0.446 . . . . 0.0 110.214 179.732 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -49.54 152.32 1.4 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.397 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 22.4 p -74.14 -167.09 0.47 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.881 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.569 HG13 HD11 ' A' ' 87' ' ' LEU . 55.3 t -77.14 -57.42 1.12 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.276 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.508 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 6.2 Cg_endo -48.89 -31.42 19.95 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.358 2.039 . . . . 0.0 112.139 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 45.8 mtm -79.46 -39.54 31.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.249 179.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.781 HD13 ' HB2' ' A' ' 87' ' ' LEU . 8.8 mt -61.12 -39.69 90.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.631 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.74 -36.77 58.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.891 179.725 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -55.52 -52.49 63.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.925 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.828 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.58 -42.85 83.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.731 179.763 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.54 ' HA ' HD12 ' A' ' 78' ' ' LEU . 8.8 m -59.84 -38.91 83.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.681 179.664 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 mtt-85 -62.07 -36.33 81.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.671 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -81.14 -29.89 34.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.082 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CD2' ' CG ' ' A' ' 94' ' ' HIS . 2.8 m-30 -84.82 -25.64 27.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.105 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.59 21.73 49.88 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.592 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.54 HD12 ' HA ' ' A' ' 73' ' ' CYS . 2.8 mt -81.27 -175.93 5.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.866 0.365 . . . . 0.0 110.961 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.2 tmtt? -97.47 -40.35 8.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.029 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.547 ' HB2' HD23 ' A' ' 87' ' ' LEU . 0.0 OUTLIER 69.68 173.52 0.3 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.768 -179.987 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -138.23 -130.27 2.78 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.588 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.431 ' HA ' HD23 ' A' ' 82' ' ' LEU . 12.3 mt -159.18 53.1 0.39 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.004 0.43 . . . . 0.0 110.744 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.15 10.16 0.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.803 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 75.03 -71.94 0.12 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.816 0.341 . . . . 0.0 110.755 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.401 ' HA ' ' HG ' ' A' ' 88' ' ' LEU . 0.5 OUTLIER -47.33 -34.81 7.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.405 179.947 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -62.04 -45.29 94.24 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.057 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.781 ' HB2' HD13 ' A' ' 69' ' ' LEU . 1.2 mt -60.96 -42.62 98.63 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.573 HD21 HD11 ' A' ' 69' ' ' LEU . 6.8 mt -52.61 -53.28 48.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.273 178.585 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.78 -52.47 40.54 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.799 179.696 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.417 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -53.12 -45.03 68.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.005 0.431 . . . . 0.0 110.52 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.963 HD13 HD11 ' A' ' 61' ' ' LEU . 3.1 mt -66.52 -53.8 30.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.347 179.202 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.45 HG22 ' N ' ' A' ' 93' ' ' LYS . 0.9 OUTLIER -51.5 -60.49 3.08 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.448 179.859 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.45 ' N ' HG22 ' A' ' 92' ' ' THR . 1.6 pttt -48.12 -28.96 3.21 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.801 0.334 . . . . 0.0 110.975 179.48 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.5 ' CG ' ' CD2' ' A' ' 76' ' ' TYR . 3.0 t60 -67.54 -58.49 4.62 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.673 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' PHE . . . . . 0.491 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -95.82 22.4 7.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.256 179.887 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -72.13 141.06 49.14 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.809 0.338 . . . . 0.0 110.72 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.877 -179.933 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.438 ' O ' ' CG2' ' A' ' 45' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.668 0.27 . . . . 0.0 111.194 . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.438 ' CG2' ' O ' ' A' ' 44' ' ' LYS . 63.4 t -160.49 84.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.667 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -75.38 -6.8 51.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.379 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.678 ' HB3' HD21 ' A' ' 52' ' ' LEU . 25.7 m-85 65.68 57.06 0.87 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.017 0.436 . . . . 0.0 110.811 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.524 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 5.6 p -72.4 -53.13 13.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.356 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.871 ' HA ' HD12 ' A' ' 52' ' ' LEU . 2.8 pt-20 169.01 -35.03 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.207 179.731 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.52 -58.29 8.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.812 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.45 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -60.07 -41.59 92.74 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.208 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.871 HD12 ' HA ' ' A' ' 49' ' ' GLU . 14.0 mt -60.36 -49.52 77.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.013 178.739 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.626 ' HA ' HD12 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -53.29 -49.27 67.32 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.096 179.208 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.52 -44.76 89.65 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.553 179.032 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.45 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 8.1 m-70 -60.13 -51.12 70.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.815 178.835 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.626 HD12 ' HA ' ' A' ' 53' ' ' LYS . 8.7 mt -56.66 -45.49 82.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.939 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -53.61 -73.96 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.221 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 48.3 mttt -62.18 -75.56 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.078 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 149.77 37.71 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.738 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.2 p -100.89 -8.81 22.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.656 0.265 . . . . 0.0 111.066 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.42 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 16.1 tp -58.79 -23.77 60.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.812 0.339 . . . . 0.0 110.694 179.864 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.796 ' HA2' HD11 ' A' ' 88' ' ' LEU . . . -91.42 14.07 64.82 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.367 179.542 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.2 tttt -92.28 -55.81 3.28 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.934 0.397 . . . . 0.0 110.407 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -48.0 154.54 0.53 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.307 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.3 p -73.67 -167.32 0.45 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.929 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.579 HG22 ' HA ' ' A' ' 84' ' ' LYS . 56.0 t -77.03 -57.94 1.08 Allowed Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.256 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.504 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 5.2 Cg_endo -47.83 -30.25 12.9 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.34 2.026 . . . . 0.0 112.054 179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 33.1 mtm -80.33 -46.88 15.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.271 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.912 ' HB2' HD13 ' A' ' 87' ' ' LEU . 36.1 mt -61.14 -46.11 91.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.449 179.381 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.437 ' N ' HD22 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -51.95 -32.1 31.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.54 179.272 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.42 ' HB3' ' CD2' ' A' ' 47' ' ' TYR . 0.0 OUTLIER -56.76 -54.92 40.71 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.891 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.675 ' CB ' HD21 ' A' ' 91' ' ' LEU . . . -57.12 -46.9 82.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.974 0.416 . . . . 0.0 110.372 179.522 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 57.3 m -61.01 -44.06 97.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.338 179.226 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.1 mmt180 -63.15 -34.3 77.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.67 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.86 -38.08 73.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.846 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.503 ' CD1' ' CE1' ' A' ' 94' ' ' HIS . 4.5 m-85 -84.28 -28.63 27.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.035 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.94 26.57 11.33 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.605 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.485 HD23 ' HB3' ' A' ' 76' ' ' TYR . 4.4 mm? -81.09 176.41 9.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.793 0.33 . . . . 0.0 110.912 -179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.92 -33.07 11.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.799 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.566 ' HB2' HD23 ' A' ' 87' ' ' LEU . 3.9 p 48.33 -173.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.418 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -124.92 160.4 19.55 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.47 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 35.4 mt -80.85 -4.5 54.98 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -80.38 -73.55 0.36 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.677 0.275 . . . . 0.0 110.768 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.749 ' O ' HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER 167.84 -67.32 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.978 179.851 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.573 ' HA ' HD13 ' A' ' 88' ' ' LEU . 0.0 OUTLIER -54.5 -38.13 66.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.041 0.448 . . . . 0.0 110.681 179.76 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -45.13 -31.64 1.5 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.432 -179.065 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.912 HD13 ' HB2' ' A' ' 69' ' ' LEU . 2.3 mt -62.46 -40.72 97.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.099 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.796 HD11 ' HA2' ' A' ' 62' ' ' GLY . 5.1 mp -50.92 -53.64 30.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.38 178.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -49.74 -54.52 18.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.956 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.475 ' HB1' ' HG ' ' A' ' 78' ' ' LEU . . . -51.49 -44.54 62.52 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.199 0.524 . . . . 0.0 110.121 179.303 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.833 ' CD2' HD22 ' A' ' 52' ' ' LEU . 0.4 OUTLIER -66.75 -58.2 5.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.755 179.16 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.416 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.3 m -49.35 -53.95 19.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.298 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.92 -31.12 4.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.12 179.264 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.503 ' CE1' ' CD1' ' A' ' 76' ' ' TYR . 2.5 t60 -76.44 -16.55 59.66 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.704 -179.452 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' PHE . . . . . 0.474 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -146.78 36.12 0.95 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.819 0.343 . . . . 0.0 110.998 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.416 ' N ' ' O ' ' A' ' 92' ' ' THR . 2.8 pt20 -77.89 24.13 0.24 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.985 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.904 179.979 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.584 ' HB3' HD21 ' A' ' 52' ' ' LEU . 27.6 m-85 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.987 0.423 . . . . 0.0 110.811 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.415 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 0.7 OUTLIER -71.82 -42.13 67.38 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.336 179.502 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.861 ' HA ' HD12 ' A' ' 52' ' ' LEU . 0.4 OUTLIER 163.11 -42.84 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.367 179.84 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.2 -58.7 6.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.311 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.449 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.4 tp10 -58.88 -39.1 80.4 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.861 HD12 ' HA ' ' A' ' 49' ' ' GLU . 22.1 mt -60.2 -52.94 63.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.222 178.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.523 ' HG2' ' CE2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.56 -48.21 69.35 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-O 121.033 0.444 . . . . 0.0 109.952 179.168 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.7 m -59.39 -45.6 91.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.954 179.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.477 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 15.3 m-70 -59.59 -49.07 79.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.258 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.711 HG13 HD12 ' A' ' 61' ' ' LEU . 58.7 mt -55.29 -40.56 57.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.946 179.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.4 t -53.26 -77.01 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.347 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -49.28 77.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.29 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 118.67 31.84 1.42 Allowed Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.743 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.478 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 2.9 m -98.25 -6.23 31.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.587 0.232 . . . . 0.0 111.099 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.757 ' C ' HD11 ' A' ' 88' ' ' LEU . 0.6 OUTLIER -59.86 -22.46 62.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.874 0.369 . . . . 0.0 110.337 179.352 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.501 ' N ' HD11 ' A' ' 88' ' ' LEU . . . -90.77 22.44 28.17 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.846 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 60' ' ' THR . 0.2 OUTLIER -90.4 -54.87 3.82 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.107 0.48 . . . . 0.0 109.987 179.47 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -49.42 158.27 0.43 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.563 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.444 ' H ' ' HE3' ' A' ' 68' ' ' MET . 65.3 p -73.89 -168.0 0.55 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.624 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.853 HG22 ' HA ' ' A' ' 84' ' ' LYS . 47.4 t -77.35 -47.51 2.53 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.656 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.537 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 51.7 Cg_exo -52.15 -34.14 57.16 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.187 1.924 . . . . 0.0 111.88 179.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . 0.444 ' HE3' ' H ' ' A' ' 65' ' ' THR . 46.5 mtm -80.01 -40.48 27.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.497 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.57 ' HB2' HD13 ' A' ' 87' ' ' LEU . 9.6 mt -60.32 -41.52 93.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.491 179.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.93 -34.91 57.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.684 179.142 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.09 -54.86 39.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.966 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.836 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -56.94 -43.56 81.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.672 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 13.7 m -60.27 -41.26 92.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.442 179.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.85 -35.95 79.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.544 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.99 -30.29 50.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.817 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.429 ' CE1' ' HG3' ' A' ' 49' ' ' GLU . 2.7 m-85 -84.26 -29.11 26.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.006 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.77 24.02 47.47 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.573 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.414 HD13 ' HB1' ' A' ' 90' ' ' ALA . 2.9 mt -81.2 -170.79 2.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.796 0.331 . . . . 0.0 110.846 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -96.86 -37.58 10.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.881 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 68.23 176.58 0.26 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.857 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -137.37 146.22 18.07 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.483 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.2 mp -80.75 65.63 5.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.83 0.348 . . . . 0.0 111.015 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.561 ' O ' HG21 ' A' ' 66' ' ' VAL . 2.0 tptt -157.39 -73.38 0.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.029 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.853 ' HA ' HG22 ' A' ' 66' ' ' VAL . 35.8 tttm 168.9 -83.77 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.582 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -47.55 -31.77 4.72 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.159 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -52.37 -36.86 54.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.696 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.628 HD11 HG13 ' A' ' 66' ' ' VAL . 1.2 mt -62.39 -47.37 84.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.764 179.166 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.757 HD11 ' C ' ' A' ' 61' ' ' LEU . 4.3 mm? -51.2 -51.25 55.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.333 178.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.44 -53.2 39.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.816 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.414 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.91 -44.09 66.69 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.112 0.482 . . . . 0.0 110.117 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.836 HD21 ' HB1' ' A' ' 72' ' ' ALA . 2.0 mt -65.94 -57.3 8.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.696 179.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.1 m -49.76 -55.9 12.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.365 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.8 mmtm -48.61 -35.21 13.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.216 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.427 ' CD2' ' CD2' ' A' ' 76' ' ' TYR . 1.5 t-80 -79.17 -3.35 45.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.817 -179.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . 0.523 ' CE2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.5 27.66 0.9 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.663 0.268 . . . . 0.0 110.947 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.982 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.657 ' HB3' HD21 ' A' ' 52' ' ' LEU . 17.3 m-85 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 121.016 0.436 . . . . 0.0 110.696 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.512 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 85.3 p -71.52 -47.89 52.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.31 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.756 ' HA ' HD12 ' A' ' 52' ' ' LEU . 5.3 pt-20 167.39 -42.16 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.486 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -55.7 -56.1 24.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.251 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.458 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.3 OUTLIER -60.07 -40.73 90.55 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.395 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.756 HD12 ' HA ' ' A' ' 49' ' ' GLU . 23.7 mt -60.05 -50.98 71.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.208 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.634 ' HA ' HD12 ' A' ' 56' ' ' ILE . 41.5 tttm -53.04 -48.88 67.28 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.1 m -55.19 -43.12 74.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.313 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.516 ' HB2' HD12 ' A' ' 61' ' ' LEU . 4.7 m-70 -60.79 -49.81 75.98 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.686 178.467 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.634 HD12 ' HA ' ' A' ' 53' ' ' LYS . 34.3 mt -55.89 -46.74 80.31 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.905 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 58.5 m -53.7 -74.37 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.272 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -61.79 -74.77 0.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.133 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 145.66 37.39 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.857 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 63.2 p -100.41 -9.48 22.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.688 0.28 . . . . 0.0 111.034 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.62 HD22 ' HG ' ' A' ' 88' ' ' LEU . 0.7 OUTLIER -58.67 -24.84 62.05 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.843 0.354 . . . . 0.0 110.38 179.611 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.717 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -88.01 16.19 52.54 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.581 179.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.6 mtmt -91.38 -57.91 2.62 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.089 0.471 . . . . 0.0 110.125 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -49.92 155.8 0.84 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.361 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 73.6 p -74.4 -169.53 0.84 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.708 179.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.601 HG13 HD11 ' A' ' 87' ' ' LEU . 53.7 t -78.01 -46.69 2.25 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.748 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.516 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 52.6 Cg_exo -51.97 -34.69 57.64 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.192 1.928 . . . . 0.0 111.84 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 17.0 mtm -80.27 -39.26 29.24 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.404 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.647 ' CB ' HD13 ' A' ' 87' ' ' LEU . 7.9 mt -60.82 -46.89 88.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.393 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.453 ' HD3' HG12 ' A' ' 66' ' ' VAL . 0.2 OUTLIER -52.08 -33.14 37.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.628 179.256 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.402 ' O ' ' CG ' ' A' ' 74' ' ' ARG . 2.2 tm-20 -56.82 -53.76 54.12 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.865 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.689 ' CB ' HD21 ' A' ' 91' ' ' LEU . . . -57.68 -33.74 68.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.031 0.443 . . . . 0.0 110.38 179.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.779 ' HA ' HD12 ' A' ' 78' ' ' LEU . 34.8 m -61.45 -47.48 85.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.02 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.405 ' HG3' ' N ' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -61.99 -28.45 69.57 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.921 -179.849 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.405 ' N ' ' HG3' ' A' ' 74' ' ' ARG . . . -80.14 -34.29 37.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.986 0.422 . . . . 0.0 110.724 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.463 ' CE2' ' HB3' ' A' ' 94' ' ' HIS . 3.2 m-30 -84.8 -25.76 27.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.047 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.07 24.52 31.73 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.457 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.779 HD12 ' HA ' ' A' ' 73' ' ' CYS . 1.3 mt -81.13 -164.73 0.79 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.759 0.314 . . . . 0.0 110.821 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.64 24.4 2.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.006 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.83 -166.99 0.87 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.785 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.671 ' HA2' HD21 ' A' ' 87' ' ' LEU . . . 108.8 88.03 1.93 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.632 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 82' ' ' LEU . 19.2 mt -158.86 -86.17 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.675 0.274 . . . . 0.0 110.667 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 3.1 mmtm -82.0 -66.01 0.94 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.841 0.353 . . . . 0.0 110.642 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.605 ' HA ' HD12 ' A' ' 87' ' ' LEU . 0.8 OUTLIER 169.13 -65.63 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.019 179.931 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.68 -37.48 28.89 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.248 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.87 -40.12 69.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.067 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.741 ' O ' HD12 ' A' ' 91' ' ' LEU . 1.9 mt -61.54 -47.16 86.84 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.717 HD21 ' CA ' ' A' ' 62' ' ' GLY . 9.4 mp -51.42 -53.02 41.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.227 178.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -51.12 -52.75 40.71 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.879 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.545 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.88 -43.24 66.0 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.103 0.478 . . . . 0.0 110.107 179.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.741 HD12 ' O ' ' A' ' 87' ' ' LEU . 0.4 OUTLIER -66.82 -58.52 4.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.695 179.187 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.41 ' OG1' HG23 ' A' ' 56' ' ' ILE . 1.2 m -49.37 -55.59 12.43 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.263 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.8 mtpp -46.31 -34.21 4.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.043 179.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.463 ' HB3' ' CE2' ' A' ' 76' ' ' TYR . 33.1 t-80 -66.22 -55.42 16.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.143 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . 0.57 ' CZ ' ' HD2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -92.38 14.26 17.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.5 -179.629 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.408 ' N ' ' O ' ' A' ' 92' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.169 0 CA-C-O 120.729 0.3 . . . . 0.0 110.873 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.807 ' HB3' HD21 ' A' ' 52' ' ' LEU . 26.8 m-85 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.987 0.423 . . . . 0.0 110.911 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.46 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 13.1 p -71.87 -46.92 56.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.518 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.708 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.2 tt0 168.16 -43.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.537 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.33 -58.55 6.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.374 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.417 ' O ' ' CD2' ' A' ' 55' ' ' HIS . 0.3 OUTLIER -59.06 -39.26 81.53 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.463 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.807 HD21 ' HB3' ' A' ' 47' ' ' TYR . 38.0 mt -60.33 -52.3 65.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.306 178.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.763 ' HA ' HD12 ' A' ' 56' ' ' ILE . 1.4 tmtp? -54.87 -47.34 74.37 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-O 121.107 0.479 . . . . 0.0 110.005 179.153 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.2 m -59.09 -44.04 91.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.9 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.417 ' CD2' ' O ' ' A' ' 51' ' ' GLU . 19.3 m-70 -58.68 -49.73 76.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.889 179.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.763 HD12 ' HA ' ' A' ' 53' ' ' LYS . 8.2 mt -57.63 -48.21 83.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.014 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.91 -65.74 0.51 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.645 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 46.2 mttt -60.69 -39.01 86.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.166 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 111.29 23.67 5.68 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.527 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 44.5 p -97.65 -13.63 21.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.587 0.232 . . . . 0.0 111.001 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.824 ' O ' HD22 ' A' ' 88' ' ' LEU . 3.1 tm? -59.09 -28.53 66.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.746 0.308 . . . . 0.0 110.463 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.597 ' HA2' HD13 ' A' ' 88' ' ' LEU . . . -86.7 13.22 59.26 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.598 179.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.94 -45.68 6.84 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.815 0.341 . . . . 0.0 111.275 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -45.24 144.77 1.27 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.958 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.647 ' O ' HD12 ' A' ' 69' ' ' LEU . 26.7 p -74.13 -168.2 0.6 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.82 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.518 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 55.5 t -76.1 -56.84 1.54 Allowed Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.626 -179.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.518 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 7.9 Cg_endo -50.28 -34.9 41.96 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.357 2.038 . . . . 0.0 112.416 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 47.1 mtm -80.1 -33.91 38.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.489 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.976 HD21 HD23 ' A' ' 88' ' ' LEU . 4.8 mt -61.43 -41.55 97.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.924 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.75 -37.68 43.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.839 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.61 -57.79 10.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.985 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.825 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.61 -44.29 85.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.872 0.368 . . . . 0.0 110.546 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.2 m -60.27 -37.26 79.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.436 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.0 mtt180 -62.47 -36.89 83.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.647 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -78.82 -32.16 46.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.005 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.465 ' CE1' ' HG3' ' A' ' 49' ' ' GLU . 2.7 m-85 -83.79 -25.99 29.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.187 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.7 24.45 55.9 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.617 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.4 mt -81.11 175.6 10.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.822 0.344 . . . . 0.0 110.842 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.01 -53.8 3.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.833 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.631 ' CB ' HD23 ' A' ' 87' ' ' LEU . 86.8 p 45.29 -166.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.35 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.53 ' C ' HD12 ' A' ' 82' ' ' LEU . . . -148.22 -112.23 0.66 Allowed Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.475 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.649 ' N ' HD12 ' A' ' 82' ' ' LEU . 0.1 OUTLIER -153.31 13.09 0.49 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.594 0.235 . . . . 0.0 111.395 -179.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.416 ' O ' ' HB3' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -84.97 8.05 19.09 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.764 -0.198 . . . . 0.0 111.292 179.476 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.416 ' HB3' ' O ' ' A' ' 83' ' ' LYS . 32.4 tttt 71.39 -79.35 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.57 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.855 ' HA ' HD12 ' A' ' 88' ' ' LEU . 0.5 OUTLIER -47.3 -40.44 16.92 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.88 0.372 . . . . 0.0 111.093 179.592 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.22 -49.78 66.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.692 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.84 ' HB2' HD13 ' A' ' 69' ' ' LEU . 2.4 mt -61.22 -49.58 76.56 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 178.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.976 HD23 HD21 ' A' ' 69' ' ' LEU . 15.4 mt -52.67 -50.55 63.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.941 178.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -54.5 -52.4 62.08 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.593 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -51.33 -41.4 60.53 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.099 0.476 . . . . 0.0 110.114 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.825 HD21 ' HB1' ' A' ' 72' ' ' ALA . 1.1 mt -65.67 -61.54 2.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.295 179.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.7 m -50.17 -56.67 10.05 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.086 179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.4 mtpt -48.36 -33.41 8.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.095 179.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -71.6 -15.47 62.26 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.684 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . 0.447 ' CD1' ' HE3' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.19 34.84 0.89 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.839 0.352 . . . . 0.0 110.908 -179.867 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.88 -179.979 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.728 ' HB3' HD21 ' A' ' 52' ' ' LEU . 60.6 m-85 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 121.015 0.435 . . . . 0.0 110.482 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.529 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 85.3 p -73.67 -55.32 6.41 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.616 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.684 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.0 OUTLIER 168.66 -37.22 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.149 179.831 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -57.09 -54.79 42.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.765 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.46 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.0 OUTLIER -61.09 -42.92 99.4 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.022 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.728 HD21 ' HB3' ' A' ' 47' ' ' TYR . 33.1 mt -58.72 -50.99 71.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.077 178.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.476 ' CE ' ' CD1' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -52.42 -48.92 65.45 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.858 179.055 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.549 HG22 ' HD2' ' A' ' 58' ' ' LYS . 3.9 m -57.51 -42.34 82.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.643 178.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.669 ' HB2' HD12 ' A' ' 61' ' ' LEU . 4.7 m-70 -60.09 -48.9 79.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.859 178.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 74.7 mt -56.41 -47.95 80.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.859 179.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.48 -72.75 0.06 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.51 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.549 ' HD2' HG22 ' A' ' 54' ' ' THR . 4.1 mttt -61.53 -74.34 0.08 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.297 -179.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 145.53 35.24 0.07 OUTLIER Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.949 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.428 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 0.7 OUTLIER -99.82 -9.62 22.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.644 0.259 . . . . 0.0 110.85 179.603 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.669 HD12 ' HB2' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -59.32 -21.48 59.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.902 0.382 . . . . 0.0 110.379 179.544 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.705 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -90.66 15.12 61.16 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.934 -0.651 . . . . 0.0 112.535 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.428 ' HB2' ' O ' ' A' ' 60' ' ' THR . 0.1 OUTLIER -90.92 -55.95 3.36 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.025 0.44 . . . . 0.0 109.977 179.633 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -49.82 151.79 1.71 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.236 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.467 ' O ' HD12 ' A' ' 69' ' ' LEU . 17.8 p -73.87 -165.49 0.3 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.767 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.514 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 41.7 t -76.59 -57.55 1.26 Allowed Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.205 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 9.1 Cg_endo -50.95 -28.97 25.63 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.272 1.981 . . . . 0.0 112.101 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.4 mtp -79.98 -39.33 30.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.151 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.744 ' HB2' HD13 ' A' ' 87' ' ' LEU . 7.0 mt -61.16 -43.03 99.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.52 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.94 -33.4 37.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.854 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -56.02 -52.52 63.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.053 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.643 ' CB ' HD21 ' A' ' 91' ' ' LEU . . . -57.67 -53.01 63.04 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.687 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.97 -33.61 72.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.358 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -37.72 87.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.08 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.77 -26.83 31.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.715 179.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CD2' ' CD2' ' A' ' 94' ' ' HIS . 3.0 m-85 -82.97 -30.92 27.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.817 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.97 14.6 59.05 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.809 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.559 HD13 ' O ' ' A' ' 90' ' ' ALA . 4.4 mt -82.04 167.19 19.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.934 0.397 . . . . 0.0 111.103 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.29 75.58 1.82 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.662 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.695 ' OG ' HD23 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -75.85 -169.07 1.0 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.103 -179.697 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -140.91 -120.37 1.67 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.47 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.7 pp -155.4 11.23 0.32 Allowed 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.8 tptp -85.52 7.05 24.38 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.614 0.245 . . . . 0.0 111.095 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.4 ttmm 69.43 -76.82 0.06 Allowed 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.53 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -50.56 -36.36 34.21 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.876 0.37 . . . . 0.0 111.161 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -62.08 -38.28 88.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.062 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.744 HD13 ' HB2' ' A' ' 69' ' ' LEU . 1.2 mt -61.38 -42.44 98.72 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.705 HD21 ' CA ' ' A' ' 62' ' ' GLY . 9.2 mp -52.04 -54.48 29.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.34 178.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -50.37 -52.54 36.36 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.828 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.559 ' O ' HD13 ' A' ' 78' ' ' LEU . . . -51.4 -44.09 62.13 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.199 0.523 . . . . 0.0 109.814 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.643 HD21 ' CB ' ' A' ' 72' ' ' ALA . 0.4 OUTLIER -66.66 -61.09 2.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.653 179.016 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.0 m -48.88 -52.14 25.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.365 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 15.6 tptp -48.46 -34.64 11.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.168 179.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.501 ' CD2' ' CD2' ' A' ' 76' ' ' TYR . 24.7 t60 -78.53 -5.55 52.98 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.923 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . 0.476 ' CD1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.65 27.96 0.98 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.799 0.333 . . . . 0.0 110.975 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.884 179.92 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.781 ' HB3' HD21 ' A' ' 52' ' ' LEU . 24.4 m-85 . . . . . 0 CA--C 1.522 -0.11 0 CA-C-O 120.971 0.415 . . . . 0.0 110.754 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.512 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 83.0 p -72.47 -52.99 13.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.342 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.858 ' HA ' HD12 ' A' ' 52' ' ' LEU . 2.5 pt-20 164.83 -39.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.001 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -56.13 -58.26 8.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.471 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.442 ' HG3' ' CE1' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -58.92 -37.5 76.81 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 179.61 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.858 HD12 ' HA ' ' A' ' 49' ' ' GLU . 36.2 mt -60.95 -53.6 55.31 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.22 178.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.643 ' HA ' HD12 ' A' ' 56' ' ' ILE . 20.8 tttm -54.7 -47.02 74.21 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-O 121.03 0.443 . . . . 0.0 110.096 178.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.9 m -56.97 -44.81 83.01 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.489 178.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.446 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 12.0 m-70 -60.42 -51.49 69.26 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.824 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.643 HD12 ' HA ' ' A' ' 53' ' ' LYS . 11.6 mt -56.96 -42.42 78.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.024 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.78 -76.11 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.643 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.9 pttt -60.97 -51.51 68.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.371 -179.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 123.98 52.18 0.2 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.564 -0.826 . . . . 0.0 112.805 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.661 HG22 ' HG3' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -124.18 -4.13 7.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.506 0.193 . . . . 0.0 111.097 179.792 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.481 HD11 HD13 ' A' ' 91' ' ' LEU . 60.7 tp -60.05 -20.89 60.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.843 0.354 . . . . 0.0 110.559 179.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.781 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -93.05 22.8 32.47 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.25 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.661 ' HG3' HG22 ' A' ' 60' ' ' THR . 0.3 OUTLIER -91.37 -57.59 2.73 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.018 0.437 . . . . 0.0 110.073 179.683 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -49.84 157.26 0.61 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.25 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 30.6 p -73.86 -169.4 0.73 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.037 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.529 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 75.2 t -76.77 -56.22 1.4 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.315 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 9.9 Cg_endo -52.31 -29.61 39.26 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.147 1.898 . . . . 0.0 112.027 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.71 -41.51 26.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.2 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.737 ' CB ' HD22 ' A' ' 87' ' ' LEU . 24.6 mt -61.4 -34.68 75.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.52 179.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.465 ' N ' HD22 ' A' ' 87' ' ' LEU . 12.4 mmtt -53.16 -38.21 62.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.097 179.636 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -54.98 -49.66 70.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.964 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.685 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.31 -48.81 77.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.733 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.76 -40.04 86.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.418 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -37.03 81.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.478 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.01 -30.39 44.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.734 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.636 ' HB3' HD23 ' A' ' 78' ' ' LEU . 2.7 m-85 -85.48 5.38 31.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.417 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.82 16.18 58.92 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.704 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.879 ' HG ' ' HB1' ' A' ' 90' ' ' ALA . 3.4 mm? -81.1 178.74 8.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.873 0.368 . . . . 0.0 110.868 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.17 -31.85 12.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.698 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.9 p 65.63 169.3 0.21 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.977 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -151.06 150.91 22.95 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.56 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.57 66.95 6.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.921 0.391 . . . . 0.0 110.864 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -155.88 8.33 0.24 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.938 -179.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.422 ' CA ' HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER 65.99 -76.48 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.725 0.298 . . . . 0.0 111.031 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.672 ' HA ' HD13 ' A' ' 88' ' ' LEU . 8.1 tt0 -47.83 -34.01 8.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.332 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 37.8 tp10 -59.72 -42.54 93.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.925 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.737 HD22 ' CB ' ' A' ' 69' ' ' LEU . 1.5 mp -61.11 -43.91 98.15 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.781 HD21 ' CA ' ' A' ' 62' ' ' GLY . 5.2 mp -51.51 -53.71 34.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.269 178.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -50.47 -53.25 31.21 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.97 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.879 ' HB1' ' HG ' ' A' ' 78' ' ' LEU . . . -52.19 -43.99 64.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.062 0.458 . . . . 0.0 110.128 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.721 ' CD2' HD22 ' A' ' 52' ' ' LEU . 0.4 OUTLIER -66.36 -58.54 5.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.424 179.094 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.9 m -50.23 -57.27 8.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.419 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.51 -31.87 11.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.279 179.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -85.43 0.49 52.09 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . 0.579 ' CZ ' ' HD2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -147.64 19.75 1.17 Allowed 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.036 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 . . . . . 0 C--N 1.333 -0.141 0 CA-C-O 120.799 0.333 . . . . 0.0 110.92 179.988 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.892 ' HB3' HD21 ' A' ' 52' ' ' LEU . 21.7 m-85 . . . . . 0 N--CA 1.461 0.084 0 CA-C-O 121.022 0.439 . . . . 0.0 110.967 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.512 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 2.7 p -73.34 -53.31 11.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.383 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.839 ' HA ' HD12 ' A' ' 52' ' ' LEU . 8.1 pt-20 168.24 -39.46 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.214 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -56.29 -55.61 31.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.036 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.476 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -59.97 -43.02 95.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.343 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.892 HD21 ' HB3' ' A' ' 47' ' ' TYR . 15.4 mt -58.9 -50.68 73.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.055 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.741 ' HA ' HD12 ' A' ' 56' ' ' ILE . 0.5 OUTLIER -52.61 -49.05 65.84 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.878 178.976 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.9 m -58.05 -43.45 86.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.727 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.476 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 6.2 m-70 -59.73 -49.33 78.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.84 178.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.741 HD12 ' HA ' ' A' ' 53' ' ' LYS . 16.4 mt -56.22 -47.73 80.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.988 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.54 -75.7 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.344 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -61.74 -72.28 0.13 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.148 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 143.33 39.47 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.582 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -99.52 -9.95 22.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.704 0.288 . . . . 0.0 111.068 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.619 HD12 HG13 ' A' ' 56' ' ' ILE . 0.4 OUTLIER -59.7 -21.46 60.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.862 0.363 . . . . 0.0 110.648 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.755 ' HA2' HD11 ' A' ' 88' ' ' LEU . . . -94.84 17.11 59.88 Favored Glycine 0 C--N 1.333 0.363 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.514 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.87 -57.44 2.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.992 0.425 . . . . 0.0 110.272 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -48.62 161.95 0.11 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.181 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 52.8 p -73.25 -174.63 1.65 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.816 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.674 HG22 ' HB3' ' A' ' 84' ' ' LYS . 82.7 t -75.86 -56.3 1.74 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.227 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.532 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 7.4 Cg_endo -50.08 -28.32 19.06 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.201 1.934 . . . . 0.0 111.89 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.47 -42.35 25.48 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.026 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.852 ' CB ' HD13 ' A' ' 87' ' ' LEU . 11.9 mt -60.87 -42.65 98.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.061 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.47 ' HD3' HD21 ' A' ' 87' ' ' LEU . 6.5 mmtp -54.06 -33.71 58.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.29 178.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -55.42 31.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.919 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.639 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.11 -44.57 83.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.02 0.438 . . . . 0.0 110.378 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 86.3 m -60.89 -43.26 98.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.426 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -35.74 78.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.469 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.67 -31.51 59.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.609 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -84.22 -23.45 30.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.972 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 92.47 15.4 53.3 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.57 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.482 HD13 ' HB1' ' A' ' 90' ' ' ALA . 4.5 mt -81.21 172.98 12.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.753 0.311 . . . . 0.0 110.856 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.68 -50.07 4.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.654 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.835 ' CB ' HD23 ' A' ' 87' ' ' LEU . 59.0 p 45.44 -166.15 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.593 179.591 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.58 164.88 17.91 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.368 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.1 mt 76.51 118.62 0.05 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.071 0.462 . . . . 0.0 111.031 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.419 ' O ' ' HB3' ' A' ' 84' ' ' LYS . 0.3 OUTLIER 62.53 -79.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.635 179.627 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.674 ' HB3' HG22 ' A' ' 66' ' ' VAL . 3.9 ptpt 163.68 -46.71 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.945 0.403 . . . . 0.0 110.14 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -47.24 -39.78 15.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.904 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -48.81 -36.42 16.72 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.56 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.852 HD13 ' CB ' ' A' ' 69' ' ' LEU . 9.6 mt -62.43 -51.66 66.65 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 178.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.755 HD11 ' HA2' ' A' ' 62' ' ' GLY . 4.0 mp -52.35 -54.29 33.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.844 178.225 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -51.5 -49.31 62.12 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.663 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.482 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.41 -45.24 65.82 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.161 0.505 . . . . 0.0 109.884 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.846 ' CD2' HD22 ' A' ' 52' ' ' LEU . 0.3 OUTLIER -66.61 -60.38 2.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.554 179.048 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.4 m -50.24 -52.96 31.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.368 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -48.88 -32.01 8.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.869 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -93.09 13.84 19.7 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.531 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . 0.505 ' HB3' HD13 ' A' ' 56' ' ' ILE . 0.1 OUTLIER -145.44 -6.09 0.64 Allowed 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.914 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.821 0.343 . . . . 0.0 110.893 179.911 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.901 ' HB3' HD21 ' A' ' 52' ' ' LEU . 3.1 m-85 . . . . . 0 N--CA 1.462 0.127 0 CA-C-O 121.056 0.455 . . . . 0.0 110.955 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.487 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 79.8 p -72.73 -44.24 61.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.703 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.889 ' HA ' HD12 ' A' ' 52' ' ' LEU . 26.7 tt0 165.22 -45.89 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.223 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.1 -56.55 16.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.22 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.468 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.1 OUTLIER -59.1 -40.28 84.81 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 179.29 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.901 HD21 ' HB3' ' A' ' 47' ' ' TYR . 28.0 mt -59.04 -53.66 55.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.285 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.48 ' HG2' ' CD2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.77 -47.28 70.87 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 121.065 0.459 . . . . 0.0 109.942 179.131 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.1 m -58.2 -42.17 85.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.697 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.468 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 12.8 m-70 -60.53 -47.76 84.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.181 179.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.539 HD11 ' HA ' ' A' ' 92' ' ' THR . 0.8 OUTLIER -55.51 -44.48 76.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.977 179.628 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 m -52.93 -73.13 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.307 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.2 mttm -62.13 -52.9 61.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.997 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 117.71 32.63 1.41 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.503 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.31 -3.14 34.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.613 0.244 . . . . 0.0 111.297 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.676 ' C ' HD21 ' A' ' 88' ' ' LEU . 0.6 OUTLIER -60.21 -23.0 63.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.723 0.297 . . . . 0.0 110.871 179.883 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.617 ' N ' HD21 ' A' ' 88' ' ' LEU . . . -96.62 20.72 49.33 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.818 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.69 -56.64 2.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.949 0.404 . . . . 0.0 110.325 179.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -48.43 154.17 0.66 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.345 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 72.1 p -73.09 -163.05 0.13 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.623 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.555 ' HB ' ' HD3' ' A' ' 67' ' ' PRO . 11.9 t -77.41 -51.69 1.89 Allowed Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.518 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.555 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 78.5 Cg_exo -46.43 -33.15 12.2 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.271 1.98 . . . . 0.0 111.966 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 9.4 mmm -80.18 -51.18 9.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.552 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.971 ' HB2' HD13 ' A' ' 87' ' ' LEU . 55.8 mt -60.43 -39.31 87.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.574 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.401 ' HD3' ' HA3' ' A' ' 81' ' ' GLY . 0.3 OUTLIER -52.14 -41.94 62.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.75 179.371 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.81 -55.15 29.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.22 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.572 ' HB2' ' CB ' ' A' ' 47' ' ' TYR . . . -57.32 -47.95 80.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.961 0.41 . . . . 0.0 110.499 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.729 ' SG ' HD23 ' A' ' 87' ' ' LEU . 31.9 m -61.41 -40.11 93.21 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.648 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.53 -35.55 80.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.944 0.402 . . . . 0.0 110.524 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.43 -43.27 70.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.854 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CE1' ' CE1' ' A' ' 94' ' ' HIS . 8.8 m-85 -84.87 -16.52 40.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.43 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 73' ' ' CYS . . . 59.39 46.27 94.17 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.571 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.587 ' CB ' ' HB1' ' A' ' 90' ' ' ALA . 1.5 mt -84.65 14.34 4.76 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? 61.91 8.12 2.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.315 -0.402 . . . . 0.0 112.006 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.89 -168.74 1.9 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.853 0.359 . . . . 0.0 110.906 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.611 ' HA2' HD21 ' A' ' 87' ' ' LEU . . . 93.6 88.5 1.62 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.629 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -159.76 -80.19 0.05 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.79 0.329 . . . . 0.0 110.932 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -80.54 -69.21 0.61 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.822 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.407 ' HA ' HG22 ' A' ' 66' ' ' VAL . 9.4 ttmm 173.97 -81.25 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.461 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.501 ' HG3' HD12 ' A' ' 88' ' ' LEU . 5.0 tt0 -47.8 -29.8 3.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.177 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.73 -36.33 62.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.784 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.971 HD13 ' HB2' ' A' ' 69' ' ' LEU . 2.3 mt -62.29 -44.94 95.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.276 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.676 HD21 ' C ' ' A' ' 61' ' ' LEU . 42.4 mt -50.87 -52.89 37.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.4 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -49.73 -52.13 33.71 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.861 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.587 ' HB1' ' CB ' ' A' ' 78' ' ' LEU . . . -53.67 -48.28 69.61 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.941 0.4 . . . . 0.0 110.663 179.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.856 HD22 HD22 ' A' ' 52' ' ' LEU . 2.3 mt -66.86 -49.2 66.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.62 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.549 HG22 ' N ' ' A' ' 93' ' ' LYS . 0.6 OUTLIER -52.15 -58.71 5.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.604 179.822 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.549 ' N ' HG22 ' A' ' 92' ' ' THR . 3.6 ptmt -47.85 -30.48 4.11 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.261 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.5 ' CE1' ' CE1' ' A' ' 76' ' ' TYR . 37.9 t-80 -73.32 -21.54 60.54 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.411 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . 0.48 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.46 43.21 1.1 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.944 0.402 . . . . 0.0 111.054 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.819 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.783 ' HB3' HD21 ' A' ' 52' ' ' LEU . 6.3 m-85 . . . . . 0 C--O 1.232 0.138 0 CA-C-O 121.01 0.433 . . . . 0.0 110.95 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.519 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 88.0 p -73.07 -47.78 41.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.268 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.886 ' HA ' HD12 ' A' ' 52' ' ' LEU . 6.4 pt-20 166.18 -41.72 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.898 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.17 -54.78 41.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.979 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.496 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.5 OUTLIER -59.58 -43.11 93.73 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.281 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.886 HD12 ' HA ' ' A' ' 49' ' ' GLU . 16.5 mt -59.04 -51.61 69.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.194 178.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.758 ' O ' HG22 ' A' ' 56' ' ' ILE . 1.3 mmtt -54.2 -45.15 72.12 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-O 121.273 0.559 . . . . 0.0 110.224 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.424 HG22 ' O ' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -61.11 -41.45 96.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.496 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 7.7 m-70 -60.75 -50.63 72.68 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.402 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.758 HG22 ' O ' ' A' ' 53' ' ' LYS . 8.7 tt -58.21 -42.35 83.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 121.064 0.459 . . . . 0.0 110.67 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.7 t -54.29 -76.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.172 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 9.8 mttt -62.43 -68.86 0.29 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.023 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 141.08 39.61 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.729 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 60.7 p -101.18 -10.45 20.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.676 0.274 . . . . 0.0 111.165 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.559 HD21 HD13 ' A' ' 91' ' ' LEU . 0.4 OUTLIER -59.09 -23.86 62.44 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.811 0.338 . . . . 0.0 110.586 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.649 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -90.58 11.99 69.86 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.414 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.1 mmtp -92.17 -54.4 3.84 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.931 0.396 . . . . 0.0 110.473 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -47.95 152.15 0.82 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.274 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 24.0 p -73.56 -166.66 0.37 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.852 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.503 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 53.2 t -76.96 -57.83 1.11 Allowed Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.437 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 5.7 Cg_endo -48.34 -29.97 14.31 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.275 1.983 . . . . 0.0 112.105 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.2 mtp -80.27 -41.45 24.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.26 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.92 ' CB ' HD13 ' A' ' 87' ' ' LEU . 11.9 mt -61.15 -49.86 75.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.555 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.598 ' HG3' HD21 ' A' ' 87' ' ' LEU . 2.0 mttt -51.32 -31.34 21.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.542 179.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -56.58 -53.57 56.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.796 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.783 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.83 -46.38 84.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.543 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 42.0 m -60.22 -40.67 90.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.561 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.9 ttt-85 -61.23 -36.52 80.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.51 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.3 -36.35 61.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.692 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.602 ' HB3' HD23 ' A' ' 78' ' ' LEU . 2.9 m-30 -85.49 5.97 28.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.481 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.93 33.59 64.0 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.546 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.602 HD23 ' HB3' ' A' ' 76' ' ' TYR . 1.4 mm? -80.66 -170.18 2.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.798 0.332 . . . . 0.0 110.884 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.6 35.68 1.63 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.859 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.706 ' HB3' HD23 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -77.21 -162.5 0.29 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.736 179.892 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 100.95 104.98 2.75 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.487 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -160.26 -39.16 0.05 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.872 0.368 . . . . 0.0 110.97 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -157.74 -52.96 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.768 -179.924 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 83' ' ' LYS . 3.1 ttpt 175.24 -76.67 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.472 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -47.83 -29.95 3.63 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.297 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -57.54 -38.67 75.11 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.811 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.92 HD13 ' CB ' ' A' ' 69' ' ' LEU . 8.1 mt -62.11 -45.88 91.54 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.649 HD21 ' CA ' ' A' ' 62' ' ' GLY . 3.2 mp -50.62 -51.04 52.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.233 178.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -51.31 -55.14 19.93 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.831 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -51.71 -42.24 62.09 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.136 0.493 . . . . 0.0 110.014 179.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.783 HD21 ' HB1' ' A' ' 72' ' ' ALA . 0.7 OUTLIER -65.96 -59.56 3.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.646 179.136 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.594 ' HA ' HD12 ' A' ' 56' ' ' ILE . 2.3 m -48.41 -55.07 11.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.408 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.69 -35.97 15.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.163 179.28 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.501 ' CD2' ' CD2' ' A' ' 76' ' ' TYR . 3.2 t60 -84.9 5.68 27.98 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.591 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . 0.473 ' CE1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.47 17.29 1.17 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.562 0.22 . . . . 0.0 111.164 179.934 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.333 -0.135 0 CA-C-O 120.8 0.333 . . . . 0.0 110.864 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.85 ' HB3' HD21 ' A' ' 52' ' ' LEU . 65.7 m-85 . . . . . 0 C--O 1.231 0.131 0 CA-C-O 121.11 0.481 . . . . 0.0 110.517 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 65.8 p -73.22 -45.83 53.86 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.012 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.795 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.2 pt-20 166.06 -46.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.425 -179.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.93 -58.8 5.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.398 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.431 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 3.3 mm-40 -58.8 -39.53 81.4 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.91 HD22 ' CD2' ' A' ' 91' ' ' LEU . 50.6 mt -59.3 -53.58 56.63 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.315 178.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.717 ' HE2' ' CG ' ' A' ' 95' ' ' PHE . 0.1 OUTLIER -55.11 -46.11 75.55 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.438 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.9 m -58.53 -44.83 89.69 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.432 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 13.5 m-70 -61.65 -53.57 54.36 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.056 -0.975 . . . . 0.0 109.738 178.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.489 HD12 ' HE3' ' A' ' 53' ' ' LYS . 14.4 mt -57.26 -41.38 78.03 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.74 179.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.7 t -55.08 -74.9 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.237 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.3 mtpp -62.75 -69.39 0.26 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.007 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 145.52 37.69 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.698 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 73.9 p -100.79 -10.32 20.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.643 0.259 . . . . 0.0 111.036 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.933 HD11 HD13 ' A' ' 91' ' ' LEU . 22.8 tp -58.27 -22.45 52.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.847 0.356 . . . . 0.0 110.646 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.552 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -94.09 15.51 63.01 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.609 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.07 -56.24 3.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.95 0.405 . . . . 0.0 110.51 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -48.68 154.79 0.63 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.383 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 82.6 p -73.33 -170.51 0.8 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.584 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.653 HG13 HD11 ' A' ' 87' ' ' LEU . 65.9 t -77.89 -46.9 2.3 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.838 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.526 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 60.1 Cg_exo -50.83 -35.26 48.12 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.17 1.914 . . . . 0.0 111.972 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 34.8 mtm -79.99 -40.33 28.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.474 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.684 ' CB ' HD13 ' A' ' 87' ' ' LEU . 7.7 mt -60.42 -44.82 95.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.496 179.523 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.75 -34.08 37.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.666 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -57.02 -54.54 45.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.899 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.702 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -56.79 -50.12 73.29 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.993 0.425 . . . . 0.0 110.496 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 8.2 m -60.89 -40.01 91.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.509 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.32 -35.94 80.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.735 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.8 -29.86 40.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.901 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.498 ' CE2' ' CD2' ' A' ' 94' ' ' HIS . 3.2 m-85 -84.63 -26.95 27.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.04 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.89 25.03 23.67 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.661 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.756 ' HG ' ' HB1' ' A' ' 90' ' ' ALA . 3.8 mm? -81.21 -175.66 5.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.828 0.346 . . . . 0.0 110.905 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.02 -24.69 15.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.01 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.519 ' HB3' HD23 ' A' ' 87' ' ' LEU . 0.3 OUTLIER 50.04 -176.62 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.916 0.389 . . . . 0.0 111.266 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -165.97 161.31 34.9 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.523 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 mp -80.38 -4.46 53.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.585 0.231 . . . . 0.0 111.411 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.1 2.24 28.2 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.673 -0.239 . . . . 0.0 111.57 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.737 ' HA ' HD12 ' A' ' 87' ' ' LEU . 17.9 ttmm 66.85 -73.98 0.07 Allowed 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.663 0.268 . . . . 0.0 110.962 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -47.74 -30.52 3.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.149 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -60.24 -35.57 75.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.792 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.737 HD12 ' HA ' ' A' ' 84' ' ' LYS . 1.5 mt -61.78 -42.32 98.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.048 0.452 . . . . 0.0 109.812 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.552 HD21 ' CA ' ' A' ' 62' ' ' GLY . 3.9 mp -51.83 -55.63 18.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.333 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -50.55 -51.2 50.12 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.888 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.756 ' HB1' ' HG ' ' A' ' 78' ' ' LEU . . . -52.68 -45.1 66.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.018 0.437 . . . . 0.0 110.165 179.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.933 HD13 HD11 ' A' ' 61' ' ' LEU . 0.5 OUTLIER -67.37 -57.86 5.84 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.598 179.16 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.401 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.3 m -50.44 -55.11 17.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.226 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.4 mtpt -48.05 -30.39 4.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.098 179.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.498 ' CD2' ' CE2' ' A' ' 76' ' ' TYR . 7.2 t60 -77.23 -15.9 59.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.983 -179.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . 0.717 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -147.19 33.11 0.89 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.782 0.325 . . . . 0.0 111.326 -179.819 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.401 ' N ' ' O ' ' A' ' 92' ' ' THR . 1.8 tp60 . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.861 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.993 0.425 . . . . 0.0 110.729 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.492 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 0.8 OUTLIER -72.51 -54.57 8.87 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.424 179.898 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.521 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.2 pt-20 168.11 -35.04 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.129 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.97 -59.43 5.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -59.83 -38.3 81.66 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.551 HD12 ' CE1' ' A' ' 76' ' ' TYR . 79.5 mt -61.3 -51.3 69.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.124 178.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.895 ' HA ' HD12 ' A' ' 56' ' ' ILE . 16.4 tttt -55.1 -47.84 74.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.988 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 91.6 m -57.83 -42.45 84.35 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.849 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.443 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 16.7 m-70 -59.64 -48.38 81.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.814 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.895 HD12 ' HA ' ' A' ' 53' ' ' LYS . 8.6 mt -57.5 -48.96 81.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.981 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.0 p -53.43 -62.84 1.39 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.714 -179.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.1 mttm -60.7 -34.65 74.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.257 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 108.64 19.98 8.4 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.557 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 61.8 p -97.95 -18.21 18.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.472 0.177 . . . . 0.0 110.888 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.852 ' O ' HD22 ' A' ' 88' ' ' LEU . 2.6 tm? -57.28 -36.76 71.43 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.627 ' HA2' HD13 ' A' ' 88' ' ' LEU . . . -90.06 51.78 3.49 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.057 178.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -139.56 -46.11 0.45 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.888 0.375 . . . . 0.0 110.835 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -47.07 152.85 0.5 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.53 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.674 ' O ' HD12 ' A' ' 69' ' ' LEU . 30.7 p -74.12 -169.56 0.8 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.992 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.679 HG23 ' HG2' ' A' ' 84' ' ' LYS . 63.3 t -76.12 -57.34 1.44 Allowed Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.469 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.511 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 4.4 Cg_endo -47.34 -34.23 18.36 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.47 2.113 . . . . 0.0 112.284 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 40.8 mtm -80.2 -38.13 31.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.335 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.975 HD21 HD23 ' A' ' 88' ' ' LEU . 5.2 mt -61.31 -39.93 92.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.846 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.42 -45.75 55.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.227 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -55.52 -52.2 64.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.027 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.971 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.38 -44.2 84.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.883 179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.93 -41.31 91.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.512 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.6 ttt85 -61.78 -36.12 80.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.623 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.72 -30.54 51.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.789 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.551 ' CE1' HD12 ' A' ' 52' ' ' LEU . 3.2 m-30 -84.45 -22.26 30.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.017 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.44 12.35 61.34 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.65 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.991 HD13 ' HB1' ' A' ' 90' ' ' ALA . 15.8 mt -81.11 -176.05 5.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.759 0.314 . . . . 0.0 110.873 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.9 38.44 1.46 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.866 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.715 ' HB3' HD23 ' A' ' 87' ' ' LEU . 0.7 OUTLIER -77.46 -173.11 2.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.839 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.402 ' HA2' HD11 ' A' ' 87' ' ' LEU . . . 126.64 162.1 11.11 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.736 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 5.1 mt 68.02 26.71 7.25 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.693 0.283 . . . . 0.0 111.413 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.41 ' HB3' ' CB ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -158.49 -6.08 0.08 Allowed 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.679 ' HG2' HG23 ' A' ' 66' ' ' VAL . 66.5 mttm 61.75 -85.25 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.598 0.237 . . . . 0.0 110.716 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.717 ' HA ' HD12 ' A' ' 88' ' ' LEU . 0.0 OUTLIER -48.08 -43.39 30.64 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.941 0.4 . . . . 0.0 110.957 179.722 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.41 ' CB ' ' HB3' ' A' ' 83' ' ' LYS . 1.3 tp10 -47.92 -46.54 32.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.793 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.715 HD23 ' HB3' ' A' ' 80' ' ' SER . 1.8 mt -61.68 -50.15 73.63 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.975 HD23 HD21 ' A' ' 69' ' ' LEU . 19.7 mt -51.83 -52.82 46.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.047 178.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.36 -50.86 64.16 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.656 179.256 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.991 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.35 -42.9 64.3 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.624 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.971 HD21 ' HB1' ' A' ' 72' ' ' ALA . 0.6 OUTLIER -65.1 -56.68 11.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.472 179.326 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.2 m -49.3 -60.4 2.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.494 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.433 ' HG2' ' HA ' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -48.72 -29.59 4.64 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.097 179.306 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.43 ' HB3' ' CE2' ' A' ' 76' ' ' TYR . 1.8 t60 -69.31 -19.24 63.89 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.557 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . 0.499 ' CD1' ' HE3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -146.3 37.9 1.04 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.905 0.383 . . . . 0.0 110.896 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.799 179.811 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.653 ' HB3' HD21 ' A' ' 52' ' ' LEU . 53.5 m-85 . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.867 0.365 . . . . 0.0 111.461 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.504 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 83.3 p -73.99 -55.3 6.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.326 179.401 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.639 ' HA ' HD12 ' A' ' 52' ' ' LEU . 2.9 pt-20 167.49 -36.23 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.084 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -57.13 -56.48 21.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.98 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.411 ' O ' ' CD2' ' A' ' 55' ' ' HIS . 0.1 OUTLIER -60.67 -41.03 94.24 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.269 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.653 HD21 ' HB3' ' A' ' 47' ' ' TYR . 39.9 mt -60.12 -50.64 72.91 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.081 178.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.685 ' HA ' HD12 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -53.74 -48.83 69.27 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.126 179.053 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.0 m -59.37 -43.11 92.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.054 179.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.414 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 24.8 m-70 -59.57 -48.7 80.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.969 179.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.685 HD12 ' HA ' ' A' ' 53' ' ' LYS . 16.3 mt -56.63 -48.08 81.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.903 179.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.67 -63.29 1.2 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.42 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.5 mtmt -61.04 -45.91 92.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.235 -179.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 118.36 20.48 4.32 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.702 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 40.6 p -97.57 -10.07 25.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.568 0.223 . . . . 0.0 111.059 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.937 HD21 HD13 ' A' ' 91' ' ' LEU . 2.4 tm? -58.52 -24.21 60.01 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.795 0.331 . . . . 0.0 110.176 179.406 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.61 ' CA ' HD13 ' A' ' 88' ' ' LEU . . . -87.38 16.58 48.22 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.94 -0.647 . . . . 0.0 112.281 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.34 -46.1 6.86 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.874 0.369 . . . . 0.0 111.2 -179.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -45.45 143.87 1.69 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.27 -179.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.593 ' O ' HD12 ' A' ' 69' ' ' LEU . 40.8 p -74.87 -172.38 1.58 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.748 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.51 HG22 ' N ' ' A' ' 84' ' ' LYS . 85.4 t -75.85 -44.46 3.96 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.206 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.506 ' CD ' ' N ' ' A' ' 66' ' ' VAL . 36.3 Cg_exo -60.86 -38.46 69.82 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.264 1.976 . . . . 0.0 112.15 179.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -80.03 -31.41 39.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.799 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.961 HD21 HD23 ' A' ' 88' ' ' LEU . 5.7 mt -60.97 -43.83 98.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.003 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.7 -39.46 51.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.099 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -56.13 -52.66 63.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.144 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.798 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.09 -49.42 75.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.861 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.79 -36.13 76.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.518 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -37.69 86.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.545 179.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -80.9 -30.03 35.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.894 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.606 ' CE1' HD12 ' A' ' 52' ' ' LEU . 2.7 m-85 -83.63 -22.25 32.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.023 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.19 21.02 53.78 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.523 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.606 HD23 ' HB3' ' A' ' 76' ' ' TYR . 3.4 mm? -81.49 169.94 16.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.839 0.352 . . . . 0.0 111.014 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.13 -38.06 9.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.613 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.668 ' OG ' HD23 ' A' ' 87' ' ' LEU . 0.3 OUTLIER 46.21 -166.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.425 179.764 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -152.38 -118.47 0.76 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.743 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -159.3 72.79 0.56 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.935 0.398 . . . . 0.0 110.801 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.405 ' O ' ' HB3' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -156.03 11.43 0.29 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.695 -179.549 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.51 ' N ' HG22 ' A' ' 66' ' ' VAL . 54.4 tttt 67.43 -83.87 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.797 -179.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.856 ' HA ' HD12 ' A' ' 88' ' ' LEU . 16.1 tt0 -45.34 -40.89 8.3 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.786 0.327 . . . . 0.0 111.108 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.441 ' HA ' ' HG2' ' A' ' 89' ' ' GLU . 1.7 tp10 -57.83 -46.71 84.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.652 179.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.939 ' HB2' HD13 ' A' ' 69' ' ' LEU . 0.8 OUTLIER -62.87 -46.64 86.93 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 178.571 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.961 HD23 HD21 ' A' ' 69' ' ' LEU . 24.9 mt -53.51 -56.63 15.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.519 179.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.441 ' HG2' ' HA ' ' A' ' 86' ' ' GLU . 11.1 pt-20 -55.89 -44.42 78.18 Favored 'General case' 0 CA--C 1.523 -0.08 0 CA-C-O 120.831 0.348 . . . . 0.0 110.375 179.274 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -52.3 -42.08 63.47 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 121.037 0.446 . . . . 0.0 110.237 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.937 HD13 HD21 ' A' ' 61' ' ' LEU . 1.6 mt -64.86 -62.98 1.24 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.655 179.346 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.52 HG23 HG23 ' A' ' 56' ' ' ILE . 49.7 m -47.47 -53.43 14.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.483 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.76 -36.55 16.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.976 178.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.529 ' ND1' HD21 ' A' ' 78' ' ' LEU . 33.4 t60 -73.26 -8.28 55.15 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.738 -179.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . 0.459 ' CD1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.36 33.47 0.88 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.818 0.342 . . . . 0.0 110.803 -179.912 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.886 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.531 ' CD1' HD21 ' A' ' 52' ' ' LEU . 11.9 m-85 . . . . . 0 C--O 1.231 0.094 0 CA-C-O 121.015 0.436 . . . . 0.0 110.465 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.477 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 58.5 p -73.44 -53.78 9.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.615 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.762 ' HA ' HD12 ' A' ' 52' ' ' LEU . 2.5 pt-20 167.54 -39.07 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.123 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.01 -57.6 11.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.241 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.454 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.5 tp10 -59.15 -40.51 85.79 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 179.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.762 HD12 ' HA ' ' A' ' 49' ' ' GLU . 30.7 mt -59.7 -51.78 68.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.236 178.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.838 ' HA ' HD12 ' A' ' 56' ' ' ILE . 37.8 tttm -53.56 -48.26 69.29 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.1 0.476 . . . . 0.0 109.835 178.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 78.4 m -56.55 -42.12 78.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.556 178.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.454 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 7.4 m-70 -60.49 -49.65 76.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.573 178.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.838 HD12 ' HA ' ' A' ' 53' ' ' LYS . 8.6 mt -57.45 -49.31 80.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.159 179.323 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.49 -70.8 0.08 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.544 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 74.6 mttt -61.01 -77.12 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.135 -179.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 151.94 35.72 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.777 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.9 p -100.89 -13.65 18.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.715 0.293 . . . . 0.0 110.93 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.446 HD11 HD22 ' A' ' 91' ' ' LEU . 14.8 tp -58.71 -26.82 64.28 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.92 0.391 . . . . 0.0 110.47 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.721 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -87.21 5.32 85.33 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.512 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -91.03 -54.46 3.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.983 0.42 . . . . 0.0 110.185 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -48.82 148.91 1.98 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.188 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.8 p -73.35 -166.02 0.3 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.96 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.551 HG22 ' HB3' ' A' ' 84' ' ' LYS . 52.4 t -75.5 -57.34 1.64 Allowed Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.056 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.512 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 4.4 Cg_endo -47.37 -27.87 7.63 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.247 1.965 . . . . 0.0 111.869 179.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -79.24 -50.16 11.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.842 179.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.792 ' CB ' HD13 ' A' ' 87' ' ' LEU . 14.4 mt -61.5 -39.04 89.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.163 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -52.25 -44.47 64.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.989 179.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -53.76 -52.11 61.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.946 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.658 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.99 -43.09 86.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.643 179.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -40.26 88.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.641 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.12 -35.58 79.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.795 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.08 -32.63 44.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.202 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -84.92 -28.85 25.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.2 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.83 33.81 50.04 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.53 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.452 HD13 ' HB1' ' A' ' 90' ' ' ALA . 0.9 OUTLIER -82.39 178.16 8.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.833 0.349 . . . . 0.0 111.286 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -102.34 76.74 1.59 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.004 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.424 ' HB3' HD23 ' A' ' 87' ' ' LEU . 24.1 t -161.35 -163.06 0.95 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.749 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.764 ' HA2' HD21 ' A' ' 87' ' ' LEU . . . 134.8 -32.1 2.64 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.729 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mt -80.6 -73.18 0.38 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.973 0.416 . . . . 0.0 111.284 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.2 mtmm -80.45 110.16 15.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.575 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.739 ' HA ' HD12 ' A' ' 87' ' ' LEU . 10.0 ptmm? -47.06 -52.92 13.85 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.907 179.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -49.12 -37.67 22.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.134 0.492 . . . . 0.0 110.054 179.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -70.54 -33.16 70.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.932 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.792 HD13 ' CB ' ' A' ' 69' ' ' LEU . 62.5 mt -61.8 -43.48 98.76 Favored 'General case' 0 CA--C 1.52 -0.18 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.721 HD21 ' CA ' ' A' ' 62' ' ' GLY . 3.7 mp -52.93 -60.39 3.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.28 178.473 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -48.72 -47.53 41.15 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.645 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.452 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -53.62 -46.31 70.41 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.059 0.457 . . . . 0.0 110.286 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.729 HD12 ' O ' ' A' ' 87' ' ' LEU . 0.8 OUTLIER -67.15 -56.13 11.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.44 179.055 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.667 ' OG1' HG23 ' A' ' 56' ' ' ILE . 1.0 OUTLIER -50.04 -56.96 8.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.555 179.886 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.443 ' HG2' ' HA ' ' A' ' 90' ' ' ALA . 0.0 OUTLIER -50.05 -28.29 6.85 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.161 179.537 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.414 ' N ' ' HG3' ' A' ' 93' ' ' LYS . 3.0 t60 -89.86 5.35 46.61 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.818 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . 0.555 ' CZ ' ' HD2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -146.14 11.31 1.18 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 121.02 -0.272 . . . . 0.0 111.442 179.973 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.333 -0.145 0 CA-C-O 120.804 0.335 . . . . 0.0 110.881 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.657 ' HB3' HD21 ' A' ' 52' ' ' LEU . 68.9 m-85 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 121.091 0.472 . . . . 0.0 110.792 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.517 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 35.6 p -74.12 -55.15 6.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.462 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.846 ' HA ' HD12 ' A' ' 52' ' ' LEU . 10.8 pt-20 170.25 -40.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.114 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -55.78 -55.24 34.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.962 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.464 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.9 tt0 -59.88 -41.6 91.95 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.152 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.846 HD12 ' HA ' ' A' ' 49' ' ' GLU . 30.4 mt -58.54 -53.42 58.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.205 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.501 ' HG2' ' CE2' ' A' ' 95' ' ' PHE . 0.8 OUTLIER -53.1 -47.56 68.48 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.068 0.461 . . . . 0.0 109.888 179.105 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.0 m -58.7 -44.76 90.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.615 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.464 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 12.8 m-70 -59.26 -50.82 72.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.815 178.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.572 HG13 HD22 ' A' ' 61' ' ' LEU . 40.9 mt -57.18 -46.26 84.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.98 179.256 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.5 m -52.45 -73.91 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.511 -179.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp -61.35 -69.01 0.26 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.956 -179.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 143.44 37.29 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.658 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 19.3 p -100.92 -13.69 18.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.545 0.212 . . . . 0.0 111.015 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.822 ' C ' HD11 ' A' ' 88' ' ' LEU . 14.5 tp -59.07 -32.06 69.44 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.009 0.433 . . . . 0.0 110.236 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.54 ' N ' HD11 ' A' ' 88' ' ' LEU . . . -80.16 6.15 60.81 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.73 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.31 -50.29 6.21 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 120.927 0.394 . . . . 0.0 110.403 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -49.11 149.22 2.06 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.348 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 31.5 p -73.71 -162.86 0.14 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.663 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.489 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 24.6 t -75.67 -59.17 1.26 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.884 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 5.4 Cg_endo -47.48 -29.39 10.11 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.275 1.984 . . . . 0.0 111.877 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -79.69 -44.84 20.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.89 179.183 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.805 HD13 ' HB2' ' A' ' 87' ' ' LEU . 15.9 mt -61.32 -48.87 79.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.129 179.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.555 ' CD ' HD21 ' A' ' 87' ' ' LEU . 20.6 mmmt -52.64 -34.11 49.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.298 179.053 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -56.3 -55.84 28.39 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.855 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.64 ' CB ' HD21 ' A' ' 91' ' ' LEU . . . -57.63 -45.55 85.27 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.994 0.426 . . . . 0.0 110.317 179.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 91.3 m -60.59 -43.12 97.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.239 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -35.08 78.36 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.546 179.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.19 -37.93 72.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.741 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -83.88 -23.28 31.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.132 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.3 24.21 29.62 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.341 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.4 mt -81.17 -174.27 4.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.788 0.327 . . . . 0.0 110.989 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.16 71.3 1.39 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.063 0.459 . . . . 0.0 110.505 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.693 ' CB ' HD23 ' A' ' 87' ' ' LEU . 3.0 m -76.52 -170.9 1.65 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.024 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.854 ' C ' HD22 ' A' ' 82' ' ' LEU . . . -116.69 -129.04 4.26 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.691 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.854 HD22 ' C ' ' A' ' 81' ' ' GLY . 2.5 mm? -147.03 9.8 0.99 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.498 0.189 . . . . 0.0 111.143 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.5 tptm -84.04 6.0 23.78 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.599 0.238 . . . . 0.0 111.23 179.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.7 mtmm 72.13 -78.34 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.518 -179.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -51.1 -32.15 21.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.901 0.381 . . . . 0.0 111.008 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -64.16 -40.03 95.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.919 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.805 ' HB2' HD13 ' A' ' 69' ' ' LEU . 1.2 mt -61.11 -42.78 99.16 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 179.314 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.822 HD11 ' C ' ' A' ' 61' ' ' LEU . 4.5 mm? -50.72 -53.65 29.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.502 179.006 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -50.85 -53.23 34.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.872 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -53.24 -43.29 67.2 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.133 0.492 . . . . 0.0 110.261 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.64 HD21 ' CB ' ' A' ' 72' ' ' ALA . 0.6 OUTLIER -66.11 -58.11 6.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.264 179.143 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.426 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.9 m -50.74 -59.13 4.41 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.018 179.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.4 tptm -47.63 -31.51 4.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.235 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -75.33 -44.19 46.65 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.367 -179.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . 0.501 ' CE2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -92.81 3.68 55.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.623 -179.641 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' A' ' 92' ' ' THR . 1.4 tp-100 . . . . . 0 C--N 1.332 -0.181 0 CA-C-O 120.788 0.328 . . . . 0.0 110.726 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 . . . . . 0 N--CA 1.453 -0.295 0 CA-C-O 121.253 0.549 . . . . 0.0 110.251 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.8 p -163.61 -33.11 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.218 -179.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.636 ' HA ' HD12 ' A' ' 52' ' ' LEU . 0.0 OUTLIER 169.07 -56.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.287 179.576 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.0 -53.79 44.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.695 0.284 . . . . 0.0 110.835 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.418 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.1 tp10 -61.11 -40.77 95.02 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.886 HD22 ' CD2' ' A' ' 91' ' ' LEU . 45.2 mt -59.7 -52.33 65.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.182 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.49 ' HG2' ' CZ ' ' A' ' 95' ' ' PHE . 1.2 mmtp -52.76 -47.97 67.11 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.016 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.8 m -57.23 -45.7 83.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.271 178.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.418 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 12.9 m-70 -60.94 -52.93 62.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.828 178.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 24.7 mt -57.75 -38.45 65.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.057 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.4 t -52.31 -75.21 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.408 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -61.52 -70.48 0.19 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.946 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 150.53 34.93 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.774 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.8 p -101.96 -15.07 16.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.742 0.306 . . . . 0.0 111.022 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.854 HD13 ' O ' ' A' ' 61' ' ' LEU . 2.8 tm? -58.57 -26.72 63.9 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.895 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.454 ' HA2' HD21 ' A' ' 88' ' ' LEU . . . -93.09 2.56 71.95 Favored Glycine 0 C--N 1.33 0.242 0 C-N-CA 120.766 -0.731 . . . . 0.0 113.034 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.5 mtmm -91.87 -38.67 12.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.929 0.395 . . . . 0.0 110.586 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.44 ' CE2' ' HA ' ' A' ' 61' ' ' LEU . 28.6 m-85 -47.08 152.66 0.52 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.511 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.64 -171.56 1.06 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.014 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.496 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 69.2 t -75.83 -58.25 1.38 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.696 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 9.3 Cg_endo -52.31 -28.32 34.17 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.047 1.831 . . . . 0.0 111.489 179.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.7 mtm -79.57 -45.94 18.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.9 179.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.896 ' CB ' HD13 ' A' ' 87' ' ' LEU . 27.2 mt -61.67 -44.05 97.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.346 179.175 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.71 -36.38 46.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.732 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -55.51 -53.1 60.52 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.637 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.688 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -58.05 -44.92 87.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.575 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.474 ' SG ' HD23 ' A' ' 87' ' ' LEU . 1.7 m -58.83 -40.69 84.96 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.935 179.336 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.79 -36.53 83.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.191 179.127 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.68 -32.56 65.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.642 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.483 ' CE2' HD13 ' A' ' 52' ' ' LEU . 1.5 m-85 -82.92 -34.21 26.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.773 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 97.61 15.63 36.73 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.584 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.039 HD13 ' HB1' ' A' ' 90' ' ' ALA . 0.9 OUTLIER -81.41 159.83 24.2 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.794 0.331 . . . . 0.0 110.891 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.49 28.19 6.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.161 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.75 -173.38 3.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.874 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.476 ' HA2' HD21 ' A' ' 87' ' ' LEU . . . 117.0 -145.67 18.73 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.767 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 81' ' ' GLY . 5.2 mt 68.3 -67.77 0.19 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.022 0.439 . . . . 0.0 110.847 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -83.73 -95.63 0.06 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.909 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.44 -61.34 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.9 0.381 . . . . 0.0 109.995 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.437 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.2 OUTLIER -55.13 -46.61 75.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.702 179.128 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -44.13 -35.85 2.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.073 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.896 HD13 ' CB ' ' A' ' 69' ' ' LEU . 15.9 mt -63.04 -43.93 97.32 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.454 HD21 ' HA2' ' A' ' 62' ' ' GLY . 1.8 mp -51.76 -55.4 19.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.161 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.54 -52.13 41.58 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.817 179.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 1.039 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.68 -42.7 65.0 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 121.188 0.518 . . . . 0.0 110.055 179.273 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.886 ' CD2' HD22 ' A' ' 52' ' ' LEU . 0.4 OUTLIER -67.19 -60.32 2.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.48 178.996 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.1 m -50.03 -54.95 16.82 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.273 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 30.6 mttm -49.61 -33.06 14.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.035 179.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.481 ' CE1' ' CD1' ' A' ' 76' ' ' TYR . 2.1 t-160 -83.89 1.1 44.92 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.676 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . 0.49 ' CZ ' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.75 22.4 1.0 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.749 0.309 . . . . 0.0 111.05 179.751 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.331 -0.201 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.891 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.732 ' HB3' HD21 ' A' ' 52' ' ' LEU . 30.2 m-85 . . . . . 0 C--O 1.231 0.107 0 CA-C-O 121.046 0.451 . . . . 0.0 111.031 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 90.5 p -74.02 -52.65 12.07 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.661 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.5 ' HA ' HD12 ' A' ' 52' ' ' LEU . 3.4 mt-10 164.31 -36.45 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.348 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -60.16 3.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.258 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.472 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.2 OUTLIER -58.72 -40.48 83.85 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.402 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.732 HD21 ' HB3' ' A' ' 47' ' ' TYR . 68.1 mt -59.47 -51.89 67.96 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.247 178.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.46 ' HG2' ' CD2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.5 -48.09 69.27 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.152 0.501 . . . . 0.0 109.872 179.115 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.2 m -57.8 -42.24 83.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.708 178.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.472 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 8.4 m-70 -60.07 -48.94 79.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.916 178.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 55.6 mt -57.24 -47.72 83.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.143 179.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -53.08 -73.76 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.542 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.83 -70.81 0.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.279 -179.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 144.34 36.18 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.868 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.573 HG22 ' HD2' ' A' ' 63' ' ' LYS . 0.6 OUTLIER -99.88 -10.49 21.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.705 0.288 . . . . 0.0 110.898 179.583 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.83 HD11 HD22 ' A' ' 91' ' ' LEU . 28.8 tp -59.05 -21.27 58.85 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.829 0.347 . . . . 0.0 110.507 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.742 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -90.77 16.86 57.23 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.435 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.573 ' HD2' HG22 ' A' ' 60' ' ' THR . 10.8 mtpt -89.66 -47.25 8.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.008 0.433 . . . . 0.0 110.356 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.404 ' HB2' ' HG ' ' A' ' 69' ' ' LEU . 73.1 m-85 -48.17 153.41 0.7 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.489 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.592 ' O ' HG23 ' A' ' 66' ' ' VAL . 55.0 m -74.94 -81.62 0.07 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.602 -179.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.592 HG23 ' O ' ' A' ' 65' ' ' THR . 3.8 t -160.42 -64.84 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.131 -178.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.499 ' CD ' ' HB ' ' A' ' 66' ' ' VAL . 10.2 Cg_endo -50.63 -26.11 16.29 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.264 1.976 . . . . 0.0 110.912 178.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.7 mtm -78.6 -43.2 26.98 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.535 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.604 ' HB2' HD13 ' A' ' 87' ' ' LEU . 19.8 mt -62.63 -44.34 96.54 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.457 179.06 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.3 mmtt -51.3 -34.56 33.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.656 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.446 ' HB3' ' CD2' ' A' ' 47' ' ' TYR . 2.3 tp10 -55.8 -55.44 32.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.799 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.94 88.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.96 0.41 . . . . 0.0 110.36 179.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 80.5 m -60.4 -40.94 92.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.248 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.6 ttm-85 -61.69 -36.9 82.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.133 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.43 -28.52 56.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.541 179.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.445 ' CE1' ' HG3' ' A' ' 49' ' ' GLU . 3.3 m-85 -83.02 -32.6 26.81 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.705 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.67 16.71 59.58 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.62 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.504 HD13 ' O ' ' A' ' 90' ' ' ALA . 4.0 mt -81.85 -165.61 1.02 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.877 0.37 . . . . 0.0 111.115 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -133.96 74.98 1.57 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.321 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.462 ' HG ' HD23 ' A' ' 87' ' ' LEU . 4.3 p -74.54 -176.44 2.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.288 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -113.18 165.52 12.05 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.842 -179.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -81.83 1.38 35.12 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.07 -75.54 0.24 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.721 0.296 . . . . 0.0 110.686 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.665 ' HA ' HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER 166.82 -71.41 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.593 179.531 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.533 ' HA ' HD13 ' A' ' 88' ' ' LEU . 5.7 tp60 -51.06 -30.76 16.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.852 0.358 . . . . 0.0 111.106 179.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -58.92 -39.68 82.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.746 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.665 HD12 ' HA ' ' A' ' 84' ' ' LYS . 1.1 mt -61.58 -43.94 97.94 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.742 HD21 ' CA ' ' A' ' 62' ' ' GLY . 4.0 mp -51.78 -53.91 34.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.134 178.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -50.23 -53.15 30.2 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.867 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.504 ' O ' HD13 ' A' ' 78' ' ' LEU . . . -51.89 -44.01 63.58 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.145 0.498 . . . . 0.0 110.341 179.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.83 HD22 HD11 ' A' ' 61' ' ' LEU . 0.5 OUTLIER -67.39 -57.15 7.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.352 178.981 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.2 m -50.46 -56.64 10.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.544 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -49.52 -31.06 9.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.052 179.374 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 19.1 t60 -75.76 -9.28 58.46 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.655 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . 0.46 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.21 29.98 0.95 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.862 0.363 . . . . 0.0 110.955 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.807 179.764 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.899 ' HB3' HD21 ' A' ' 52' ' ' LEU . 15.7 m-85 . . . . . 0 C--O 1.232 0.134 0 CA-C-O 121.09 0.471 . . . . 0.0 110.899 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.12 -46.74 40.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.719 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.849 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.5 tt0 166.91 -43.02 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.386 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.1 -55.97 25.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.016 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.457 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 3.5 tt0 -59.72 -40.89 89.51 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.905 HD22 ' CD2' ' A' ' 91' ' ' LEU . 26.8 mt -59.24 -52.81 64.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.245 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.706 ' O ' HG22 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -53.89 -46.38 71.38 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 121.256 0.551 . . . . 0.0 110.126 179.2 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.9 m -59.48 -43.53 93.26 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.457 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 11.1 m-70 -60.49 -51.65 68.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.99 178.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.706 HG22 ' O ' ' A' ' 53' ' ' LYS . 8.8 tt -58.54 -44.85 90.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-O 120.841 0.353 . . . . 0.0 110.617 179.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.2 m -56.59 -63.48 1.18 Allowed 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.869 179.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.403 ' N ' ' CD ' ' A' ' 58' ' ' LYS . 8.9 mptt -62.19 -50.52 71.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.953 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.8 23.63 4.59 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.495 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 38.2 p -101.07 1.08 39.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.498 0.19 . . . . 0.0 111.512 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.609 HD23 HD23 ' A' ' 88' ' ' LEU . 47.5 tp -59.63 -26.85 65.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.778 0.323 . . . . 0.0 110.923 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.684 ' HA3' HD11 ' A' ' 88' ' ' LEU . . . -92.87 12.89 68.92 Favored Glycine 0 CA--C 1.518 0.267 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.738 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -91.67 -51.55 5.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.851 0.358 . . . . 0.0 110.676 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -46.78 158.11 0.13 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.166 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 26.4 p -72.84 -167.83 0.41 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.886 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.873 HG12 ' HD3' ' A' ' 70' ' ' LYS . 55.9 t -76.76 -59.58 0.95 Allowed Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.209 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.522 ' HA ' ' CD ' ' A' ' 70' ' ' LYS . 3.8 Cg_endo -46.42 -29.68 7.42 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.526 2.151 . . . . 0.0 112.144 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 29.4 mtm -79.2 -44.72 21.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.167 0.508 . . . . 0.0 109.993 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.718 ' HB2' HD13 ' A' ' 87' ' ' LEU . 29.6 mt -64.73 -55.64 18.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.071 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.873 ' HD3' HG12 ' A' ' 66' ' ' VAL . 0.0 OUTLIER -51.19 -27.3 8.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.748 0.309 . . . . 0.0 110.784 179.865 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -57.53 -53.05 62.54 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.586 179.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.682 ' CB ' HD21 ' A' ' 91' ' ' LEU . . . -59.01 -48.32 82.0 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.986 0.422 . . . . 0.0 110.357 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.403 ' CB ' ' HB2' ' A' ' 78' ' ' LEU . 90.8 m -61.33 -40.73 95.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.666 179.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -61.77 -36.22 80.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.675 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.19 -44.87 64.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.611 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -88.71 10.02 22.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.574 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.37 44.67 76.56 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.86 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.696 HD12 ' HB1' ' A' ' 90' ' ' ALA . 3.6 mm? -81.33 -177.95 6.71 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.827 0.346 . . . . 0.0 110.919 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.44 -43.87 7.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.826 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.678 ' HB2' HD23 ' A' ' 87' ' ' LEU . 8.2 p 45.99 -164.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.367 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.42 ' N ' ' HB3' ' A' ' 86' ' ' GLU . . . -137.88 -108.71 0.86 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.727 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -160.49 -31.35 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -65.96 0.88 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.689 0.281 . . . . 0.0 111.205 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.821 ' HA ' HD12 ' A' ' 87' ' ' LEU . 0.8 OUTLIER 173.36 -64.57 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.102 179.99 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.543 ' HA ' HD12 ' A' ' 88' ' ' LEU . 29.8 tt0 -46.9 -34.89 5.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.876 0.37 . . . . 0.0 111.189 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.42 ' HB3' ' N ' ' A' ' 81' ' ' GLY . 3.7 mm-40 -59.91 -44.57 94.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.565 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.821 HD12 ' HA ' ' A' ' 84' ' ' LYS . 1.3 mt -61.78 -43.04 99.64 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.684 HD11 ' HA3' ' A' ' 62' ' ' GLY . 3.8 mt -50.64 -50.99 53.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.425 178.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -51.05 -54.61 23.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.105 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.696 ' HB1' HD12 ' A' ' 78' ' ' LEU . . . -55.12 -43.4 74.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.95 0.405 . . . . 0.0 110.909 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.905 ' CD2' HD22 ' A' ' 52' ' ' LEU . 0.8 OUTLIER -69.12 -49.02 60.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.498 179.438 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.574 HG22 ' N ' ' A' ' 93' ' ' LYS . 0.7 OUTLIER -52.4 -61.32 2.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.711 -179.988 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.654 ' HD2' HD11 ' A' ' 78' ' ' LEU . 0.0 OUTLIER -48.87 -28.38 3.72 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.731 0.301 . . . . 0.0 111.058 179.557 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 -72.89 -23.6 60.74 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.262 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . 0.506 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.06 45.13 1.08 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.889 0.376 . . . . 0.0 111.014 -179.856 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.466 ' HB2' HD11 ' A' ' 56' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.937 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.406 ' HB3' HD21 ' A' ' 52' ' ' LEU . 24.8 m-85 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.987 0.422 . . . . 0.0 111.128 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.508 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 91.2 p -72.28 -52.83 14.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.283 179.642 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.852 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.8 pt-20 165.4 -34.68 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.009 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -60.13 4.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.062 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.441 ' HG3' ' CE1' ' A' ' 55' ' ' HIS . 0.1 OUTLIER -59.23 -39.75 83.71 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.251 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.852 HD12 ' HA ' ' A' ' 49' ' ' GLU . 22.3 mt -60.21 -51.56 69.07 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.155 178.767 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.493 ' HA ' HD12 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -53.72 -48.39 69.65 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.86 179.045 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.1 m -57.89 -45.09 86.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.605 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.443 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 14.8 m-70 -59.56 -51.01 71.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.808 178.83 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.493 HD12 ' HA ' ' A' ' 53' ' ' LYS . 20.3 mt -56.84 -45.12 83.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.844 179.325 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.4 m -52.94 -70.74 0.08 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.352 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.6 mttp -61.56 -79.75 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.029 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 157.49 33.26 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.885 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 17.0 p -102.77 -12.46 17.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.734 0.302 . . . . 0.0 111.037 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.857 HD13 ' O ' ' A' ' 61' ' ' LEU . 3.1 tm? -59.65 -27.09 66.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.802 0.334 . . . . 0.0 110.81 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.499 ' HA2' HD21 ' A' ' 88' ' ' LEU . . . -90.22 11.13 71.98 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.755 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.74 -47.01 7.59 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.879 0.371 . . . . 0.0 110.557 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -47.43 146.6 1.99 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.388 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.57 ' O ' HD12 ' A' ' 69' ' ' LEU . 32.6 p -73.71 -169.84 0.77 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.118 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.563 HG22 ' CA ' ' A' ' 84' ' ' LYS . 78.8 t -76.4 -56.24 1.54 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.507 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.534 ' HA ' ' CD ' ' A' ' 70' ' ' LYS . 5.5 Cg_endo -48.29 -35.94 28.53 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.341 2.027 . . . . 0.0 112.233 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 26.9 mtp -81.69 -34.34 30.72 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.78 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.877 ' CB ' HD13 ' A' ' 87' ' ' LEU . 7.5 mt -63.04 -52.89 61.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.572 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.534 ' CD ' ' HA ' ' A' ' 67' ' ' PRO . 0.5 OUTLIER -49.45 -29.87 7.22 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.868 0.366 . . . . 0.0 111.026 -179.663 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.418 ' N ' ' HG2' ' A' ' 70' ' ' LYS . 2.0 tt0 -57.32 -55.34 36.08 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.357 179.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.426 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -58.91 -40.2 83.81 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.29 179.139 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.723 ' SG ' HD23 ' A' ' 87' ' ' LEU . 7.7 m -60.12 -40.58 90.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.391 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.94 -36.43 81.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.466 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.87 -32.74 59.84 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.63 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.499 ' CD2' ' CG ' ' A' ' 94' ' ' HIS . 3.2 m-30 -84.17 -23.91 30.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.971 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 82.36 23.76 55.87 Favored Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.492 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' A' ' 73' ' ' CYS . 1.4 mt -81.81 170.48 15.65 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.922 0.392 . . . . 0.0 111.155 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -111.47 81.16 1.4 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.76 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -159.5 -171.22 3.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.084 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.62 ' HA2' HD21 ' A' ' 87' ' ' LEU . . . 109.38 48.54 0.8 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.667 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -158.51 19.24 0.22 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.586 0.232 . . . . 0.0 111.576 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.432 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -159.15 6.49 0.1 Allowed 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -179.915 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.563 ' CA ' HG22 ' A' ' 66' ' ' VAL . 16.5 ttpp 69.13 -82.4 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.604 0.24 . . . . 0.0 110.895 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.673 ' HA ' HD22 ' A' ' 88' ' ' LEU . 34.1 tt0 -49.04 -45.38 42.65 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.897 0.379 . . . . 0.0 111.249 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.432 ' HB2' ' HB3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -47.28 -39.38 14.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.902 179.978 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.877 HD13 ' CB ' ' A' ' 69' ' ' LEU . 1.7 mt -62.57 -43.93 97.58 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.27 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.673 HD22 ' HA ' ' A' ' 85' ' ' GLN . 1.2 mp -51.97 -53.55 40.09 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.139 178.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -50.79 -52.97 35.83 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.812 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.48 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.85 -43.83 66.34 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.02 0.438 . . . . 0.0 110.496 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.724 HD13 HD11 ' A' ' 61' ' ' LEU . 0.7 OUTLIER -66.29 -54.87 19.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.425 179.341 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.419 HG22 ' N ' ' A' ' 93' ' ' LYS . 0.9 OUTLIER -50.58 -59.41 4.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.373 179.802 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.419 ' N ' HG22 ' A' ' 92' ' ' THR . 1.5 ptmm? -48.24 -31.2 5.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.214 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.499 ' CG ' ' CD2' ' A' ' 76' ' ' TYR . 51.3 t-80 -74.26 -17.9 60.8 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.712 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . 0.484 ' CD1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -146.87 38.04 0.99 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.945 0.402 . . . . 0.0 110.855 -179.831 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.401 ' NE2' ' CG2' ' A' ' 92' ' ' THR . 1.7 tt0 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.876 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.454 ' HB3' HD21 ' A' ' 52' ' ' LEU . 28.0 m-85 . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.988 0.423 . . . . 0.0 110.718 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.405 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 1.1 p -72.05 -42.83 65.81 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.637 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.866 ' HA ' HD12 ' A' ' 52' ' ' LEU . 3.4 mt-10 163.79 -43.94 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.536 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.0 -56.28 21.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.173 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.455 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.0 OUTLIER -60.02 -40.33 88.94 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.327 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.866 HD12 ' HA ' ' A' ' 49' ' ' GLU . 19.8 mt -59.9 -51.73 68.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.247 178.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.877 ' HA ' HD12 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -54.07 -47.84 71.25 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-O 121.073 0.463 . . . . 0.0 109.938 179.071 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.5 m -57.81 -42.61 84.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.685 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.455 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 11.7 m-70 -59.61 -49.29 78.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.829 178.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.877 HD12 ' HA ' ' A' ' 53' ' ' LYS . 6.9 mt -57.36 -48.36 82.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.988 179.313 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 2.4 m -53.78 -63.54 1.12 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.54 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 30.4 mttm -60.85 -46.45 90.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.254 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 116.98 20.78 4.76 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.692 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 21.8 p -97.87 -8.44 28.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.613 0.244 . . . . 0.0 111.047 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.729 ' O ' HD22 ' A' ' 88' ' ' LEU . 3.4 tm? -58.87 -29.37 66.94 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.654 0.264 . . . . 0.0 110.378 179.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.575 ' HA2' HD22 ' A' ' 88' ' ' LEU . . . -85.0 10.67 62.29 Favored Glycine 0 CA--C 1.52 0.387 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.536 179.52 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -95.48 -40.71 9.33 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.781 0.324 . . . . 0.0 111.641 -179.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -44.74 144.74 1.06 Allowed 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -179.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.629 ' O ' HD12 ' A' ' 69' ' ' LEU . 15.8 p -74.24 -171.68 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.54 179.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.516 ' HB ' ' HD3' ' A' ' 67' ' ' PRO . 70.6 t -76.81 -46.23 3.0 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.65 -179.625 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.516 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 39.6 Cg_exo -60.42 -30.28 90.54 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.13 1.887 . . . . 0.0 111.952 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . 0.412 ' N ' ' HE3' ' A' ' 68' ' ' MET . 0.0 OUTLIER -81.45 -39.15 25.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.301 179.656 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.949 HD21 HD23 ' A' ' 88' ' ' LEU . 11.5 mt -61.01 -40.96 95.53 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.147 179.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -52.33 -42.0 63.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.949 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.39 -53.52 56.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.411 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.993 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -56.26 -50.36 71.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.942 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -59.58 -37.43 78.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.194 179.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -62.46 -37.74 87.08 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.161 179.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.88 -27.99 49.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.744 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -82.09 -37.94 25.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.939 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 100.75 18.19 21.29 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.923 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.48 HD13 ' HB1' ' A' ' 90' ' ' ALA . 21.0 mt -81.15 -166.71 1.21 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.696 0.284 . . . . 0.0 110.737 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.428 ' O ' ' O ' ' A' ' 80' ' ' SER . 0.2 OUTLIER -96.26 -43.85 7.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.774 179.813 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.428 ' O ' ' O ' ' A' ' 79' ' ' LYS . 0.0 OUTLIER 57.71 138.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.434 179.527 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.414 ' O ' ' HB2' ' A' ' 82' ' ' LEU . . . 147.17 -165.93 28.55 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.231 -0.985 . . . . 0.0 113.086 179.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.602 ' N ' HD12 ' A' ' 82' ' ' LEU . 4.7 mp 68.83 -67.4 0.21 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.961 0.41 . . . . 0.0 110.793 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.65 152.85 16.43 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.248 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.729 ' HA ' HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -44.37 -54.61 5.68 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.895 179.548 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.923 ' HA ' HD12 ' A' ' 88' ' ' LEU . 3.8 tt0 -46.19 -43.65 15.4 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.014 0.435 . . . . 0.0 110.3 179.238 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -60.91 -42.2 97.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.504 178.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.729 HD12 ' HA ' ' A' ' 84' ' ' LYS . 26.6 mt -62.72 -54.25 42.12 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 178.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.949 HD23 HD21 ' A' ' 69' ' ' LEU . 4.3 mt -53.44 -52.07 60.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.679 178.369 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.37 -49.21 70.36 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.572 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.48 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -51.83 -42.69 62.75 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 121.128 0.49 . . . . 0.0 110.01 179.303 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.993 HD21 ' HB1' ' A' ' 72' ' ' ALA . 0.4 OUTLIER -64.82 -62.46 1.55 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.247 178.887 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 18.0 m -49.55 -57.51 6.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.101 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -47.06 -30.8 2.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.138 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -65.83 -52.92 46.45 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.627 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . 0.486 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -90.91 -9.82 44.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.799 -179.386 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 C--N 1.33 -0.261 0 CA-C-O 120.863 0.363 . . . . 0.0 110.908 179.809 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.739 ' HB3' HD21 ' A' ' 52' ' ' LEU . 22.4 m-85 . . . . . 0 N--CA 1.457 -0.09 0 CA-C-O 120.998 0.428 . . . . 0.0 110.729 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.557 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 78.9 p -71.18 -55.54 7.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.424 179.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.64 ' HA ' HD12 ' A' ' 52' ' ' LEU . 4.6 pt-20 170.38 -37.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.446 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -57.46 -55.28 36.9 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.703 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.444 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 2.1 tt0 -61.35 -41.56 97.25 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.006 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.739 HD21 ' HB3' ' A' ' 47' ' ' TYR . 43.3 mt -59.65 -50.58 73.29 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.14 178.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.491 ' HG2' ' CD2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -52.58 -49.86 64.16 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.011 178.957 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 94.5 m -59.3 -42.42 91.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.012 179.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.444 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 12.5 m-70 -58.44 -50.04 75.13 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 36.8 mt -58.27 -56.86 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.514 178.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.9 p -67.36 46.59 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.117 179.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -175.6 -58.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.744 0.307 . . . . 0.0 111.019 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 125.25 24.2 1.65 Allowed Glycine 0 CA--C 1.518 0.257 0 C-N-CA 120.659 -0.782 . . . . 0.0 113.036 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.7 -11.92 20.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.599 0.238 . . . . 0.0 111.097 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.963 HD11 HD13 ' A' ' 91' ' ' LEU . 17.8 tp -58.81 -22.61 58.87 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.815 0.34 . . . . 0.0 110.602 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -91.05 19.37 46.62 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.343 179.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.41 -58.34 2.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.037 0.446 . . . . 0.0 110.214 179.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -49.54 152.32 1.4 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.397 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 22.4 p -74.14 -167.09 0.47 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.881 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.569 HG13 HD11 ' A' ' 87' ' ' LEU . 55.3 t -77.14 -57.42 1.12 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.276 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.508 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 6.2 Cg_endo -48.89 -31.42 19.95 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.358 2.039 . . . . 0.0 112.139 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 45.8 mtm -79.46 -39.54 31.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.249 179.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.781 HD13 ' HB2' ' A' ' 87' ' ' LEU . 8.8 mt -61.12 -39.69 90.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.631 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.74 -36.77 58.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.891 179.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -55.52 -52.49 63.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.925 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.828 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.58 -42.85 83.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.731 179.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.54 ' HA ' HD12 ' A' ' 78' ' ' LEU . 8.8 m -59.84 -38.91 83.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.681 179.664 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 mtt-85 -62.07 -36.33 81.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.671 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -81.14 -29.89 34.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.082 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CD2' ' CG ' ' A' ' 94' ' ' HIS . 2.8 m-30 -84.82 -25.64 27.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.105 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.59 21.73 49.88 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.592 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.54 HD12 ' HA ' ' A' ' 73' ' ' CYS . 2.8 mt -81.27 -175.93 5.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.866 0.365 . . . . 0.0 110.961 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.2 tmtt? -97.47 -40.35 8.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.029 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.547 ' HB2' HD23 ' A' ' 87' ' ' LEU . 0.0 OUTLIER 69.68 173.52 0.3 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.768 -179.987 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -138.23 -130.27 2.78 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.588 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 82' ' ' LEU . 12.3 mt -159.18 53.1 0.39 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.004 0.43 . . . . 0.0 110.744 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.15 10.16 0.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.803 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 75.03 -71.94 0.12 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.816 0.341 . . . . 0.0 110.755 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.401 ' HA ' ' HG ' ' A' ' 88' ' ' LEU . 0.5 OUTLIER -47.33 -34.81 7.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.405 179.947 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -62.04 -45.29 94.24 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.057 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.781 ' HB2' HD13 ' A' ' 69' ' ' LEU . 1.2 mt -60.96 -42.62 98.63 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.573 HD21 HD11 ' A' ' 69' ' ' LEU . 6.8 mt -52.61 -53.28 48.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.273 178.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.78 -52.47 40.54 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.799 179.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.417 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -53.12 -45.03 68.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.005 0.431 . . . . 0.0 110.52 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.963 HD13 HD11 ' A' ' 61' ' ' LEU . 3.1 mt -66.52 -53.8 30.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.347 179.202 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.45 HG22 ' N ' ' A' ' 93' ' ' LYS . 0.9 OUTLIER -51.5 -60.49 3.08 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.448 179.859 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.45 ' N ' HG22 ' A' ' 92' ' ' THR . 1.6 pttt -48.12 -28.96 3.21 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.801 0.334 . . . . 0.0 110.975 179.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.5 ' CG ' ' CD2' ' A' ' 76' ' ' TYR . 27.5 t-80 -67.54 -58.49 4.62 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.673 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . 0.491 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -95.82 22.4 7.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.256 179.887 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 C--N 1.331 -0.229 0 CA-C-O 120.809 0.338 . . . . 0.0 110.72 179.935 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.678 ' HB3' HD21 ' A' ' 52' ' ' LEU . 25.7 m-85 . . . . . 0 C--O 1.231 0.129 0 CA-C-O 121.017 0.436 . . . . 0.0 110.811 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.524 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 5.6 p -72.4 -53.13 13.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.356 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.871 ' HA ' HD12 ' A' ' 52' ' ' LEU . 2.8 pt-20 169.01 -35.03 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.207 179.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.52 -58.29 8.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.812 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.45 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -60.07 -41.59 92.74 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.208 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.871 HD12 ' HA ' ' A' ' 49' ' ' GLU . 14.0 mt -60.36 -49.52 77.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.013 178.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.626 ' HA ' HD12 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -53.29 -49.27 67.32 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.096 179.208 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.52 -44.76 89.65 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.553 179.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.45 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 8.1 m-70 -60.13 -51.12 70.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.815 178.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.626 HD12 ' HA ' ' A' ' 53' ' ' LYS . 8.7 mt -56.66 -45.49 82.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.939 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -53.61 -73.96 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.221 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 48.3 mttt -62.18 -75.56 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.078 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 149.77 37.71 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.738 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.2 p -100.89 -8.81 22.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.656 0.265 . . . . 0.0 111.066 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.42 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 16.1 tp -58.79 -23.77 60.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.812 0.339 . . . . 0.0 110.694 179.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.796 ' HA2' HD11 ' A' ' 88' ' ' LEU . . . -91.42 14.07 64.82 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.367 179.542 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.2 tttt -92.28 -55.81 3.28 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.934 0.397 . . . . 0.0 110.407 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -48.0 154.54 0.53 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.307 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.3 p -73.67 -167.32 0.45 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.929 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.579 HG22 ' HA ' ' A' ' 84' ' ' LYS . 56.0 t -77.03 -57.94 1.08 Allowed Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.256 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.504 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 5.2 Cg_endo -47.83 -30.25 12.9 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.34 2.026 . . . . 0.0 112.054 179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 33.1 mtm -80.33 -46.88 15.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.271 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.912 ' HB2' HD13 ' A' ' 87' ' ' LEU . 36.1 mt -61.14 -46.11 91.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.449 179.381 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.437 ' N ' HD22 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -51.95 -32.1 31.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.54 179.272 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.42 ' HB3' ' CD2' ' A' ' 47' ' ' TYR . 0.0 OUTLIER -56.76 -54.92 40.71 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.891 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.675 ' CB ' HD21 ' A' ' 91' ' ' LEU . . . -57.12 -46.9 82.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.974 0.416 . . . . 0.0 110.372 179.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 57.3 m -61.01 -44.06 97.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.338 179.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.1 mmt180 -63.15 -34.3 77.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.67 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.86 -38.08 73.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.846 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.503 ' CD1' ' CE1' ' A' ' 94' ' ' HIS . 4.5 m-85 -84.28 -28.63 27.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.035 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.94 26.57 11.33 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.605 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.485 HD23 ' HB3' ' A' ' 76' ' ' TYR . 4.4 mm? -81.09 176.41 9.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.793 0.33 . . . . 0.0 110.912 -179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.92 -33.07 11.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.799 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.566 ' HB2' HD23 ' A' ' 87' ' ' LEU . 3.9 p 48.33 -173.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.418 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -124.92 160.4 19.55 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.47 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 35.4 mt -80.85 -4.5 54.98 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -80.38 -73.55 0.36 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.677 0.275 . . . . 0.0 110.768 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.749 ' O ' HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER 167.84 -67.32 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.978 179.851 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.573 ' HA ' HD13 ' A' ' 88' ' ' LEU . 0.0 OUTLIER -54.5 -38.13 66.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.041 0.448 . . . . 0.0 110.681 179.76 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -45.13 -31.64 1.5 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.432 -179.065 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.912 HD13 ' HB2' ' A' ' 69' ' ' LEU . 2.3 mt -62.46 -40.72 97.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.099 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.796 HD11 ' HA2' ' A' ' 62' ' ' GLY . 5.1 mp -50.92 -53.64 30.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.38 178.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -49.74 -54.52 18.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.956 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.475 ' HB1' ' HG ' ' A' ' 78' ' ' LEU . . . -51.49 -44.54 62.52 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.199 0.524 . . . . 0.0 110.121 179.303 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.833 ' CD2' HD22 ' A' ' 52' ' ' LEU . 0.4 OUTLIER -66.75 -58.2 5.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.755 179.16 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.416 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.3 m -49.35 -53.95 19.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.298 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.92 -31.12 4.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.12 179.264 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.503 ' CE1' ' CD1' ' A' ' 76' ' ' TYR . 2.5 t60 -76.44 -16.55 59.66 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.704 -179.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . 0.474 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -146.78 36.12 0.95 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.819 0.343 . . . . 0.0 110.998 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.416 ' N ' ' O ' ' A' ' 92' ' ' THR . 2.8 pt20 . . . . . 0 CA--C 1.532 0.251 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.985 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.8 mtmt . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.696 0.284 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.76 HG23 ' HG2' ' A' ' 51' ' ' GLU . 14.4 p 41.39 38.31 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.697 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.83 3.52 14.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.823 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.584 ' HB3' HD21 ' A' ' 52' ' ' LEU . 27.6 m-85 70.81 44.45 0.62 Allowed 'General case' 0 C--O 1.231 0.13 0 CA-C-O 120.987 0.423 . . . . 0.0 110.811 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.415 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 0.7 OUTLIER -71.82 -42.13 67.38 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.336 179.502 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.861 ' HA ' HD12 ' A' ' 52' ' ' LEU . 0.4 OUTLIER 163.11 -42.84 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.367 179.84 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.2 -58.7 6.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.311 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.76 ' HG2' HG23 ' A' ' 45' ' ' VAL . 1.4 tp10 -58.88 -39.1 80.4 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.861 HD12 ' HA ' ' A' ' 49' ' ' GLU . 22.1 mt -60.2 -52.94 63.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.222 178.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.523 ' HG2' ' CE2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.56 -48.21 69.35 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-O 121.033 0.444 . . . . 0.0 109.952 179.168 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.7 m -59.39 -45.6 91.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.954 179.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.477 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 15.3 m-70 -59.59 -49.07 79.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.258 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.711 HG13 HD12 ' A' ' 61' ' ' LEU . 58.7 mt -55.29 -40.56 57.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.946 179.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.4 t -53.26 -77.01 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.347 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -49.28 77.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.29 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 118.67 31.84 1.42 Allowed Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.743 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.478 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 2.9 m -98.25 -6.23 31.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.587 0.232 . . . . 0.0 111.099 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.757 ' C ' HD11 ' A' ' 88' ' ' LEU . 0.6 OUTLIER -59.86 -22.46 62.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.874 0.369 . . . . 0.0 110.337 179.352 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.501 ' N ' HD11 ' A' ' 88' ' ' LEU . . . -90.77 22.44 28.17 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.846 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 60' ' ' THR . 0.2 OUTLIER -90.4 -54.87 3.82 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.107 0.48 . . . . 0.0 109.987 179.47 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -49.42 158.27 0.43 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.563 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.444 ' H ' ' HE3' ' A' ' 68' ' ' MET . 65.3 p -73.89 -168.0 0.55 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.624 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.853 HG22 ' HA ' ' A' ' 84' ' ' LYS . 47.4 t -77.35 -47.51 2.53 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.656 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.537 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 51.7 Cg_exo -52.15 -34.14 57.16 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.187 1.924 . . . . 0.0 111.88 179.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . 0.444 ' HE3' ' H ' ' A' ' 65' ' ' THR . 46.5 mtm -80.01 -40.48 27.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.497 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.57 ' HB2' HD13 ' A' ' 87' ' ' LEU . 9.6 mt -60.32 -41.52 93.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.491 179.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.93 -34.91 57.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.684 179.142 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.09 -54.86 39.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.966 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.836 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -56.94 -43.56 81.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.672 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 13.7 m -60.27 -41.26 92.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.442 179.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.85 -35.95 79.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.544 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.99 -30.29 50.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.817 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.429 ' CE1' ' HG3' ' A' ' 49' ' ' GLU . 2.7 m-85 -84.26 -29.11 26.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.006 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.77 24.02 47.47 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.573 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.414 HD13 ' HB1' ' A' ' 90' ' ' ALA . 2.9 mt -81.2 -170.79 2.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.796 0.331 . . . . 0.0 110.846 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -96.86 -37.58 10.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.881 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 68.23 176.58 0.26 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.857 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -137.37 146.22 18.07 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.483 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.2 mp -80.75 65.63 5.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.83 0.348 . . . . 0.0 111.015 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.561 ' O ' HG21 ' A' ' 66' ' ' VAL . 2.0 tptt -157.39 -73.38 0.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.029 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.853 ' HA ' HG22 ' A' ' 66' ' ' VAL . 35.8 tttm 168.9 -83.77 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.582 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -47.55 -31.77 4.72 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.159 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -52.37 -36.86 54.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.696 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.628 HD11 HG13 ' A' ' 66' ' ' VAL . 1.2 mt -62.39 -47.37 84.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.764 179.166 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.757 HD11 ' C ' ' A' ' 61' ' ' LEU . 4.3 mm? -51.2 -51.25 55.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.333 178.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.44 -53.2 39.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.816 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.414 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.91 -44.09 66.69 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.112 0.482 . . . . 0.0 110.117 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.836 HD21 ' HB1' ' A' ' 72' ' ' ALA . 2.0 mt -65.94 -57.3 8.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.696 179.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.1 m -49.76 -55.9 12.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.365 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.8 mmtm -48.61 -35.21 13.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.216 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.427 ' CD2' ' CD2' ' A' ' 76' ' ' TYR . 1.5 t-80 -79.17 -3.35 45.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.817 -179.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.523 ' CE2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.5 27.66 0.9 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.663 0.268 . . . . 0.0 110.947 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -167.1 125.61 1.34 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.982 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.906 -179.933 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.9 mttt . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.808 0.337 . . . . 0.0 111.192 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.614 ' O ' HG22 ' A' ' 45' ' ' VAL . 13.0 p -78.43 34.71 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.979 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -78.59 2.91 17.71 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.657 ' HB3' HD21 ' A' ' 52' ' ' LEU . 17.3 m-85 70.42 50.99 0.37 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.016 0.436 . . . . 0.0 110.696 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.512 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 85.3 p -71.52 -47.89 52.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.31 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.756 ' HA ' HD12 ' A' ' 52' ' ' LEU . 5.3 pt-20 167.39 -42.16 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.486 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -55.7 -56.1 24.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.251 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.458 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.3 OUTLIER -60.07 -40.73 90.55 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.395 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.756 HD12 ' HA ' ' A' ' 49' ' ' GLU . 23.7 mt -60.05 -50.98 71.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.208 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.634 ' HA ' HD12 ' A' ' 56' ' ' ILE . 41.5 tttm -53.04 -48.88 67.28 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.1 m -55.19 -43.12 74.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.313 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.516 ' HB2' HD12 ' A' ' 61' ' ' LEU . 4.7 m-70 -60.79 -49.81 75.98 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.686 178.467 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.634 HD12 ' HA ' ' A' ' 53' ' ' LYS . 34.3 mt -55.89 -46.74 80.31 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.905 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 58.5 m -53.7 -74.37 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.272 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -61.79 -74.77 0.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.133 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 145.66 37.39 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.857 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 63.2 p -100.41 -9.48 22.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.688 0.28 . . . . 0.0 111.034 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.62 HD22 ' HG ' ' A' ' 88' ' ' LEU . 0.7 OUTLIER -58.67 -24.84 62.05 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.843 0.354 . . . . 0.0 110.38 179.611 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.717 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -88.01 16.19 52.54 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.581 179.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.6 mtmt -91.38 -57.91 2.62 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.089 0.471 . . . . 0.0 110.125 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -49.92 155.8 0.84 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.361 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 73.6 p -74.4 -169.53 0.84 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.708 179.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.601 HG13 HD11 ' A' ' 87' ' ' LEU . 53.7 t -78.01 -46.69 2.25 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.748 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.516 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 52.6 Cg_exo -51.97 -34.69 57.64 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.192 1.928 . . . . 0.0 111.84 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 17.0 mtm -80.27 -39.26 29.24 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.404 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.647 ' CB ' HD13 ' A' ' 87' ' ' LEU . 7.9 mt -60.82 -46.89 88.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.393 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.453 ' HD3' HG12 ' A' ' 66' ' ' VAL . 0.2 OUTLIER -52.08 -33.14 37.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.628 179.256 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.402 ' O ' ' CG ' ' A' ' 74' ' ' ARG . 2.2 tm-20 -56.82 -53.76 54.12 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.865 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.689 ' CB ' HD21 ' A' ' 91' ' ' LEU . . . -57.68 -33.74 68.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.031 0.443 . . . . 0.0 110.38 179.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.779 ' HA ' HD12 ' A' ' 78' ' ' LEU . 34.8 m -61.45 -47.48 85.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.02 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.405 ' HG3' ' N ' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -61.99 -28.45 69.57 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.921 -179.849 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.405 ' N ' ' HG3' ' A' ' 74' ' ' ARG . . . -80.14 -34.29 37.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.986 0.422 . . . . 0.0 110.724 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.463 ' CE2' ' HB3' ' A' ' 94' ' ' HIS . 3.2 m-30 -84.8 -25.76 27.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.047 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.07 24.52 31.73 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.457 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.779 HD12 ' HA ' ' A' ' 73' ' ' CYS . 1.3 mt -81.13 -164.73 0.79 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.759 0.314 . . . . 0.0 110.821 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.64 24.4 2.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.006 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.83 -166.99 0.87 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.785 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.671 ' HA2' HD21 ' A' ' 87' ' ' LEU . . . 108.8 88.03 1.93 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.632 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 82' ' ' LEU . 19.2 mt -158.86 -86.17 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.675 0.274 . . . . 0.0 110.667 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 3.1 mmtm -82.0 -66.01 0.94 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.841 0.353 . . . . 0.0 110.642 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.605 ' HA ' HD12 ' A' ' 87' ' ' LEU . 0.8 OUTLIER 169.13 -65.63 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.019 179.931 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.68 -37.48 28.89 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.248 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.87 -40.12 69.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.067 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.741 ' O ' HD12 ' A' ' 91' ' ' LEU . 1.9 mt -61.54 -47.16 86.84 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.717 HD21 ' CA ' ' A' ' 62' ' ' GLY . 9.4 mp -51.42 -53.02 41.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.227 178.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -51.12 -52.75 40.71 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.879 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.545 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.88 -43.24 66.0 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.103 0.478 . . . . 0.0 110.107 179.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.741 HD12 ' O ' ' A' ' 87' ' ' LEU . 0.4 OUTLIER -66.82 -58.52 4.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.695 179.187 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.41 ' OG1' HG23 ' A' ' 56' ' ' ILE . 1.2 m -49.37 -55.59 12.43 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.263 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.8 mtpp -46.31 -34.21 4.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.043 179.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.463 ' HB3' ' CE2' ' A' ' 76' ' ' TYR . 33.1 t-80 -66.22 -55.42 16.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.143 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.57 ' CZ ' ' HD2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -92.38 14.26 17.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.5 -179.629 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.408 ' N ' ' O ' ' A' ' 92' ' ' THR . 0.0 OUTLIER -73.54 105.94 5.1 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.729 0.3 . . . . 0.0 110.873 179.692 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.242 -0.885 . . . . 0.0 110.929 -179.988 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.832 0.349 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.563 ' O ' HG12 ' A' ' 45' ' ' VAL . 20.0 t -76.16 2.41 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.998 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -73.38 -16.55 61.34 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.6 0.238 . . . . 0.0 111.345 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.807 ' HB3' HD21 ' A' ' 52' ' ' LEU . 26.8 m-85 65.14 55.0 1.15 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.987 0.423 . . . . 0.0 110.911 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.46 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 13.1 p -71.87 -46.92 56.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.518 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.708 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.2 tt0 168.16 -43.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.537 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.33 -58.55 6.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.374 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.417 ' O ' ' CD2' ' A' ' 55' ' ' HIS . 0.3 OUTLIER -59.06 -39.26 81.53 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.463 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.807 HD21 ' HB3' ' A' ' 47' ' ' TYR . 38.0 mt -60.33 -52.3 65.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.306 178.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.763 ' HA ' HD12 ' A' ' 56' ' ' ILE . 1.4 tmtp? -54.87 -47.34 74.37 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-O 121.107 0.479 . . . . 0.0 110.005 179.153 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.2 m -59.09 -44.04 91.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.9 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.417 ' CD2' ' O ' ' A' ' 51' ' ' GLU . 19.3 m-70 -58.68 -49.73 76.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.889 179.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.763 HD12 ' HA ' ' A' ' 53' ' ' LYS . 8.2 mt -57.63 -48.21 83.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.014 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.91 -65.74 0.51 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.645 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 46.2 mttt -60.69 -39.01 86.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.166 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 111.29 23.67 5.68 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.527 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 44.5 p -97.65 -13.63 21.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.587 0.232 . . . . 0.0 111.001 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.824 ' O ' HD22 ' A' ' 88' ' ' LEU . 3.1 tm? -59.09 -28.53 66.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.746 0.308 . . . . 0.0 110.463 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.597 ' HA2' HD13 ' A' ' 88' ' ' LEU . . . -86.7 13.22 59.26 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.598 179.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.94 -45.68 6.84 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.815 0.341 . . . . 0.0 111.275 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -45.24 144.77 1.27 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.958 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.647 ' O ' HD12 ' A' ' 69' ' ' LEU . 26.7 p -74.13 -168.2 0.6 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.82 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.518 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 55.5 t -76.1 -56.84 1.54 Allowed Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.626 -179.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.518 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 7.9 Cg_endo -50.28 -34.9 41.96 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.357 2.038 . . . . 0.0 112.416 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 47.1 mtm -80.1 -33.91 38.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.489 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.976 HD21 HD23 ' A' ' 88' ' ' LEU . 4.8 mt -61.43 -41.55 97.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.924 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.75 -37.68 43.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.839 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.61 -57.79 10.88 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.985 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.825 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.61 -44.29 85.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.872 0.368 . . . . 0.0 110.546 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.2 m -60.27 -37.26 79.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.436 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.0 mtt180 -62.47 -36.89 83.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.647 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -78.82 -32.16 46.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.005 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.465 ' CE1' ' HG3' ' A' ' 49' ' ' GLU . 2.7 m-85 -83.79 -25.99 29.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.187 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.7 24.45 55.9 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.617 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.4 mt -81.11 175.6 10.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.822 0.344 . . . . 0.0 110.842 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.01 -53.8 3.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.833 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.631 ' CB ' HD23 ' A' ' 87' ' ' LEU . 86.8 p 45.29 -166.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.35 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.53 ' C ' HD12 ' A' ' 82' ' ' LEU . . . -148.22 -112.23 0.66 Allowed Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.475 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.649 ' N ' HD12 ' A' ' 82' ' ' LEU . 0.1 OUTLIER -153.31 13.09 0.49 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.594 0.235 . . . . 0.0 111.395 -179.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.416 ' O ' ' HB3' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -84.97 8.05 19.09 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.764 -0.198 . . . . 0.0 111.292 179.476 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.416 ' HB3' ' O ' ' A' ' 83' ' ' LYS . 32.4 tttt 71.39 -79.35 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.57 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.855 ' HA ' HD12 ' A' ' 88' ' ' LEU . 0.5 OUTLIER -47.3 -40.44 16.92 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.88 0.372 . . . . 0.0 111.093 179.592 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.22 -49.78 66.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.692 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.84 ' HB2' HD13 ' A' ' 69' ' ' LEU . 2.4 mt -61.22 -49.58 76.56 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 178.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.976 HD23 HD21 ' A' ' 69' ' ' LEU . 15.4 mt -52.67 -50.55 63.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.941 178.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -54.5 -52.4 62.08 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.593 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -51.33 -41.4 60.53 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.099 0.476 . . . . 0.0 110.114 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.825 HD21 ' HB1' ' A' ' 72' ' ' ALA . 1.1 mt -65.67 -61.54 2.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.295 179.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.7 m -50.17 -56.67 10.05 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.086 179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.4 mtpt -48.36 -33.41 8.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.095 179.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -71.6 -15.47 62.26 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.684 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.447 ' CD1' ' HE3' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.19 34.84 0.89 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.839 0.352 . . . . 0.0 110.908 -179.867 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -72.45 -177.83 2.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.88 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.5 t70 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.893 179.991 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.438 ' O ' ' CG2' ' A' ' 45' ' ' VAL . 19.9 mmtp . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.713 0.292 . . . . 0.0 111.116 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.438 ' CG2' ' O ' ' A' ' 44' ' ' LYS . 63.5 t -160.52 -54.16 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.752 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.415 ' O ' ' CD1' ' A' ' 47' ' ' TYR . 11.5 mm-40 -164.25 -70.49 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.832 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.728 ' HB3' HD21 ' A' ' 52' ' ' LEU . 60.6 m-85 -156.17 75.5 0.88 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.482 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.529 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 85.3 p -73.67 -55.32 6.41 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.616 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.684 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.0 OUTLIER 168.66 -37.22 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.149 179.831 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -57.09 -54.79 42.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.765 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.46 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.0 OUTLIER -61.09 -42.92 99.4 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.022 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.728 HD21 ' HB3' ' A' ' 47' ' ' TYR . 33.1 mt -58.72 -50.99 71.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.077 178.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.476 ' CE ' ' CD1' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -52.42 -48.92 65.45 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.858 179.055 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.549 HG22 ' HD2' ' A' ' 58' ' ' LYS . 3.9 m -57.51 -42.34 82.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.643 178.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.669 ' HB2' HD12 ' A' ' 61' ' ' LEU . 4.7 m-70 -60.09 -48.9 79.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.859 178.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 74.7 mt -56.41 -47.95 80.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.859 179.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.48 -72.75 0.06 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.51 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.549 ' HD2' HG22 ' A' ' 54' ' ' THR . 4.1 mttt -61.53 -74.34 0.08 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.297 -179.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 145.53 35.24 0.07 OUTLIER Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.949 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.428 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 0.7 OUTLIER -99.82 -9.62 22.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.644 0.259 . . . . 0.0 110.85 179.603 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.669 HD12 ' HB2' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -59.32 -21.48 59.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.902 0.382 . . . . 0.0 110.379 179.544 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.705 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -90.66 15.12 61.16 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.934 -0.651 . . . . 0.0 112.535 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.428 ' HB2' ' O ' ' A' ' 60' ' ' THR . 0.1 OUTLIER -90.92 -55.95 3.36 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.025 0.44 . . . . 0.0 109.977 179.633 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -49.82 151.79 1.71 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.236 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.467 ' O ' HD12 ' A' ' 69' ' ' LEU . 17.8 p -73.87 -165.49 0.3 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.767 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.514 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 41.7 t -76.59 -57.55 1.26 Allowed Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.205 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 9.1 Cg_endo -50.95 -28.97 25.63 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.272 1.981 . . . . 0.0 112.101 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.4 mtp -79.98 -39.33 30.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.151 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.744 ' HB2' HD13 ' A' ' 87' ' ' LEU . 7.0 mt -61.16 -43.03 99.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.52 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.94 -33.4 37.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.854 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -56.02 -52.52 63.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.053 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.643 ' CB ' HD21 ' A' ' 91' ' ' LEU . . . -57.67 -53.01 63.04 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.687 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.97 -33.61 72.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.358 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -37.72 87.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.08 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.77 -26.83 31.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.715 179.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CD2' ' CD2' ' A' ' 94' ' ' HIS . 3.0 m-85 -82.97 -30.92 27.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.817 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.97 14.6 59.05 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.809 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.559 HD13 ' O ' ' A' ' 90' ' ' ALA . 4.4 mt -82.04 167.19 19.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.934 0.397 . . . . 0.0 111.103 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.29 75.58 1.82 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.662 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.695 ' OG ' HD23 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -75.85 -169.07 1.0 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.103 -179.697 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -140.91 -120.37 1.67 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.47 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.7 pp -155.4 11.23 0.32 Allowed 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.8 tptp -85.52 7.05 24.38 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.614 0.245 . . . . 0.0 111.095 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.4 ttmm 69.43 -76.82 0.06 Allowed 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.53 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -50.56 -36.36 34.21 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.876 0.37 . . . . 0.0 111.161 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -62.08 -38.28 88.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.062 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.744 HD13 ' HB2' ' A' ' 69' ' ' LEU . 1.2 mt -61.38 -42.44 98.72 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.705 HD21 ' CA ' ' A' ' 62' ' ' GLY . 9.2 mp -52.04 -54.48 29.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.34 178.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -50.37 -52.54 36.36 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.828 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.559 ' O ' HD13 ' A' ' 78' ' ' LEU . . . -51.4 -44.09 62.13 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.199 0.523 . . . . 0.0 109.814 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.643 HD21 ' CB ' ' A' ' 72' ' ' ALA . 0.4 OUTLIER -66.66 -61.09 2.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.653 179.016 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.0 m -48.88 -52.14 25.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.365 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 15.6 tptp -48.46 -34.64 11.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.168 179.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.501 ' CD2' ' CD2' ' A' ' 76' ' ' TYR . 24.7 t60 -78.53 -5.55 52.98 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.923 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.476 ' CD1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.65 27.96 0.98 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.799 0.333 . . . . 0.0 110.975 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -72.71 98.17 2.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.884 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.847 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.8 mmpt? . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.866 0.365 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.9 p -73.57 -33.23 38.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.053 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -76.76 -0.42 23.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.671 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.781 ' HB3' HD21 ' A' ' 52' ' ' LEU . 24.4 m-85 64.42 83.05 0.17 Allowed 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.971 0.415 . . . . 0.0 110.754 -179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.512 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 83.0 p -72.47 -52.99 13.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.342 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.858 ' HA ' HD12 ' A' ' 52' ' ' LEU . 2.5 pt-20 164.83 -39.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.001 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -56.13 -58.26 8.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.471 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.442 ' HG3' ' CE1' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -58.92 -37.5 76.81 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 179.61 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.858 HD12 ' HA ' ' A' ' 49' ' ' GLU . 36.2 mt -60.95 -53.6 55.31 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.22 178.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.643 ' HA ' HD12 ' A' ' 56' ' ' ILE . 20.8 tttm -54.7 -47.02 74.21 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-O 121.03 0.443 . . . . 0.0 110.096 178.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.9 m -56.97 -44.81 83.01 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.489 178.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.446 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 12.0 m-70 -60.42 -51.49 69.26 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.824 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.643 HD12 ' HA ' ' A' ' 53' ' ' LYS . 11.6 mt -56.96 -42.42 78.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.024 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.78 -76.11 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.643 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.9 pttt -60.97 -51.51 68.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.371 -179.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 123.98 52.18 0.2 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.564 -0.826 . . . . 0.0 112.805 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.661 HG22 ' HG3' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -124.18 -4.13 7.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.506 0.193 . . . . 0.0 111.097 179.792 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.481 HD11 HD13 ' A' ' 91' ' ' LEU . 60.7 tp -60.05 -20.89 60.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.843 0.354 . . . . 0.0 110.559 179.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.781 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -93.05 22.8 32.47 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.25 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.661 ' HG3' HG22 ' A' ' 60' ' ' THR . 0.3 OUTLIER -91.37 -57.59 2.73 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 121.018 0.437 . . . . 0.0 110.073 179.683 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -49.84 157.26 0.61 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.25 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 30.6 p -73.86 -169.4 0.73 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.037 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.529 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 75.2 t -76.77 -56.22 1.4 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.315 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 9.9 Cg_endo -52.31 -29.61 39.26 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.147 1.898 . . . . 0.0 112.027 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.71 -41.51 26.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.2 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.737 ' CB ' HD22 ' A' ' 87' ' ' LEU . 24.6 mt -61.4 -34.68 75.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.52 179.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.465 ' N ' HD22 ' A' ' 87' ' ' LEU . 12.4 mmtt -53.16 -38.21 62.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.097 179.636 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -54.98 -49.66 70.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.964 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.685 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.31 -48.81 77.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.733 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.76 -40.04 86.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.418 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -37.03 81.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.478 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.01 -30.39 44.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.734 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.636 ' HB3' HD23 ' A' ' 78' ' ' LEU . 2.7 m-85 -85.48 5.38 31.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.417 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.82 16.18 58.92 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.704 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.879 ' HG ' ' HB1' ' A' ' 90' ' ' ALA . 3.4 mm? -81.1 178.74 8.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.873 0.368 . . . . 0.0 110.868 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.17 -31.85 12.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.698 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.9 p 65.63 169.3 0.21 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.977 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -151.06 150.91 22.95 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.56 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.57 66.95 6.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.921 0.391 . . . . 0.0 110.864 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -155.88 8.33 0.24 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.938 -179.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.422 ' CA ' HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER 65.99 -76.48 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.725 0.298 . . . . 0.0 111.031 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.672 ' HA ' HD13 ' A' ' 88' ' ' LEU . 8.1 tt0 -47.83 -34.01 8.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.332 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 37.8 tp10 -59.72 -42.54 93.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.925 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.737 HD22 ' CB ' ' A' ' 69' ' ' LEU . 1.5 mp -61.11 -43.91 98.15 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.781 HD21 ' CA ' ' A' ' 62' ' ' GLY . 5.2 mp -51.51 -53.71 34.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.269 178.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -50.47 -53.25 31.21 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.97 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.879 ' HB1' ' HG ' ' A' ' 78' ' ' LEU . . . -52.19 -43.99 64.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.062 0.458 . . . . 0.0 110.128 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.721 ' CD2' HD22 ' A' ' 52' ' ' LEU . 0.4 OUTLIER -66.36 -58.54 5.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.424 179.094 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.9 m -50.23 -57.27 8.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.419 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.51 -31.87 11.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.279 179.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -85.43 0.49 52.09 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.579 ' CZ ' ' HD2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -147.64 19.75 1.17 Allowed 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.036 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -72.57 82.48 1.11 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.799 0.333 . . . . 0.0 110.92 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.897 179.987 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.0 mtpt . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.833 0.349 . . . . 0.0 111.196 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.625 HG21 ' OE1' ' A' ' 51' ' ' GLU . 16.3 t -73.65 -45.11 51.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.087 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 76.24 28.91 0.77 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.043 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.892 ' HB3' HD21 ' A' ' 52' ' ' LEU . 21.7 m-85 51.95 68.8 0.75 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.022 0.439 . . . . 0.0 110.967 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.512 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 2.7 p -73.34 -53.31 11.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.383 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.839 ' HA ' HD12 ' A' ' 52' ' ' LEU . 8.1 pt-20 168.24 -39.46 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.214 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -56.29 -55.61 31.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.036 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.625 ' OE1' HG21 ' A' ' 45' ' ' VAL . 0.4 OUTLIER -59.97 -43.02 95.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.343 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.892 HD21 ' HB3' ' A' ' 47' ' ' TYR . 15.4 mt -58.9 -50.68 73.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.055 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.741 ' HA ' HD12 ' A' ' 56' ' ' ILE . 0.5 OUTLIER -52.61 -49.05 65.84 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.878 178.976 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.9 m -58.05 -43.45 86.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.727 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.476 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 6.2 m-70 -59.73 -49.33 78.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.84 178.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.741 HD12 ' HA ' ' A' ' 53' ' ' LYS . 16.4 mt -56.22 -47.73 80.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.988 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.54 -75.7 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.344 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -61.74 -72.28 0.13 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.148 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 143.33 39.47 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.582 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -99.52 -9.95 22.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.704 0.288 . . . . 0.0 111.068 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.619 HD12 HG13 ' A' ' 56' ' ' ILE . 0.4 OUTLIER -59.7 -21.46 60.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.862 0.363 . . . . 0.0 110.648 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.755 ' HA2' HD11 ' A' ' 88' ' ' LEU . . . -94.84 17.11 59.88 Favored Glycine 0 C--N 1.333 0.363 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.514 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.87 -57.44 2.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.992 0.425 . . . . 0.0 110.272 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -48.62 161.95 0.11 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.181 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 52.8 p -73.25 -174.63 1.65 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.816 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.674 HG22 ' HB3' ' A' ' 84' ' ' LYS . 82.7 t -75.86 -56.3 1.74 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.227 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.532 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 7.4 Cg_endo -50.08 -28.32 19.06 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.201 1.934 . . . . 0.0 111.89 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.47 -42.35 25.48 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.026 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.852 ' CB ' HD13 ' A' ' 87' ' ' LEU . 11.9 mt -60.87 -42.65 98.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.061 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.47 ' HD3' HD21 ' A' ' 87' ' ' LEU . 6.5 mmtp -54.06 -33.71 58.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.29 178.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -55.42 31.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.919 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.639 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.11 -44.57 83.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.02 0.438 . . . . 0.0 110.378 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 86.3 m -60.89 -43.26 98.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.426 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -35.74 78.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.469 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.67 -31.51 59.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.609 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -84.22 -23.45 30.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.972 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 92.47 15.4 53.3 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.57 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.482 HD13 ' HB1' ' A' ' 90' ' ' ALA . 4.5 mt -81.21 172.98 12.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.753 0.311 . . . . 0.0 110.856 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.68 -50.07 4.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.654 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.835 ' CB ' HD23 ' A' ' 87' ' ' LEU . 59.0 p 45.44 -166.15 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.593 179.591 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.58 164.88 17.91 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.368 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.1 mt 76.51 118.62 0.05 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.071 0.462 . . . . 0.0 111.031 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.419 ' O ' ' HB3' ' A' ' 84' ' ' LYS . 0.3 OUTLIER 62.53 -79.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.635 179.627 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.674 ' HB3' HG22 ' A' ' 66' ' ' VAL . 3.9 ptpt 163.68 -46.71 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.945 0.403 . . . . 0.0 110.14 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -47.24 -39.78 15.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.904 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -48.81 -36.42 16.72 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.56 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.852 HD13 ' CB ' ' A' ' 69' ' ' LEU . 9.6 mt -62.43 -51.66 66.65 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 178.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.755 HD11 ' HA2' ' A' ' 62' ' ' GLY . 4.0 mp -52.35 -54.29 33.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.844 178.225 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -51.5 -49.31 62.12 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.663 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.482 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.41 -45.24 65.82 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.161 0.505 . . . . 0.0 109.884 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.846 ' CD2' HD22 ' A' ' 52' ' ' LEU . 0.3 OUTLIER -66.61 -60.38 2.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.554 179.048 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.4 m -50.24 -52.96 31.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.368 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -48.88 -32.01 8.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.869 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -93.09 13.84 19.7 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.531 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.505 ' HB3' HD13 ' A' ' 56' ' ' ILE . 0.1 OUTLIER -145.44 -6.09 0.64 Allowed 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.914 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -73.27 122.58 22.2 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.821 0.343 . . . . 0.0 110.893 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.892 -179.946 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 12.7 tptt . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.782 0.325 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.792 HG13 ' H ' ' A' ' 47' ' ' TYR . 8.3 p -73.63 -30.36 29.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.048 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 74.98 21.48 1.99 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.215 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.901 ' HB3' HD21 ' A' ' 52' ' ' LEU . 3.1 m-85 50.39 58.48 5.45 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.056 0.455 . . . . 0.0 110.955 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.487 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 79.8 p -72.73 -44.24 61.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.703 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.889 ' HA ' HD12 ' A' ' 52' ' ' LEU . 26.7 tt0 165.22 -45.89 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.223 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.1 -56.55 16.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.22 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.468 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.1 OUTLIER -59.1 -40.28 84.81 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 179.29 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.901 HD21 ' HB3' ' A' ' 47' ' ' TYR . 28.0 mt -59.04 -53.66 55.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.285 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.48 ' HG2' ' CD2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.77 -47.28 70.87 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 121.065 0.459 . . . . 0.0 109.942 179.131 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.1 m -58.2 -42.17 85.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.697 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.468 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 12.8 m-70 -60.53 -47.76 84.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.181 179.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.539 HD11 ' HA ' ' A' ' 92' ' ' THR . 0.8 OUTLIER -55.51 -44.48 76.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.977 179.628 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 m -52.93 -73.13 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.307 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.2 mttm -62.13 -52.9 61.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.997 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 117.71 32.63 1.41 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.503 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.31 -3.14 34.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.613 0.244 . . . . 0.0 111.297 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.676 ' C ' HD21 ' A' ' 88' ' ' LEU . 0.6 OUTLIER -60.21 -23.0 63.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.723 0.297 . . . . 0.0 110.871 179.883 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.617 ' N ' HD21 ' A' ' 88' ' ' LEU . . . -96.62 20.72 49.33 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.818 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.69 -56.64 2.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.949 0.404 . . . . 0.0 110.325 179.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -48.43 154.17 0.66 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.345 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 72.1 p -73.09 -163.05 0.13 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.623 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.555 ' HB ' ' HD3' ' A' ' 67' ' ' PRO . 11.9 t -77.41 -51.69 1.89 Allowed Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.518 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.555 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 78.5 Cg_exo -46.43 -33.15 12.2 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.271 1.98 . . . . 0.0 111.966 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 9.4 mmm -80.18 -51.18 9.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.552 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.971 ' HB2' HD13 ' A' ' 87' ' ' LEU . 55.8 mt -60.43 -39.31 87.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.574 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.401 ' HD3' ' HA3' ' A' ' 81' ' ' GLY . 0.3 OUTLIER -52.14 -41.94 62.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.75 179.371 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.81 -55.15 29.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.22 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.572 ' HB2' ' CB ' ' A' ' 47' ' ' TYR . . . -57.32 -47.95 80.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.961 0.41 . . . . 0.0 110.499 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.729 ' SG ' HD23 ' A' ' 87' ' ' LEU . 31.9 m -61.41 -40.11 93.21 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.648 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.53 -35.55 80.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.944 0.402 . . . . 0.0 110.524 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.43 -43.27 70.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.854 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CE1' ' CE1' ' A' ' 94' ' ' HIS . 8.8 m-85 -84.87 -16.52 40.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.43 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 73' ' ' CYS . . . 59.39 46.27 94.17 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.571 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.587 ' CB ' ' HB1' ' A' ' 90' ' ' ALA . 1.5 mt -84.65 14.34 4.76 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? 61.91 8.12 2.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.315 -0.402 . . . . 0.0 112.006 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -80.89 -168.74 1.9 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.853 0.359 . . . . 0.0 110.906 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.611 ' HA2' HD21 ' A' ' 87' ' ' LEU . . . 93.6 88.5 1.62 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.629 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -159.76 -80.19 0.05 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.79 0.329 . . . . 0.0 110.932 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -80.54 -69.21 0.61 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.822 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.407 ' HA ' HG22 ' A' ' 66' ' ' VAL . 9.4 ttmm 173.97 -81.25 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.461 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.501 ' HG3' HD12 ' A' ' 88' ' ' LEU . 5.0 tt0 -47.8 -29.8 3.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.177 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.73 -36.33 62.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.784 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.971 HD13 ' HB2' ' A' ' 69' ' ' LEU . 2.3 mt -62.29 -44.94 95.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.276 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.676 HD21 ' C ' ' A' ' 61' ' ' LEU . 42.4 mt -50.87 -52.89 37.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.4 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -49.73 -52.13 33.71 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.861 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.587 ' HB1' ' CB ' ' A' ' 78' ' ' LEU . . . -53.67 -48.28 69.61 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.941 0.4 . . . . 0.0 110.663 179.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.856 HD22 HD22 ' A' ' 52' ' ' LEU . 2.3 mt -66.86 -49.2 66.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.62 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.549 HG22 ' N ' ' A' ' 93' ' ' LYS . 0.6 OUTLIER -52.15 -58.71 5.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.604 179.822 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.549 ' N ' HG22 ' A' ' 92' ' ' THR . 3.6 ptmt -47.85 -30.48 4.11 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.261 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.5 ' CE1' ' CE1' ' A' ' 76' ' ' TYR . 37.9 t-80 -73.32 -21.54 60.54 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.411 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.48 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.46 43.21 1.1 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.944 0.402 . . . . 0.0 111.054 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.91 121.13 0.91 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.819 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.937 -179.951 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.2 mttp . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.837 0.351 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.757 HG21 ' OE2' ' A' ' 51' ' ' GLU . 14.5 t -73.86 -38.78 51.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.1 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 65.67 30.72 10.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.991 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.783 ' HB3' HD21 ' A' ' 52' ' ' LEU . 6.3 m-85 57.98 57.58 4.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.01 0.433 . . . . 0.0 110.95 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.548 ' H ' HG12 ' A' ' 45' ' ' VAL . 88.0 p -73.07 -47.78 41.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.268 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.886 ' HA ' HD12 ' A' ' 52' ' ' LEU . 6.4 pt-20 166.18 -41.72 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.898 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.17 -54.78 41.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.979 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.757 ' OE2' HG21 ' A' ' 45' ' ' VAL . 0.5 OUTLIER -59.58 -43.11 93.73 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.281 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.886 HD12 ' HA ' ' A' ' 49' ' ' GLU . 16.5 mt -59.04 -51.61 69.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.194 178.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.758 ' O ' HG22 ' A' ' 56' ' ' ILE . 1.3 mmtt -54.2 -45.15 72.12 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-O 121.273 0.559 . . . . 0.0 110.224 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.424 HG22 ' O ' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -61.11 -41.45 96.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.496 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 7.7 m-70 -60.75 -50.63 72.68 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.402 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.758 HG22 ' O ' ' A' ' 53' ' ' LYS . 8.7 tt -58.21 -42.35 83.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 121.064 0.459 . . . . 0.0 110.67 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.7 t -54.29 -76.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.172 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 9.8 mttt -62.43 -68.86 0.29 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.023 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 141.08 39.61 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.729 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 60.7 p -101.18 -10.45 20.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.676 0.274 . . . . 0.0 111.165 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.559 HD21 HD13 ' A' ' 91' ' ' LEU . 0.4 OUTLIER -59.09 -23.86 62.44 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.811 0.338 . . . . 0.0 110.586 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.649 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -90.58 11.99 69.86 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.414 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.1 mmtp -92.17 -54.4 3.84 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.931 0.396 . . . . 0.0 110.473 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -47.95 152.15 0.82 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.274 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 24.0 p -73.56 -166.66 0.37 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.852 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.503 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 53.2 t -76.96 -57.83 1.11 Allowed Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.437 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 5.7 Cg_endo -48.34 -29.97 14.31 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.275 1.983 . . . . 0.0 112.105 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.2 mtp -80.27 -41.45 24.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.26 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.92 ' CB ' HD13 ' A' ' 87' ' ' LEU . 11.9 mt -61.15 -49.86 75.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.555 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.598 ' HG3' HD21 ' A' ' 87' ' ' LEU . 2.0 mttt -51.32 -31.34 21.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.542 179.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -56.58 -53.57 56.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.796 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.783 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.83 -46.38 84.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.543 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 42.0 m -60.22 -40.67 90.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.561 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.9 ttt-85 -61.23 -36.52 80.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.51 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.3 -36.35 61.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.692 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.602 ' HB3' HD23 ' A' ' 78' ' ' LEU . 2.9 m-30 -85.49 5.97 28.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.481 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.93 33.59 64.0 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.546 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.602 HD23 ' HB3' ' A' ' 76' ' ' TYR . 1.4 mm? -80.66 -170.18 2.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.798 0.332 . . . . 0.0 110.884 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.6 35.68 1.63 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.859 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.706 ' HB3' HD23 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -77.21 -162.5 0.29 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.736 179.892 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 100.95 104.98 2.75 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.487 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -160.26 -39.16 0.05 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.872 0.368 . . . . 0.0 110.97 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -157.74 -52.96 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.768 -179.924 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 83' ' ' LYS . 3.1 ttpt 175.24 -76.67 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.472 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -47.83 -29.95 3.63 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.297 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -57.54 -38.67 75.11 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.811 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.92 HD13 ' CB ' ' A' ' 69' ' ' LEU . 8.1 mt -62.11 -45.88 91.54 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.649 HD21 ' CA ' ' A' ' 62' ' ' GLY . 3.2 mp -50.62 -51.04 52.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.233 178.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -51.31 -55.14 19.93 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.831 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -51.71 -42.24 62.09 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.136 0.493 . . . . 0.0 110.014 179.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.783 HD21 ' HB1' ' A' ' 72' ' ' ALA . 0.7 OUTLIER -65.96 -59.56 3.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.646 179.136 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.594 ' HA ' HD12 ' A' ' 56' ' ' ILE . 2.3 m -48.41 -55.07 11.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.408 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.69 -35.97 15.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.163 179.28 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.501 ' CD2' ' CD2' ' A' ' 76' ' ' TYR . 3.2 t60 -84.9 5.68 27.98 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.591 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.473 ' CE1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.47 17.29 1.17 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.562 0.22 . . . . 0.0 111.164 179.934 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.64 173.2 9.33 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.8 0.333 . . . . 0.0 110.864 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.873 179.936 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.883 0.373 . . . . 0.0 111.192 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.574 ' O ' HG12 ' A' ' 45' ' ' VAL . 14.2 t -78.65 35.37 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.963 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.441 ' O ' ' CD1' ' A' ' 47' ' ' TYR . 4.3 mm-40 -76.15 -39.0 56.01 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.891 0.377 . . . . 0.0 110.902 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.85 ' HB3' HD21 ' A' ' 52' ' ' LEU . 65.7 m-85 -156.78 66.86 0.54 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.517 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 65.8 p -73.22 -45.83 53.86 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.012 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.795 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.2 pt-20 166.06 -46.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.425 -179.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.93 -58.8 5.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.398 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.431 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 3.3 mm-40 -58.8 -39.53 81.4 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.91 HD22 ' CD2' ' A' ' 91' ' ' LEU . 50.6 mt -59.3 -53.58 56.63 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.315 178.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.717 ' HE2' ' CG ' ' A' ' 95' ' ' PHE . 0.1 OUTLIER -55.11 -46.11 75.55 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.438 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.9 m -58.53 -44.83 89.69 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.432 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 13.5 m-70 -61.65 -53.57 54.36 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.056 -0.975 . . . . 0.0 109.738 178.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.489 HD12 ' HE3' ' A' ' 53' ' ' LYS . 14.4 mt -57.26 -41.38 78.03 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.74 179.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.7 t -55.08 -74.9 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.237 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.3 mtpp -62.75 -69.39 0.26 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.007 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 145.52 37.69 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.698 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 73.9 p -100.79 -10.32 20.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.643 0.259 . . . . 0.0 111.036 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.933 HD11 HD13 ' A' ' 91' ' ' LEU . 22.8 tp -58.27 -22.45 52.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.847 0.356 . . . . 0.0 110.646 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.552 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -94.09 15.51 63.01 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.609 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.07 -56.24 3.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.95 0.405 . . . . 0.0 110.51 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -48.68 154.79 0.63 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.383 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 82.6 p -73.33 -170.51 0.8 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.584 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.653 HG13 HD11 ' A' ' 87' ' ' LEU . 65.9 t -77.89 -46.9 2.3 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.838 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.526 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 60.1 Cg_exo -50.83 -35.26 48.12 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.17 1.914 . . . . 0.0 111.972 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 34.8 mtm -79.99 -40.33 28.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.474 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.684 ' CB ' HD13 ' A' ' 87' ' ' LEU . 7.7 mt -60.42 -44.82 95.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.496 179.523 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.75 -34.08 37.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.666 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -57.02 -54.54 45.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.899 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.702 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -56.79 -50.12 73.29 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.993 0.425 . . . . 0.0 110.496 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 8.2 m -60.89 -40.01 91.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.509 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.32 -35.94 80.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.735 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.8 -29.86 40.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.901 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.498 ' CE2' ' CD2' ' A' ' 94' ' ' HIS . 3.2 m-85 -84.63 -26.95 27.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.04 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.89 25.03 23.67 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.661 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.756 ' HG ' ' HB1' ' A' ' 90' ' ' ALA . 3.8 mm? -81.21 -175.66 5.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.828 0.346 . . . . 0.0 110.905 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.02 -24.69 15.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.01 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.519 ' HB3' HD23 ' A' ' 87' ' ' LEU . 0.3 OUTLIER 50.04 -176.62 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.916 0.389 . . . . 0.0 111.266 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -165.97 161.31 34.9 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.523 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 mp -80.38 -4.46 53.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.585 0.231 . . . . 0.0 111.411 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.1 2.24 28.2 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.673 -0.239 . . . . 0.0 111.57 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.737 ' HA ' HD12 ' A' ' 87' ' ' LEU . 17.9 ttmm 66.85 -73.98 0.07 Allowed 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.663 0.268 . . . . 0.0 110.962 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -47.74 -30.52 3.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.149 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -60.24 -35.57 75.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.792 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.737 HD12 ' HA ' ' A' ' 84' ' ' LYS . 1.5 mt -61.78 -42.32 98.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.048 0.452 . . . . 0.0 109.812 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.552 HD21 ' CA ' ' A' ' 62' ' ' GLY . 3.9 mp -51.83 -55.63 18.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.333 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -50.55 -51.2 50.12 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.888 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.756 ' HB1' ' HG ' ' A' ' 78' ' ' LEU . . . -52.68 -45.1 66.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.018 0.437 . . . . 0.0 110.165 179.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.933 HD13 HD11 ' A' ' 61' ' ' LEU . 0.5 OUTLIER -67.37 -57.86 5.84 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.598 179.16 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.401 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.3 m -50.44 -55.11 17.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.226 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.4 mtpt -48.05 -30.39 4.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.098 179.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.498 ' CD2' ' CE2' ' A' ' 76' ' ' TYR . 7.2 t60 -77.23 -15.9 59.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.983 -179.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.717 ' CG ' ' HE2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -147.19 33.11 0.89 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.782 0.325 . . . . 0.0 111.326 -179.819 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.401 ' N ' ' O ' ' A' ' 92' ' ' THR . 1.8 tp60 -72.62 118.28 15.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.861 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.912 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.5 tttt . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.798 0.332 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.882 HG11 ' CZ ' ' A' ' 47' ' ' TYR . 16.8 t -73.68 -50.47 29.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.062 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 76.66 69.27 0.06 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.083 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.882 ' CZ ' HG11 ' A' ' 45' ' ' VAL . 81.4 m-85 -81.72 67.44 7.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.729 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.492 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 0.8 OUTLIER -72.51 -54.57 8.87 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.424 179.898 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.521 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.2 pt-20 168.11 -35.04 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.129 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.97 -59.43 5.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -59.83 -38.3 81.66 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.551 HD12 ' CE1' ' A' ' 76' ' ' TYR . 79.5 mt -61.3 -51.3 69.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.124 178.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.895 ' HA ' HD12 ' A' ' 56' ' ' ILE . 16.4 tttt -55.1 -47.84 74.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.988 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 91.6 m -57.83 -42.45 84.35 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.849 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.443 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 16.7 m-70 -59.64 -48.38 81.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.814 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.895 HD12 ' HA ' ' A' ' 53' ' ' LYS . 8.6 mt -57.5 -48.96 81.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.981 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.0 p -53.43 -62.84 1.39 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.714 -179.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.1 mttm -60.7 -34.65 74.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.257 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 108.64 19.98 8.4 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.557 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 61.8 p -97.95 -18.21 18.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.472 0.177 . . . . 0.0 110.888 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.852 ' O ' HD22 ' A' ' 88' ' ' LEU . 2.6 tm? -57.28 -36.76 71.43 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.627 ' HA2' HD13 ' A' ' 88' ' ' LEU . . . -90.06 51.78 3.49 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.057 178.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -139.56 -46.11 0.45 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.888 0.375 . . . . 0.0 110.835 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -47.07 152.85 0.5 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.53 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.674 ' O ' HD12 ' A' ' 69' ' ' LEU . 30.7 p -74.12 -169.56 0.8 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.992 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.679 HG23 ' HG2' ' A' ' 84' ' ' LYS . 63.3 t -76.12 -57.34 1.44 Allowed Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.469 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.511 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 4.4 Cg_endo -47.34 -34.23 18.36 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.47 2.113 . . . . 0.0 112.284 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 40.8 mtm -80.2 -38.13 31.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.335 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.975 HD21 HD23 ' A' ' 88' ' ' LEU . 5.2 mt -61.31 -39.93 92.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.846 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.42 -45.75 55.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.227 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -55.52 -52.2 64.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.027 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.971 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.38 -44.2 84.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.883 179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.93 -41.31 91.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.512 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.6 ttt85 -61.78 -36.12 80.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.623 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.72 -30.54 51.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.789 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.551 ' CE1' HD12 ' A' ' 52' ' ' LEU . 3.2 m-30 -84.45 -22.26 30.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.017 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.44 12.35 61.34 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.65 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.991 HD13 ' HB1' ' A' ' 90' ' ' ALA . 15.8 mt -81.11 -176.05 5.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.759 0.314 . . . . 0.0 110.873 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.9 38.44 1.46 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.866 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.715 ' HB3' HD23 ' A' ' 87' ' ' LEU . 0.7 OUTLIER -77.46 -173.11 2.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.839 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.402 ' HA2' HD11 ' A' ' 87' ' ' LEU . . . 126.64 162.1 11.11 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.736 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 5.1 mt 68.02 26.71 7.25 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.693 0.283 . . . . 0.0 111.413 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.41 ' HB3' ' CB ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -158.49 -6.08 0.08 Allowed 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.679 ' HG2' HG23 ' A' ' 66' ' ' VAL . 66.5 mttm 61.75 -85.25 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.598 0.237 . . . . 0.0 110.716 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.717 ' HA ' HD12 ' A' ' 88' ' ' LEU . 0.0 OUTLIER -48.08 -43.39 30.64 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.941 0.4 . . . . 0.0 110.957 179.722 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.41 ' CB ' ' HB3' ' A' ' 83' ' ' LYS . 1.3 tp10 -47.92 -46.54 32.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.793 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.715 HD23 ' HB3' ' A' ' 80' ' ' SER . 1.8 mt -61.68 -50.15 73.63 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.975 HD23 HD21 ' A' ' 69' ' ' LEU . 19.7 mt -51.83 -52.82 46.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.047 178.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.36 -50.86 64.16 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.656 179.256 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.991 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.35 -42.9 64.3 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.624 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.971 HD21 ' HB1' ' A' ' 72' ' ' ALA . 0.6 OUTLIER -65.1 -56.68 11.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.472 179.326 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.2 m -49.3 -60.4 2.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.494 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.433 ' HG2' ' HA ' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -48.72 -29.59 4.64 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.097 179.306 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.43 ' HB3' ' CE2' ' A' ' 76' ' ' TYR . 1.8 t60 -69.31 -19.24 63.89 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.557 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.499 ' CD1' ' HE3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -146.3 37.9 1.04 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.905 0.383 . . . . 0.0 110.896 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -72.52 117.27 13.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.799 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 25.1 t0 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.192 -0.909 . . . . 0.0 110.898 -179.989 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.411 ' O ' HG12 ' A' ' 45' ' ' VAL . 19.0 pttp . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.767 0.318 . . . . 0.0 111.396 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.611 ' O ' HG22 ' A' ' 45' ' ' VAL . 12.9 p 42.04 33.19 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.643 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 47.89 38.76 9.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.705 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.653 ' HB3' HD21 ' A' ' 52' ' ' LEU . 53.5 m-85 50.27 75.85 0.16 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.461 179.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.504 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 83.3 p -73.99 -55.3 6.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.326 179.401 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.639 ' HA ' HD12 ' A' ' 52' ' ' LEU . 2.9 pt-20 167.49 -36.23 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.084 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -57.13 -56.48 21.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.98 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.411 ' O ' ' CD2' ' A' ' 55' ' ' HIS . 0.1 OUTLIER -60.67 -41.03 94.24 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.269 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.653 HD21 ' HB3' ' A' ' 47' ' ' TYR . 39.9 mt -60.12 -50.64 72.91 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.081 178.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.685 ' HA ' HD12 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -53.74 -48.83 69.27 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.126 179.053 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.0 m -59.37 -43.11 92.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.054 179.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.414 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 24.8 m-70 -59.57 -48.7 80.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.969 179.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.685 HD12 ' HA ' ' A' ' 53' ' ' LYS . 16.3 mt -56.63 -48.08 81.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.903 179.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.67 -63.29 1.2 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.42 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.5 mtmt -61.04 -45.91 92.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.235 -179.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 118.36 20.48 4.32 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.702 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 40.6 p -97.57 -10.07 25.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.568 0.223 . . . . 0.0 111.059 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.937 HD21 HD13 ' A' ' 91' ' ' LEU . 2.4 tm? -58.52 -24.21 60.01 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.795 0.331 . . . . 0.0 110.176 179.406 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.61 ' CA ' HD13 ' A' ' 88' ' ' LEU . . . -87.38 16.58 48.22 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.94 -0.647 . . . . 0.0 112.281 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.34 -46.1 6.86 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.874 0.369 . . . . 0.0 111.2 -179.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -45.45 143.87 1.69 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.27 -179.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.593 ' O ' HD12 ' A' ' 69' ' ' LEU . 40.8 p -74.87 -172.38 1.58 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.748 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.51 HG22 ' N ' ' A' ' 84' ' ' LYS . 85.4 t -75.85 -44.46 3.96 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.206 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.506 ' CD ' ' N ' ' A' ' 66' ' ' VAL . 36.3 Cg_exo -60.86 -38.46 69.82 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.264 1.976 . . . . 0.0 112.15 179.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -80.03 -31.41 39.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.799 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.961 HD21 HD23 ' A' ' 88' ' ' LEU . 5.7 mt -60.97 -43.83 98.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.003 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.7 -39.46 51.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.099 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -56.13 -52.66 63.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.144 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.798 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.09 -49.42 75.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.861 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.79 -36.13 76.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.518 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -37.69 86.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.545 179.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -80.9 -30.03 35.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.894 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.606 ' CE1' HD12 ' A' ' 52' ' ' LEU . 2.7 m-85 -83.63 -22.25 32.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.023 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.19 21.02 53.78 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.523 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.606 HD23 ' HB3' ' A' ' 76' ' ' TYR . 3.4 mm? -81.49 169.94 16.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.839 0.352 . . . . 0.0 111.014 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.13 -38.06 9.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.613 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.668 ' OG ' HD23 ' A' ' 87' ' ' LEU . 0.3 OUTLIER 46.21 -166.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.425 179.764 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -152.38 -118.47 0.76 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.743 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -159.3 72.79 0.56 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.935 0.398 . . . . 0.0 110.801 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.405 ' O ' ' HB3' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -156.03 11.43 0.29 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.695 -179.549 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.51 ' N ' HG22 ' A' ' 66' ' ' VAL . 54.4 tttt 67.43 -83.87 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.797 -179.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.856 ' HA ' HD12 ' A' ' 88' ' ' LEU . 16.1 tt0 -45.34 -40.89 8.3 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.786 0.327 . . . . 0.0 111.108 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.441 ' HA ' ' HG2' ' A' ' 89' ' ' GLU . 1.7 tp10 -57.83 -46.71 84.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.652 179.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.939 ' HB2' HD13 ' A' ' 69' ' ' LEU . 0.8 OUTLIER -62.87 -46.64 86.93 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 178.571 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.961 HD23 HD21 ' A' ' 69' ' ' LEU . 24.9 mt -53.51 -56.63 15.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.519 179.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.441 ' HG2' ' HA ' ' A' ' 86' ' ' GLU . 11.1 pt-20 -55.89 -44.42 78.18 Favored 'General case' 0 CA--C 1.523 -0.08 0 CA-C-O 120.831 0.348 . . . . 0.0 110.375 179.274 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -52.3 -42.08 63.47 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 121.037 0.446 . . . . 0.0 110.237 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.937 HD13 HD21 ' A' ' 61' ' ' LEU . 1.6 mt -64.86 -62.98 1.24 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.655 179.346 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.52 HG23 HG23 ' A' ' 56' ' ' ILE . 49.7 m -47.47 -53.43 14.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.483 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.76 -36.55 16.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.976 178.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.529 ' ND1' HD21 ' A' ' 78' ' ' LEU . 33.4 t60 -73.26 -8.28 55.15 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.738 -179.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.459 ' CD1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.36 33.47 0.88 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.818 0.342 . . . . 0.0 110.803 -179.912 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.4 112.28 0.71 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.886 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.6 t70 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.176 -0.916 . . . . 0.0 110.896 -179.985 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.1 mttp . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.754 0.312 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.639 ' O ' HG22 ' A' ' 45' ' ' VAL . 14.4 p 41.44 32.03 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.192 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.841 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.429 ' O ' ' CD1' ' A' ' 47' ' ' TYR . 8.3 mt-10 -75.84 -44.3 41.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.816 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.531 ' CD1' HD21 ' A' ' 52' ' ' LEU . 11.9 m-85 -158.11 72.07 0.62 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.465 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.477 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 58.5 p -73.44 -53.78 9.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.615 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.762 ' HA ' HD12 ' A' ' 52' ' ' LEU . 2.5 pt-20 167.54 -39.07 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.123 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.01 -57.6 11.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.241 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.454 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.5 tp10 -59.15 -40.51 85.79 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 179.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.762 HD12 ' HA ' ' A' ' 49' ' ' GLU . 30.7 mt -59.7 -51.78 68.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.236 178.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.838 ' HA ' HD12 ' A' ' 56' ' ' ILE . 37.8 tttm -53.56 -48.26 69.29 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.1 0.476 . . . . 0.0 109.835 178.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 78.4 m -56.55 -42.12 78.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.556 178.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.454 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 7.4 m-70 -60.49 -49.65 76.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.573 178.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.838 HD12 ' HA ' ' A' ' 53' ' ' LYS . 8.6 mt -57.45 -49.31 80.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.159 179.323 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.49 -70.8 0.08 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.544 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 74.6 mttt -61.01 -77.12 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.135 -179.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 151.94 35.72 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.777 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.9 p -100.89 -13.65 18.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.715 0.293 . . . . 0.0 110.93 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.446 HD11 HD22 ' A' ' 91' ' ' LEU . 14.8 tp -58.71 -26.82 64.28 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.92 0.391 . . . . 0.0 110.47 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.721 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -87.21 5.32 85.33 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.512 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -91.03 -54.46 3.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.983 0.42 . . . . 0.0 110.185 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -48.82 148.91 1.98 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.188 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.8 p -73.35 -166.02 0.3 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.96 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.551 HG22 ' HB3' ' A' ' 84' ' ' LYS . 52.4 t -75.5 -57.34 1.64 Allowed Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.056 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.512 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 4.4 Cg_endo -47.37 -27.87 7.63 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.247 1.965 . . . . 0.0 111.869 179.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -79.24 -50.16 11.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.842 179.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.792 ' CB ' HD13 ' A' ' 87' ' ' LEU . 14.4 mt -61.5 -39.04 89.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.163 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -52.25 -44.47 64.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.989 179.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -53.76 -52.11 61.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.946 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.658 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.99 -43.09 86.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.643 179.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -40.26 88.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.641 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.12 -35.58 79.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.795 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.08 -32.63 44.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.202 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -84.92 -28.85 25.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.2 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.83 33.81 50.04 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.53 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.452 HD13 ' HB1' ' A' ' 90' ' ' ALA . 0.9 OUTLIER -82.39 178.16 8.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.833 0.349 . . . . 0.0 111.286 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -102.34 76.74 1.59 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.004 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.424 ' HB3' HD23 ' A' ' 87' ' ' LEU . 24.1 t -161.35 -163.06 0.95 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.749 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.764 ' HA2' HD21 ' A' ' 87' ' ' LEU . . . 134.8 -32.1 2.64 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.729 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mt -80.6 -73.18 0.38 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.973 0.416 . . . . 0.0 111.284 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.2 mtmm -80.45 110.16 15.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.575 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.739 ' HA ' HD12 ' A' ' 87' ' ' LEU . 10.0 ptmm? -47.06 -52.92 13.85 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.907 179.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -49.12 -37.67 22.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.134 0.492 . . . . 0.0 110.054 179.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -70.54 -33.16 70.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.932 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.792 HD13 ' CB ' ' A' ' 69' ' ' LEU . 62.5 mt -61.8 -43.48 98.76 Favored 'General case' 0 CA--C 1.52 -0.18 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.721 HD21 ' CA ' ' A' ' 62' ' ' GLY . 3.7 mp -52.93 -60.39 3.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.28 178.473 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -48.72 -47.53 41.15 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.645 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.452 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -53.62 -46.31 70.41 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.059 0.457 . . . . 0.0 110.286 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.729 HD12 ' O ' ' A' ' 87' ' ' LEU . 0.8 OUTLIER -67.15 -56.13 11.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.44 179.055 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.667 ' OG1' HG23 ' A' ' 56' ' ' ILE . 1.0 OUTLIER -50.04 -56.96 8.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.555 179.886 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.443 ' HG2' ' HA ' ' A' ' 90' ' ' ALA . 0.0 OUTLIER -50.05 -28.29 6.85 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.161 179.537 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.414 ' N ' ' HG3' ' A' ' 93' ' ' LYS . 3.0 t60 -89.86 5.35 46.61 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.818 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.555 ' CZ ' ' HD2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -146.14 11.31 1.18 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 121.02 -0.272 . . . . 0.0 111.442 179.973 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.91 118.17 16.56 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.804 0.335 . . . . 0.0 110.881 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.4 t0 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.245 -0.884 . . . . 0.0 110.86 -179.984 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.81 0.338 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 26.5 t -74.04 -44.54 50.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.035 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.418 ' O ' ' CD1' ' A' ' 47' ' ' TYR . 2.3 tt0 -165.42 -69.72 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.132 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.657 ' HB3' HD21 ' A' ' 52' ' ' LEU . 68.9 m-85 -157.42 73.89 0.74 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.792 -179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.517 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 35.6 p -74.12 -55.15 6.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.462 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.846 ' HA ' HD12 ' A' ' 52' ' ' LEU . 10.8 pt-20 170.25 -40.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.114 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -55.78 -55.24 34.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.962 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.464 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.9 tt0 -59.88 -41.6 91.95 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.152 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.846 HD12 ' HA ' ' A' ' 49' ' ' GLU . 30.4 mt -58.54 -53.42 58.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.205 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.501 ' HG2' ' CE2' ' A' ' 95' ' ' PHE . 0.8 OUTLIER -53.1 -47.56 68.48 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.068 0.461 . . . . 0.0 109.888 179.105 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.0 m -58.7 -44.76 90.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.615 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.464 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 12.8 m-70 -59.26 -50.82 72.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.815 178.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.572 HG13 HD22 ' A' ' 61' ' ' LEU . 40.9 mt -57.18 -46.26 84.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.98 179.256 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.5 m -52.45 -73.91 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.511 -179.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp -61.35 -69.01 0.26 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.956 -179.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 143.44 37.29 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.658 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 19.3 p -100.92 -13.69 18.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.545 0.212 . . . . 0.0 111.015 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.822 ' C ' HD11 ' A' ' 88' ' ' LEU . 14.5 tp -59.07 -32.06 69.44 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.009 0.433 . . . . 0.0 110.236 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.54 ' N ' HD11 ' A' ' 88' ' ' LEU . . . -80.16 6.15 60.81 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.73 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.31 -50.29 6.21 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 120.927 0.394 . . . . 0.0 110.403 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -49.11 149.22 2.06 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.348 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 31.5 p -73.71 -162.86 0.14 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.663 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.489 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 24.6 t -75.67 -59.17 1.26 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.884 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 5.4 Cg_endo -47.48 -29.39 10.11 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.275 1.984 . . . . 0.0 111.877 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -79.69 -44.84 20.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.89 179.183 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.805 HD13 ' HB2' ' A' ' 87' ' ' LEU . 15.9 mt -61.32 -48.87 79.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.129 179.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.555 ' CD ' HD21 ' A' ' 87' ' ' LEU . 20.6 mmmt -52.64 -34.11 49.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.298 179.053 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -56.3 -55.84 28.39 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.855 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.64 ' CB ' HD21 ' A' ' 91' ' ' LEU . . . -57.63 -45.55 85.27 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.994 0.426 . . . . 0.0 110.317 179.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 91.3 m -60.59 -43.12 97.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.239 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -35.08 78.36 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.546 179.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.19 -37.93 72.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.741 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -83.88 -23.28 31.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.132 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.3 24.21 29.62 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.341 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.4 mt -81.17 -174.27 4.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.788 0.327 . . . . 0.0 110.989 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.16 71.3 1.39 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.063 0.459 . . . . 0.0 110.505 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.693 ' CB ' HD23 ' A' ' 87' ' ' LEU . 3.0 m -76.52 -170.9 1.65 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.024 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.854 ' C ' HD22 ' A' ' 82' ' ' LEU . . . -116.69 -129.04 4.26 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.691 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.854 HD22 ' C ' ' A' ' 81' ' ' GLY . 2.5 mm? -147.03 9.8 0.99 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.498 0.189 . . . . 0.0 111.143 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.5 tptm -84.04 6.0 23.78 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.599 0.238 . . . . 0.0 111.23 179.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.7 mtmm 72.13 -78.34 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.518 -179.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -51.1 -32.15 21.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.901 0.381 . . . . 0.0 111.008 179.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -64.16 -40.03 95.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.919 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.805 ' HB2' HD13 ' A' ' 69' ' ' LEU . 1.2 mt -61.11 -42.78 99.16 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 179.314 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.822 HD11 ' C ' ' A' ' 61' ' ' LEU . 4.5 mm? -50.72 -53.65 29.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.502 179.006 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -50.85 -53.23 34.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.872 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -53.24 -43.29 67.2 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.133 0.492 . . . . 0.0 110.261 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.64 HD21 ' CB ' ' A' ' 72' ' ' ALA . 0.6 OUTLIER -66.11 -58.11 6.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.264 179.143 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.426 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.9 m -50.74 -59.13 4.41 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.018 179.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.4 tptm -47.63 -31.51 4.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.235 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -75.33 -44.19 46.65 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.367 -179.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.501 ' CE2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -92.81 3.68 55.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.623 -179.641 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' A' ' 92' ' ' THR . 1.4 tp-100 -73.02 143.1 47.65 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.788 0.328 . . . . 0.0 110.726 179.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.872 -179.988 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.798 0.332 . . . . 0.0 111.13 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.767 HG23 ' CE1' ' A' ' 47' ' ' TYR . 11.5 p -74.25 60.61 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.027 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -77.22 -41.06 42.76 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.232 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.767 ' CE1' HG23 ' A' ' 45' ' ' VAL . 5.3 m-30 65.7 120.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.253 0.549 . . . . 0.0 110.251 -179.189 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 61.8 p -163.61 -33.11 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.218 -179.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.636 ' HA ' HD12 ' A' ' 52' ' ' LEU . 0.0 OUTLIER 169.07 -56.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.287 179.576 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.0 -53.79 44.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.695 0.284 . . . . 0.0 110.835 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.418 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.1 tp10 -61.11 -40.77 95.02 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.886 HD22 ' CD2' ' A' ' 91' ' ' LEU . 45.2 mt -59.7 -52.33 65.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.182 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.49 ' HG2' ' CZ ' ' A' ' 95' ' ' PHE . 1.2 mmtp -52.76 -47.97 67.11 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.016 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.8 m -57.23 -45.7 83.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.271 178.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.418 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 12.9 m-70 -60.94 -52.93 62.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.828 178.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 24.7 mt -57.75 -38.45 65.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.057 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.4 t -52.31 -75.21 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.408 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -61.52 -70.48 0.19 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.946 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 150.53 34.93 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.774 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.8 p -101.96 -15.07 16.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.742 0.306 . . . . 0.0 111.022 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.854 HD13 ' O ' ' A' ' 61' ' ' LEU . 2.8 tm? -58.57 -26.72 63.9 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.895 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.454 ' HA2' HD21 ' A' ' 88' ' ' LEU . . . -93.09 2.56 71.95 Favored Glycine 0 C--N 1.33 0.242 0 C-N-CA 120.766 -0.731 . . . . 0.0 113.034 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.5 mtmm -91.87 -38.67 12.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.929 0.395 . . . . 0.0 110.586 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.44 ' CE2' ' HA ' ' A' ' 61' ' ' LEU . 28.6 m-85 -47.08 152.66 0.52 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.511 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.64 -171.56 1.06 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.014 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.496 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 69.2 t -75.83 -58.25 1.38 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.696 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 9.3 Cg_endo -52.31 -28.32 34.17 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.047 1.831 . . . . 0.0 111.489 179.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.7 mtm -79.57 -45.94 18.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.9 179.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.896 ' CB ' HD13 ' A' ' 87' ' ' LEU . 27.2 mt -61.67 -44.05 97.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.346 179.175 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.71 -36.38 46.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.732 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -55.51 -53.1 60.52 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.637 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.688 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -58.05 -44.92 87.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.575 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.474 ' SG ' HD23 ' A' ' 87' ' ' LEU . 1.7 m -58.83 -40.69 84.96 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.935 179.336 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.79 -36.53 83.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.191 179.127 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.68 -32.56 65.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.642 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.483 ' CE2' HD13 ' A' ' 52' ' ' LEU . 1.5 m-85 -82.92 -34.21 26.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.773 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 97.61 15.63 36.73 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.584 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.039 HD13 ' HB1' ' A' ' 90' ' ' ALA . 0.9 OUTLIER -81.41 159.83 24.2 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.794 0.331 . . . . 0.0 110.891 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.49 28.19 6.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.161 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.75 -173.38 3.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.874 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.476 ' HA2' HD21 ' A' ' 87' ' ' LEU . . . 117.0 -145.67 18.73 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.767 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 81' ' ' GLY . 5.2 mt 68.3 -67.77 0.19 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.022 0.439 . . . . 0.0 110.847 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -83.73 -95.63 0.06 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.909 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.44 -61.34 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.9 0.381 . . . . 0.0 109.995 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.437 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.2 OUTLIER -55.13 -46.61 75.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.702 179.128 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -44.13 -35.85 2.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.073 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.896 HD13 ' CB ' ' A' ' 69' ' ' LEU . 15.9 mt -63.04 -43.93 97.32 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.454 HD21 ' HA2' ' A' ' 62' ' ' GLY . 1.8 mp -51.76 -55.4 19.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.161 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.54 -52.13 41.58 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.817 179.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 1.039 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.68 -42.7 65.0 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 121.188 0.518 . . . . 0.0 110.055 179.273 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.886 ' CD2' HD22 ' A' ' 52' ' ' LEU . 0.4 OUTLIER -67.19 -60.32 2.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.48 178.996 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.1 m -50.03 -54.95 16.82 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.273 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 30.6 mttm -49.61 -33.06 14.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.035 179.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.481 ' CE1' ' CD1' ' A' ' 76' ' ' TYR . 2.1 t-160 -83.89 1.1 44.92 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.676 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.49 ' CZ ' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.75 22.4 1.0 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.749 0.309 . . . . 0.0 111.05 179.751 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.17 174.33 7.33 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.891 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.944 179.995 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.833 0.349 . . . . 0.0 111.186 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.8 t -73.62 -38.58 52.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.018 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 67.85 14.03 9.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.428 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.732 ' HB3' HD21 ' A' ' 52' ' ' LEU . 30.2 m-85 52.82 83.34 0.06 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.046 0.451 . . . . 0.0 111.031 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 90.5 p -74.02 -52.65 12.07 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.661 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.5 ' HA ' HD12 ' A' ' 52' ' ' LEU . 3.4 mt-10 164.31 -36.45 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.348 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -60.16 3.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.258 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.472 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.2 OUTLIER -58.72 -40.48 83.85 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.402 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.732 HD21 ' HB3' ' A' ' 47' ' ' TYR . 68.1 mt -59.47 -51.89 67.96 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.247 178.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.46 ' HG2' ' CD2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -53.5 -48.09 69.27 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.152 0.501 . . . . 0.0 109.872 179.115 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.2 m -57.8 -42.24 83.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.708 178.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.472 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 8.4 m-70 -60.07 -48.94 79.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.916 178.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 55.6 mt -57.24 -47.72 83.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.143 179.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -53.08 -73.76 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.542 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.83 -70.81 0.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.279 -179.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 144.34 36.18 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.868 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.573 HG22 ' HD2' ' A' ' 63' ' ' LYS . 0.6 OUTLIER -99.88 -10.49 21.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.705 0.288 . . . . 0.0 110.898 179.583 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.83 HD11 HD22 ' A' ' 91' ' ' LEU . 28.8 tp -59.05 -21.27 58.85 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.829 0.347 . . . . 0.0 110.507 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.742 ' CA ' HD21 ' A' ' 88' ' ' LEU . . . -90.77 16.86 57.23 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.435 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.573 ' HD2' HG22 ' A' ' 60' ' ' THR . 10.8 mtpt -89.66 -47.25 8.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.008 0.433 . . . . 0.0 110.356 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.404 ' HB2' ' HG ' ' A' ' 69' ' ' LEU . 73.1 m-85 -48.17 153.41 0.7 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.489 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.592 ' O ' HG23 ' A' ' 66' ' ' VAL . 55.0 m -74.94 -81.62 0.07 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.602 -179.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.592 HG23 ' O ' ' A' ' 65' ' ' THR . 3.8 t -160.42 -64.84 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.131 -178.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.499 ' CD ' ' HB ' ' A' ' 66' ' ' VAL . 10.2 Cg_endo -50.63 -26.11 16.29 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.264 1.976 . . . . 0.0 110.912 178.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.7 mtm -78.6 -43.2 26.98 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.535 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.604 ' HB2' HD13 ' A' ' 87' ' ' LEU . 19.8 mt -62.63 -44.34 96.54 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.457 179.06 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.3 mmtt -51.3 -34.56 33.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.656 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.446 ' HB3' ' CD2' ' A' ' 47' ' ' TYR . 2.3 tp10 -55.8 -55.44 32.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.799 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.94 88.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.96 0.41 . . . . 0.0 110.36 179.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 80.5 m -60.4 -40.94 92.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.248 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.6 ttm-85 -61.69 -36.9 82.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.133 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.43 -28.52 56.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.541 179.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.445 ' CE1' ' HG3' ' A' ' 49' ' ' GLU . 3.3 m-85 -83.02 -32.6 26.81 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.705 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.67 16.71 59.58 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.62 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.504 HD13 ' O ' ' A' ' 90' ' ' ALA . 4.0 mt -81.85 -165.61 1.02 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.877 0.37 . . . . 0.0 111.115 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -133.96 74.98 1.57 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.321 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.462 ' HG ' HD23 ' A' ' 87' ' ' LEU . 4.3 p -74.54 -176.44 2.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.288 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -113.18 165.52 12.05 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.842 -179.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -81.83 1.38 35.12 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.07 -75.54 0.24 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.721 0.296 . . . . 0.0 110.686 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.665 ' HA ' HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER 166.82 -71.41 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.593 179.531 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.533 ' HA ' HD13 ' A' ' 88' ' ' LEU . 5.7 tp60 -51.06 -30.76 16.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.852 0.358 . . . . 0.0 111.106 179.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -58.92 -39.68 82.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.746 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.665 HD12 ' HA ' ' A' ' 84' ' ' LYS . 1.1 mt -61.58 -43.94 97.94 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.742 HD21 ' CA ' ' A' ' 62' ' ' GLY . 4.0 mp -51.78 -53.91 34.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.134 178.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -50.23 -53.15 30.2 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.867 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.504 ' O ' HD13 ' A' ' 78' ' ' LEU . . . -51.89 -44.01 63.58 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.145 0.498 . . . . 0.0 110.341 179.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.83 HD22 HD11 ' A' ' 61' ' ' LEU . 0.5 OUTLIER -67.39 -57.15 7.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.352 178.981 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.2 m -50.46 -56.64 10.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.544 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -49.52 -31.06 9.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.052 179.374 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 19.1 t60 -75.76 -9.28 58.46 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.655 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.46 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -147.21 29.98 0.95 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.862 0.363 . . . . 0.0 110.955 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -72.85 178.53 4.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.807 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.9 t0 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.845 179.945 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.426 ' O ' ' CG2' ' A' ' 45' ' ' VAL . 10.7 tptt . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.778 0.323 . . . . 0.0 111.126 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.426 ' CG2' ' O ' ' A' ' 44' ' ' LYS . 61.6 t -159.97 76.34 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.583 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -75.69 -35.03 60.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.021 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.899 ' HB3' HD21 ' A' ' 52' ' ' LEU . 15.7 m-85 -81.71 64.08 6.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.899 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.12 -46.74 40.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.719 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.849 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.5 tt0 166.91 -43.02 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.386 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.1 -55.97 25.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.016 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.457 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 3.5 tt0 -59.72 -40.89 89.51 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.905 HD22 ' CD2' ' A' ' 91' ' ' LEU . 26.8 mt -59.24 -52.81 64.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.245 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.706 ' O ' HG22 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -53.89 -46.38 71.38 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 121.256 0.551 . . . . 0.0 110.126 179.2 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.9 m -59.48 -43.53 93.26 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.457 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 11.1 m-70 -60.49 -51.65 68.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.99 178.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.706 HG22 ' O ' ' A' ' 53' ' ' LYS . 8.8 tt -58.54 -44.85 90.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-O 120.841 0.353 . . . . 0.0 110.617 179.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.2 m -56.59 -63.48 1.18 Allowed 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.869 179.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.403 ' N ' ' CD ' ' A' ' 58' ' ' LYS . 8.9 mptt -62.19 -50.52 71.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.953 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.8 23.63 4.59 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.495 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 38.2 p -101.07 1.08 39.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.498 0.19 . . . . 0.0 111.512 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.609 HD23 HD23 ' A' ' 88' ' ' LEU . 47.5 tp -59.63 -26.85 65.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.778 0.323 . . . . 0.0 110.923 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.684 ' HA3' HD11 ' A' ' 88' ' ' LEU . . . -92.87 12.89 68.92 Favored Glycine 0 CA--C 1.518 0.267 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.738 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -91.67 -51.55 5.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.851 0.358 . . . . 0.0 110.676 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -46.78 158.11 0.13 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.166 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 26.4 p -72.84 -167.83 0.41 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.886 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.873 HG12 ' HD3' ' A' ' 70' ' ' LYS . 55.9 t -76.76 -59.58 0.95 Allowed Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.209 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.522 ' HA ' ' CD ' ' A' ' 70' ' ' LYS . 3.8 Cg_endo -46.42 -29.68 7.42 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.526 2.151 . . . . 0.0 112.144 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 29.4 mtm -79.2 -44.72 21.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.167 0.508 . . . . 0.0 109.993 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.718 ' HB2' HD13 ' A' ' 87' ' ' LEU . 29.6 mt -64.73 -55.64 18.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.071 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.873 ' HD3' HG12 ' A' ' 66' ' ' VAL . 0.0 OUTLIER -51.19 -27.3 8.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.748 0.309 . . . . 0.0 110.784 179.865 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -57.53 -53.05 62.54 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.586 179.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.682 ' CB ' HD21 ' A' ' 91' ' ' LEU . . . -59.01 -48.32 82.0 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.986 0.422 . . . . 0.0 110.357 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.403 ' CB ' ' HB2' ' A' ' 78' ' ' LEU . 90.8 m -61.33 -40.73 95.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.666 179.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -61.77 -36.22 80.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.675 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.19 -44.87 64.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.611 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -88.71 10.02 22.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.574 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.37 44.67 76.56 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.86 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.696 HD12 ' HB1' ' A' ' 90' ' ' ALA . 3.6 mm? -81.33 -177.95 6.71 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.827 0.346 . . . . 0.0 110.919 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.44 -43.87 7.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.826 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.678 ' HB2' HD23 ' A' ' 87' ' ' LEU . 8.2 p 45.99 -164.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.367 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.42 ' N ' ' HB3' ' A' ' 86' ' ' GLU . . . -137.88 -108.71 0.86 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.727 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -160.49 -31.35 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -65.96 0.88 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.689 0.281 . . . . 0.0 111.205 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.821 ' HA ' HD12 ' A' ' 87' ' ' LEU . 0.8 OUTLIER 173.36 -64.57 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.102 179.99 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.543 ' HA ' HD12 ' A' ' 88' ' ' LEU . 29.8 tt0 -46.9 -34.89 5.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.876 0.37 . . . . 0.0 111.189 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.42 ' HB3' ' N ' ' A' ' 81' ' ' GLY . 3.7 mm-40 -59.91 -44.57 94.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.565 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.821 HD12 ' HA ' ' A' ' 84' ' ' LYS . 1.3 mt -61.78 -43.04 99.64 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.684 HD11 ' HA3' ' A' ' 62' ' ' GLY . 3.8 mt -50.64 -50.99 53.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.425 178.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -51.05 -54.61 23.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.105 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.696 ' HB1' HD12 ' A' ' 78' ' ' LEU . . . -55.12 -43.4 74.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.95 0.405 . . . . 0.0 110.909 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.905 ' CD2' HD22 ' A' ' 52' ' ' LEU . 0.8 OUTLIER -69.12 -49.02 60.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.498 179.438 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.574 HG22 ' N ' ' A' ' 93' ' ' LYS . 0.7 OUTLIER -52.4 -61.32 2.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.711 -179.988 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.654 ' HD2' HD11 ' A' ' 78' ' ' LEU . 0.0 OUTLIER -48.87 -28.38 3.72 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.731 0.301 . . . . 0.0 111.058 179.557 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 -72.89 -23.6 60.74 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.262 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.506 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -148.06 45.13 1.08 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.889 0.376 . . . . 0.0 111.014 -179.856 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.466 ' HB2' HD11 ' A' ' 56' ' ' ILE . 0.1 OUTLIER -167.36 98.91 0.51 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.937 179.885 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.956 -179.99 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.423 ' O ' ' CG2' ' A' ' 45' ' ' VAL . 19.8 mtmt . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.792 0.329 . . . . 0.0 111.141 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.423 ' CG2' ' O ' ' A' ' 44' ' ' LYS . 52.7 t -160.15 -53.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.547 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 75.59 9.15 3.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.343 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.406 ' HB3' HD21 ' A' ' 52' ' ' LEU . 24.8 m-85 51.04 63.73 2.12 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.987 0.422 . . . . 0.0 111.128 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.508 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 91.2 p -72.28 -52.83 14.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.283 179.642 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.852 ' HA ' HD12 ' A' ' 52' ' ' LEU . 1.8 pt-20 165.4 -34.68 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.009 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -60.13 4.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.062 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.441 ' HG3' ' CE1' ' A' ' 55' ' ' HIS . 0.1 OUTLIER -59.23 -39.75 83.71 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.251 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.852 HD12 ' HA ' ' A' ' 49' ' ' GLU . 22.3 mt -60.21 -51.56 69.07 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.155 178.767 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.493 ' HA ' HD12 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -53.72 -48.39 69.65 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.86 179.045 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.1 m -57.89 -45.09 86.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.605 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.443 ' HB3' ' CA ' ' A' ' 61' ' ' LEU . 14.8 m-70 -59.56 -51.01 71.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.808 178.83 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.493 HD12 ' HA ' ' A' ' 53' ' ' LYS . 20.3 mt -56.84 -45.12 83.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.844 179.325 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.4 m -52.94 -70.74 0.08 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.352 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 23.6 mttp -61.56 -79.75 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.029 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 157.49 33.26 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.885 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 17.0 p -102.77 -12.46 17.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.734 0.302 . . . . 0.0 111.037 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.857 HD13 ' O ' ' A' ' 61' ' ' LEU . 3.1 tm? -59.65 -27.09 66.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.802 0.334 . . . . 0.0 110.81 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.499 ' HA2' HD21 ' A' ' 88' ' ' LEU . . . -90.22 11.13 71.98 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.755 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.74 -47.01 7.59 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.879 0.371 . . . . 0.0 110.557 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -47.43 146.6 1.99 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.388 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.57 ' O ' HD12 ' A' ' 69' ' ' LEU . 32.6 p -73.71 -169.84 0.77 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.118 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.563 HG22 ' CA ' ' A' ' 84' ' ' LYS . 78.8 t -76.4 -56.24 1.54 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.507 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.534 ' HA ' ' CD ' ' A' ' 70' ' ' LYS . 5.5 Cg_endo -48.29 -35.94 28.53 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.341 2.027 . . . . 0.0 112.233 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 26.9 mtp -81.69 -34.34 30.72 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.78 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.877 ' CB ' HD13 ' A' ' 87' ' ' LEU . 7.5 mt -63.04 -52.89 61.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.572 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.534 ' CD ' ' HA ' ' A' ' 67' ' ' PRO . 0.5 OUTLIER -49.45 -29.87 7.22 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.868 0.366 . . . . 0.0 111.026 -179.663 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.418 ' N ' ' HG2' ' A' ' 70' ' ' LYS . 2.0 tt0 -57.32 -55.34 36.08 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.357 179.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.426 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -58.91 -40.2 83.81 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.29 179.139 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.723 ' SG ' HD23 ' A' ' 87' ' ' LEU . 7.7 m -60.12 -40.58 90.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.391 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.94 -36.43 81.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.466 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.87 -32.74 59.84 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.63 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.499 ' CD2' ' CG ' ' A' ' 94' ' ' HIS . 3.2 m-30 -84.17 -23.91 30.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.971 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 82.36 23.76 55.87 Favored Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.492 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' A' ' 73' ' ' CYS . 1.4 mt -81.81 170.48 15.65 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.922 0.392 . . . . 0.0 111.155 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -111.47 81.16 1.4 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.76 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -159.5 -171.22 3.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.084 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.62 ' HA2' HD21 ' A' ' 87' ' ' LEU . . . 109.38 48.54 0.8 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.667 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -158.51 19.24 0.22 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.586 0.232 . . . . 0.0 111.576 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.432 ' HB3' ' HB2' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -159.15 6.49 0.1 Allowed 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -179.915 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.563 ' CA ' HG22 ' A' ' 66' ' ' VAL . 16.5 ttpp 69.13 -82.4 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.604 0.24 . . . . 0.0 110.895 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.673 ' HA ' HD22 ' A' ' 88' ' ' LEU . 34.1 tt0 -49.04 -45.38 42.65 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.897 0.379 . . . . 0.0 111.249 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.432 ' HB2' ' HB3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -47.28 -39.38 14.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.902 179.978 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.877 HD13 ' CB ' ' A' ' 69' ' ' LEU . 1.7 mt -62.57 -43.93 97.58 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.27 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.673 HD22 ' HA ' ' A' ' 85' ' ' GLN . 1.2 mp -51.97 -53.55 40.09 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.139 178.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -50.79 -52.97 35.83 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.812 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.48 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -52.85 -43.83 66.34 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.02 0.438 . . . . 0.0 110.496 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.724 HD13 HD11 ' A' ' 61' ' ' LEU . 0.7 OUTLIER -66.29 -54.87 19.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.425 179.341 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.419 HG22 ' N ' ' A' ' 93' ' ' LYS . 0.9 OUTLIER -50.58 -59.41 4.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.373 179.802 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.419 ' N ' HG22 ' A' ' 92' ' ' THR . 1.5 ptmm? -48.24 -31.2 5.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.214 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.499 ' CG ' ' CD2' ' A' ' 76' ' ' TYR . 51.3 t-80 -74.26 -17.9 60.8 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.712 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.484 ' CD1' ' CE ' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -146.87 38.04 0.99 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.945 0.402 . . . . 0.0 110.855 -179.831 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.401 ' NE2' ' CG2' ' A' ' 92' ' ' THR . 1.7 tt0 -72.31 -167.05 0.29 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.876 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.4 t70 . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.895 179.945 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.45 ' O ' HG12 ' A' ' 45' ' ' VAL . 9.2 ptpt . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.495 0.188 . . . . 0.0 111.099 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.616 ' O ' HG22 ' A' ' 45' ' ' VAL . 13.2 p 43.24 30.27 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.14 0 CA-C-O 120.996 0.427 . . . . 0.0 111.375 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.97 -33.89 59.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.087 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.454 ' HB3' HD21 ' A' ' 52' ' ' LEU . 28.0 m-85 59.13 46.4 13.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.988 0.423 . . . . 0.0 110.718 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.405 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 1.1 p -72.05 -42.83 65.81 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.637 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.866 ' HA ' HD12 ' A' ' 52' ' ' LEU . 3.4 mt-10 163.79 -43.94 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.536 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.0 -56.28 21.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.173 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.455 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 1.0 OUTLIER -60.02 -40.33 88.94 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.327 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.866 HD12 ' HA ' ' A' ' 49' ' ' GLU . 19.8 mt -59.9 -51.73 68.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.247 178.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.877 ' HA ' HD12 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -54.07 -47.84 71.25 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-O 121.073 0.463 . . . . 0.0 109.938 179.071 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.5 m -57.81 -42.61 84.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.685 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.455 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 11.7 m-70 -59.61 -49.29 78.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.829 178.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.877 HD12 ' HA ' ' A' ' 53' ' ' LYS . 6.9 mt -57.36 -48.36 82.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.988 179.313 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 2.4 m -53.78 -63.54 1.12 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.54 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 30.4 mttm -60.85 -46.45 90.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.254 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 116.98 20.78 4.76 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.692 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 21.8 p -97.87 -8.44 28.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.613 0.244 . . . . 0.0 111.047 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.729 ' O ' HD22 ' A' ' 88' ' ' LEU . 3.4 tm? -58.87 -29.37 66.94 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.654 0.264 . . . . 0.0 110.378 179.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.575 ' HA2' HD22 ' A' ' 88' ' ' LEU . . . -85.0 10.67 62.29 Favored Glycine 0 CA--C 1.52 0.387 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.536 179.52 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -95.48 -40.71 9.33 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.781 0.324 . . . . 0.0 111.641 -179.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -44.74 144.74 1.06 Allowed 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -179.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.629 ' O ' HD12 ' A' ' 69' ' ' LEU . 15.8 p -74.24 -171.68 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.54 179.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.516 ' HB ' ' HD3' ' A' ' 67' ' ' PRO . 70.6 t -76.81 -46.23 3.0 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.65 -179.625 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.516 ' HD3' ' HB ' ' A' ' 66' ' ' VAL . 39.6 Cg_exo -60.42 -30.28 90.54 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.13 1.887 . . . . 0.0 111.952 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . 0.412 ' N ' ' HE3' ' A' ' 68' ' ' MET . 0.0 OUTLIER -81.45 -39.15 25.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.301 179.656 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.949 HD21 HD23 ' A' ' 88' ' ' LEU . 11.5 mt -61.01 -40.96 95.53 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.147 179.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -52.33 -42.0 63.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.949 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.39 -53.52 56.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.411 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.993 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -56.26 -50.36 71.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.942 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -59.58 -37.43 78.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.194 179.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -62.46 -37.74 87.08 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.161 179.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.88 -27.99 49.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.744 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -82.09 -37.94 25.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.939 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 100.75 18.19 21.29 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.923 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.48 HD13 ' HB1' ' A' ' 90' ' ' ALA . 21.0 mt -81.15 -166.71 1.21 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.696 0.284 . . . . 0.0 110.737 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.428 ' O ' ' O ' ' A' ' 80' ' ' SER . 0.2 OUTLIER -96.26 -43.85 7.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.774 179.813 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.428 ' O ' ' O ' ' A' ' 79' ' ' LYS . 0.0 OUTLIER 57.71 138.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.434 179.527 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.414 ' O ' ' HB2' ' A' ' 82' ' ' LEU . . . 147.17 -165.93 28.55 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.231 -0.985 . . . . 0.0 113.086 179.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.602 ' N ' HD12 ' A' ' 82' ' ' LEU . 4.7 mp 68.83 -67.4 0.21 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.961 0.41 . . . . 0.0 110.793 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.65 152.85 16.43 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.248 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.729 ' HA ' HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -44.37 -54.61 5.68 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.895 179.548 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.923 ' HA ' HD12 ' A' ' 88' ' ' LEU . 3.8 tt0 -46.19 -43.65 15.4 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.014 0.435 . . . . 0.0 110.3 179.238 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -60.91 -42.2 97.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.504 178.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.729 HD12 ' HA ' ' A' ' 84' ' ' LYS . 26.6 mt -62.72 -54.25 42.12 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 178.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.949 HD23 HD21 ' A' ' 69' ' ' LEU . 4.3 mt -53.44 -52.07 60.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.679 178.369 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.37 -49.21 70.36 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.572 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.48 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -51.83 -42.69 62.75 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 121.128 0.49 . . . . 0.0 110.01 179.303 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.993 HD21 ' HB1' ' A' ' 72' ' ' ALA . 0.4 OUTLIER -64.82 -62.46 1.55 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.247 178.887 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 18.0 m -49.55 -57.51 6.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.101 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -47.06 -30.8 2.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.138 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -65.83 -52.92 46.45 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.627 -179.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.486 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -90.91 -9.82 44.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.799 -179.386 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -73.3 64.18 0.78 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.863 0.363 . . . . 0.0 110.908 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.017 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.824 0.345 . . . . 0.0 111.161 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 22.0 t -74.53 62.47 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.165 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -75.75 -58.79 3.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.859 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.739 ' HB3' HD21 ' A' ' 52' ' ' LEU . 22.4 m-85 -81.88 68.43 8.25 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.729 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.557 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 78.9 p -71.18 -55.54 7.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.424 179.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.64 ' HA ' HD12 ' A' ' 52' ' ' LEU . 4.6 pt-20 170.38 -37.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.446 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -57.46 -55.28 36.9 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.703 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.444 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 2.1 tt0 -61.35 -41.56 97.25 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.006 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.739 HD21 ' HB3' ' A' ' 47' ' ' TYR . 43.3 mt -59.65 -50.58 73.29 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.14 178.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.491 ' HG2' ' CD2' ' A' ' 95' ' ' PHE . 0.0 OUTLIER -52.58 -49.86 64.16 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.011 178.957 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 94.5 m -59.3 -42.42 91.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.012 179.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.444 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 12.5 m-70 -58.44 -50.04 75.13 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 36.8 mt -58.27 -56.86 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.514 178.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.9 p -67.36 46.59 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.117 179.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -175.6 -58.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.744 0.307 . . . . 0.0 111.019 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 125.25 24.2 1.65 Allowed Glycine 0 CA--C 1.518 0.257 0 C-N-CA 120.659 -0.782 . . . . 0.0 113.036 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.7 -11.92 20.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.599 0.238 . . . . 0.0 111.097 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.963 HD11 HD13 ' A' ' 91' ' ' LEU . 17.8 tp -58.81 -22.61 58.87 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.815 0.34 . . . . 0.0 110.602 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -91.05 19.37 46.62 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.343 179.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.41 -58.34 2.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.037 0.446 . . . . 0.0 110.214 179.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -49.54 152.32 1.4 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.397 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 22.4 p -74.14 -167.09 0.47 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.881 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.569 HG13 HD11 ' A' ' 87' ' ' LEU . 55.3 t -77.14 -57.42 1.12 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.276 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.508 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 6.2 Cg_endo -48.89 -31.42 19.95 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.358 2.039 . . . . 0.0 112.139 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 45.8 mtm -79.46 -39.54 31.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.249 179.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.781 HD13 ' HB2' ' A' ' 87' ' ' LEU . 8.8 mt -61.12 -39.69 90.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.631 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.74 -36.77 58.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.891 179.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -55.52 -52.49 63.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.925 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.828 ' HB1' HD21 ' A' ' 91' ' ' LEU . . . -57.58 -42.85 83.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.731 179.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.54 ' HA ' HD12 ' A' ' 78' ' ' LEU . 8.8 m -59.84 -38.91 83.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.681 179.664 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 mtt-85 -62.07 -36.33 81.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.671 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -81.14 -29.89 34.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.082 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CD2' ' CG ' ' A' ' 94' ' ' HIS . 2.8 m-30 -84.82 -25.64 27.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.105 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.59 21.73 49.88 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.592 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.54 HD12 ' HA ' ' A' ' 73' ' ' CYS . 2.8 mt -81.27 -175.93 5.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.866 0.365 . . . . 0.0 110.961 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.2 tmtt? -97.47 -40.35 8.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.029 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.547 ' HB2' HD23 ' A' ' 87' ' ' LEU . 0.0 OUTLIER 69.68 173.52 0.3 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.768 -179.987 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -138.23 -130.27 2.78 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.588 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 82' ' ' LEU . 12.3 mt -159.18 53.1 0.39 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.004 0.43 . . . . 0.0 110.744 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.15 10.16 0.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.803 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 75.03 -71.94 0.12 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.816 0.341 . . . . 0.0 110.755 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.401 ' HA ' ' HG ' ' A' ' 88' ' ' LEU . 0.5 OUTLIER -47.33 -34.81 7.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.405 179.947 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -62.04 -45.29 94.24 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.057 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.781 ' HB2' HD13 ' A' ' 69' ' ' LEU . 1.2 mt -60.96 -42.62 98.63 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.573 HD21 HD11 ' A' ' 69' ' ' LEU . 6.8 mt -52.61 -53.28 48.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.273 178.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.78 -52.47 40.54 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.799 179.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.417 ' HB1' HD13 ' A' ' 78' ' ' LEU . . . -53.12 -45.03 68.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.005 0.431 . . . . 0.0 110.52 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.963 HD13 HD11 ' A' ' 61' ' ' LEU . 3.1 mt -66.52 -53.8 30.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.347 179.202 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.45 HG22 ' N ' ' A' ' 93' ' ' LYS . 0.9 OUTLIER -51.5 -60.49 3.08 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.448 179.859 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.45 ' N ' HG22 ' A' ' 92' ' ' THR . 1.6 pttt -48.12 -28.96 3.21 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.801 0.334 . . . . 0.0 110.975 179.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.5 ' CG ' ' CD2' ' A' ' 76' ' ' TYR . 27.5 t-80 -67.54 -58.49 4.62 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.673 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.491 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -95.82 22.4 7.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.256 179.887 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -72.13 141.06 49.14 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.809 0.338 . . . . 0.0 110.72 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.877 -179.933 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.438 ' O ' ' CG2' ' A' ' 45' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.668 0.27 . . . . 0.0 111.194 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.438 ' CG2' ' O ' ' A' ' 44' ' ' LYS . 63.4 t -160.49 84.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.667 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -75.38 -6.8 51.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.379 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.678 ' HB3' HD21 ' A' ' 52' ' ' LEU . 25.7 m-85 65.68 57.06 0.87 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.017 0.436 . . . . 0.0 110.811 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.524 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 5.6 p -72.4 -53.13 13.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.356 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.871 ' HA ' HD12 ' A' ' 52' ' ' LEU . 2.8 pt-20 169.01 -35.03 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.207 179.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.52 -58.29 8.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.812 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.45 ' O ' ' CG ' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -60.07 -41.59 92.74 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.208 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.871 HD12 ' HA ' ' A' ' 49' ' ' GLU . 14.0 mt -60.36 -49.52 77.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.013 178.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.626 ' HA ' HD12 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -53.29 -49.27 67.32 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.096 179.208 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.52 -44.76 89.65 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.553 179.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.45 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 8.1 m-70 -60.13 -51.12 70.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.815 178.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.626 HD12 ' HA ' ' A' ' 53' ' ' LYS . 8.7 mt -56.66 -45.49 82.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.939 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -53.61 -73.96 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.221 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 48.3 mttt -62.18 -75.56 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.078 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 149.77 37.71 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.738 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.2 p -100.89 -8.81 22.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.656 0.265 . . . . 0.0 111.066 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.42 ' CA ' ' HB3' ' A' ' 55' ' ' HIS . 16.1 tp -58.79 -23.77 60.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.812 0.339 . . . . 0.0 110.694 179.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.796 ' HA2' HD11 ' A' ' 88' ' ' LEU . . . -91.42 14.07 64.82 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.367 179.542 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 17.2 tttt -92.28 -55.81 3.28 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.934 0.397 . . . . 0.0 110.407 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -48.0 154.54 0.53 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.307 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.3 p -73.67 -167.32 0.45 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.929 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.579 HG22 ' HA ' ' A' ' 84' ' ' LYS . 56.0 t -77.03 -57.94 1.08 Allowed Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.256 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.504 ' HD2' ' N ' ' A' ' 66' ' ' VAL . 5.2 Cg_endo -47.83 -30.25 12.9 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.34 2.026 . . . . 0.0 112.054 179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 33.1 mtm -80.33 -46.88 15.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.271 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.912 ' HB2' HD13 ' A' ' 87' ' ' LEU . 36.1 mt -61.14 -46.11 91.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.449 179.381 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.437 ' N ' HD22 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -51.95 -32.1 31.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.54 179.272 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.42 ' HB3' ' CD2' ' A' ' 47' ' ' TYR . 0.0 OUTLIER -56.76 -54.92 40.71 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.891 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.675 ' CB ' HD21 ' A' ' 91' ' ' LEU . . . -57.12 -46.9 82.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.974 0.416 . . . . 0.0 110.372 179.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 57.3 m -61.01 -44.06 97.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.338 179.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.1 mmt180 -63.15 -34.3 77.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.67 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.86 -38.08 73.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.846 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.503 ' CD1' ' CE1' ' A' ' 94' ' ' HIS . 4.5 m-85 -84.28 -28.63 27.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.035 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.94 26.57 11.33 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.605 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.485 HD23 ' HB3' ' A' ' 76' ' ' TYR . 4.4 mm? -81.09 176.41 9.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.793 0.33 . . . . 0.0 110.912 -179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.92 -33.07 11.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.799 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.566 ' HB2' HD23 ' A' ' 87' ' ' LEU . 3.9 p 48.33 -173.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.418 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -124.92 160.4 19.55 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.47 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 35.4 mt -80.85 -4.5 54.98 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -80.38 -73.55 0.36 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.677 0.275 . . . . 0.0 110.768 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.749 ' O ' HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER 167.84 -67.32 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.978 179.851 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.573 ' HA ' HD13 ' A' ' 88' ' ' LEU . 0.0 OUTLIER -54.5 -38.13 66.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.041 0.448 . . . . 0.0 110.681 179.76 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -45.13 -31.64 1.5 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.432 -179.065 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.912 HD13 ' HB2' ' A' ' 69' ' ' LEU . 2.3 mt -62.46 -40.72 97.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.099 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.796 HD11 ' HA2' ' A' ' 62' ' ' GLY . 5.1 mp -50.92 -53.64 30.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.38 178.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -49.74 -54.52 18.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.956 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.475 ' HB1' ' HG ' ' A' ' 78' ' ' LEU . . . -51.49 -44.54 62.52 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.199 0.524 . . . . 0.0 110.121 179.303 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.833 ' CD2' HD22 ' A' ' 52' ' ' LEU . 0.4 OUTLIER -66.75 -58.2 5.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.755 179.16 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.416 ' O ' ' N ' ' A' ' 96' ' ' GLN . 1.3 m -49.35 -53.95 19.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.298 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.92 -31.12 4.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.12 179.264 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.503 ' CE1' ' CD1' ' A' ' 76' ' ' TYR . 2.5 t60 -76.44 -16.55 59.66 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.704 -179.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.474 ' CD2' ' HG2' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -146.78 36.12 0.95 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.819 0.343 . . . . 0.0 110.998 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.416 ' N ' ' O ' ' A' ' 92' ' ' THR . 2.8 pt20 -77.89 24.13 0.24 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.985 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.904 179.979 . . . . . . . . 0 0 . 1 stop_ save_