data_1zwb_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 1zwb _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.654 ' CD1' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.942 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -138.79 -65.56 0.49 Allowed 'General case' 0 N--CA 1.512 2.63 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.354 -178.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.2 t -143.53 -78.41 0.22 Allowed 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.253 -0.904 . . . . 0.0 109.529 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.411 ' O ' HG11 ' A' ' 20' ' ' VAL . 6.1 mmm -67.9 -26.82 66.18 Favored 'General case' 0 N--CA 1.518 2.927 0 O-C-N 121.381 -0.824 . . . . 0.0 109.499 177.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -76.78 -47.97 20.03 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 105.531 -2.026 . . . . 0.0 105.531 174.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.654 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -53.09 -17.22 1.43 Allowed 'General case' 0 N--CA 1.514 2.743 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 -179.886 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.412 ' HA ' HD22 ' A' ' 23' ' ' LEU . 5.3 p -78.52 -39.27 23.28 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.743 0 C-N-CA 119.411 -0.916 . . . . 0.0 110.093 178.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -52.75 -35.44 56.2 Favored 'General case' 0 N--CA 1.519 3.016 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.591 ' HB2' ' CD2' ' A' ' 14' ' ' LEU . 54.0 t90 -60.88 -56.01 26.25 Favored 'General case' 0 N--CA 1.507 2.41 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 176.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -60.41 -28.93 68.64 Favored 'General case' 0 N--CA 1.505 2.292 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.149 178.871 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.404 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -75.33 -47.63 26.87 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.621 -0.674 . . . . 0.0 109.29 178.912 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.25 -24.94 64.06 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 122.148 -0.345 . . . . 0.0 110.994 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.03 -40.39 75.19 Favored 'General case' 0 N--CA 1.507 2.418 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tt -67.34 -39.89 85.82 Favored 'General case' 0 N--CA 1.503 2.192 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 176.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -78.52 -1.59 34.63 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 122.058 -0.401 . . . . 0.0 111.346 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -88.43 -34.32 17.55 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.44 -1.412 . . . . 0.0 107.812 176.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 84.0 t -52.83 -32.02 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.807 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.172 0 O-C-N 122.186 -0.321 . . . . 0.0 111.244 -177.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.713 ' CG ' ' HA ' ' A' ' 19' ' ' ARG . 17.4 tp . . . . . 0 N--CA 1.499 1.981 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -163.83 152.82 13.93 Favored 'General case' 0 N--CA 1.514 2.733 0 O-C-N 121.609 -0.682 . . . . 0.0 112.084 -178.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.7 t 52.52 -136.54 1.34 Allowed 'General case' 0 N--CA 1.514 2.764 0 C-N-CA 122.991 0.516 . . . . 0.0 111.916 178.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.492 ' O ' HG11 ' A' ' 20' ' ' VAL . 0.1 OUTLIER -56.64 -34.51 67.37 Favored 'General case' 0 N--CA 1.519 2.976 0 O-C-N 121.085 -1.009 . . . . 0.0 111.524 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.441 ' O ' HD12 ' A' ' 14' ' ' LEU . 22.2 mt-10 -59.94 -43.64 94.86 Favored 'General case' 0 N--CA 1.513 2.702 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 177.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.713 ' HA ' ' CG ' ' A' ' 14' ' ' LEU . 20.9 ttt85 -61.6 -11.6 12.13 Favored 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.492 HG11 ' O ' ' A' ' 17' ' ' MET . 1.1 p -98.3 -37.21 6.29 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.725 0 C-N-CA 119.053 -1.059 . . . . 0.0 110.651 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -59.65 -40.4 87.58 Favored 'General case' 0 N--CA 1.514 2.769 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 177.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.651 ' HB2' HD12 ' A' ' 14' ' ' LEU . 7.8 t90 -61.36 -59.79 4.73 Favored 'General case' 0 N--CA 1.501 2.099 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 177.072 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.406 HD21 ' HA ' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -59.1 -30.79 68.36 Favored 'General case' 0 N--CA 1.506 2.368 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.233 179.432 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -72.83 -44.23 61.7 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.1 tptp -69.1 -47.03 66.26 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.905 -0.497 . . . . 0.0 110.165 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.49 -42.03 86.64 Favored 'General case' 0 N--CA 1.515 2.777 0 CA-C-O 120.822 0.344 . . . . 0.0 110.297 179.146 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -69.24 -35.3 76.0 Favored 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 176.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -83.16 14.91 3.13 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.657 -0.652 . . . . 0.0 111.179 178.027 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -108.18 -51.35 2.91 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.087 -1.008 . . . . 0.0 110.318 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 t -102.42 23.32 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.514 2.731 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.085 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 74.4 m80 . . . . . 0 N--CA 1.513 2.699 0 O-C-N 120.961 -1.087 . . . . 0.0 110.296 179.702 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.602 ' CD1' ' HB2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.508 2.433 0 CA-C-O 120.772 0.32 . . . . 0.0 111.321 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -52.89 14.63 Favored 'General case' 0 N--CA 1.507 2.381 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.539 ' HB3' HG21 ' A' ' 20' ' ' VAL . 0.5 OUTLIER 171.63 -96.0 0.0 OUTLIER 'General case' 0 C--O 1.174 -2.882 0 CA-C-O 116.657 -1.64 . . . . 0.0 107.893 178.287 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.433 ' HA ' ' HB ' ' A' ' 20' ' ' VAL . 3.0 ttm -24.21 -43.19 0.01 OUTLIER 'General case' 0 N--CA 1.539 4.0 0 CA-C-N 121.584 1.993 . . . . 0.0 116.254 -177.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -51.37 -41.54 60.72 Favored 'General case' 0 N--CA 1.534 3.754 0 CA-C-O 122.464 1.126 . . . . 0.0 108.741 176.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.727 ' HB3' ' CB ' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -117.7 -64.93 1.23 Allowed 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 125.3 1.44 . . . . 0.0 108.251 177.332 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.539 HG21 ' HB3' ' A' ' 16' ' ' SER . 0.3 OUTLIER 62.19 -53.76 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.518 2.968 0 C-N-CA 127.195 2.198 . . . . 0.0 112.087 175.491 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.16 -26.71 51.53 Favored 'General case' 0 N--CA 1.524 3.264 0 N-CA-C 104.842 -2.281 . . . . 0.0 104.842 169.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.727 ' CB ' ' HB3' ' A' ' 19' ' ' ARG 0.255 18.8 t90 -55.41 -57.52 11.51 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 126.826 2.051 . . . . 0.0 108.316 173.433 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 20' ' ' VAL . 0.5 OUTLIER -59.63 -28.92 67.64 Favored 'General case' 0 N--CA 1.511 2.597 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.761 178.741 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.91 -39.91 55.35 Favored 'General case' 0 N--CA 1.508 2.46 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 11.5 tttp -83.22 -4.3 58.26 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 122.074 -0.391 . . . . 0.0 111.648 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.403 ' HD3' ' CZ2' ' A' ' 22' ' ' TRP . 0.8 OUTLIER -58.23 -47.73 82.61 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 121.453 -0.779 . . . . 0.0 109.801 179.897 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 pp -67.49 -36.73 81.67 Favored 'General case' 0 N--CA 1.511 2.585 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 176.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -92.87 53.28 1.98 Allowed 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -142.63 -51.33 0.37 Allowed 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.658 -0.651 . . . . 0.0 110.072 -178.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.8 t -95.76 34.98 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.622 0 CA-C-O 121.561 0.696 . . . . 0.0 109.514 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 7.1 t60 . . . . . 0 N--CA 1.503 2.185 0 O-C-N 121.2 -0.938 . . . . 0.0 109.644 179.912 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.711 ' CD1' ' HA ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.504 2.268 0 CA-C-O 120.698 0.285 . . . . 0.0 111.432 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.602 ' CB ' ' HB2' ' A' ' 18' ' ' GLU . 1.3 m-20 70.52 159.36 0.19 Allowed 'General case' 0 N--CA 1.528 3.433 0 O-C-N 120.93 -1.106 . . . . 0.0 111.119 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.3 m -66.24 -75.89 0.09 Allowed 'General case' 0 N--CA 1.519 2.993 0 O-C-N 121.343 -0.848 . . . . 0.0 112.015 -177.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.511 ' O ' HG11 ' A' ' 20' ' ' VAL . 0.3 OUTLIER -68.26 -22.93 64.73 Favored 'General case' 0 N--CA 1.516 2.869 0 O-C-N 121.196 -0.94 . . . . 0.0 110.435 179.475 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.602 ' HB2' ' CB ' ' A' ' 15' ' ' ASN . 4.6 mt-10 -65.81 -37.92 87.56 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 175.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.711 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . 0.1 OUTLIER -59.17 -35.06 72.89 Favored 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -179.936 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.511 HG11 ' O ' ' A' ' 17' ' ' MET . 0.9 OUTLIER -79.61 -43.21 23.23 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.113 0 C-N-CA 118.216 -1.394 . . . . 0.0 110.312 -178.938 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -56.17 -40.03 73.28 Favored 'General case' 0 N--CA 1.511 2.576 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 177.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.618 ' HB2' HD12 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -68.96 -70.05 0.29 Allowed 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 176.891 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.482 ' HA ' ' HB2' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -39.61 -33.17 0.16 Allowed 'General case' 0 N--CA 1.518 2.953 0 C-N-CA 123.333 0.653 . . . . 0.0 112.102 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.18 -50.56 72.64 Favored 'General case' 0 N--CA 1.509 2.483 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 177.115 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -31.39 67.03 Favored 'General case' 0 N--CA 1.504 2.273 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 175.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.616 ' HD2' ' CE3' ' A' ' 22' ' ' TRP . 1.5 tttm -62.68 -32.4 73.46 Favored 'General case' 0 N--CA 1.52 3.037 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 178.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tt -74.47 -44.61 50.77 Favored 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 176.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -68.14 -8.16 36.06 Favored 'General case' 0 N--CA 1.519 3.021 0 O-C-N 122.172 -0.33 . . . . 0.0 111.379 176.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.83 -37.93 76.35 Favored 'General case' 0 C--N 1.31 -1.11 0 C-N-CA 119.702 -0.799 . . . . 0.0 108.876 178.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.5 t -90.55 43.26 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.331 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 173.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 77.3 m80 . . . . . 0 N--CA 1.503 2.209 0 C-N-CA 124.107 0.963 . . . . 0.0 112.316 -177.892 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.608 ' HB3' ' CA ' ' A' ' 19' ' ' ARG . 59.3 mt . . . . . 0 N--CA 1.494 1.734 0 CA-C-O 121.958 0.885 . . . . 0.0 110.432 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -160.86 -83.24 0.04 OUTLIER 'General case' 0 N--CA 1.51 2.569 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.75 179.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.7 t -128.66 -63.0 1.0 Allowed 'General case' 0 N--CA 1.506 2.356 0 CA-C-N 119.411 1.005 . . . . 0.0 109.414 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.704 ' HA ' ' CG2' ' A' ' 20' ' ' VAL . 32.9 mmt -92.12 -10.1 40.14 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.482 -0.761 . . . . 0.0 109.77 177.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.509 ' HB3' HD21 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -81.26 -50.1 9.95 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 105.335 -2.098 . . . . 0.0 105.335 174.564 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.608 ' CA ' ' HB3' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -54.16 -27.66 35.09 Favored 'General case' 0 N--CA 1.514 2.729 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.639 178.013 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.704 ' CG2' ' HA ' ' A' ' 17' ' ' MET . 33.8 m -86.88 -45.23 16.46 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.142 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.914 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -50.26 -41.18 50.0 Favored 'General case' 0 N--CA 1.52 3.075 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 176.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.571 ' HB2' HD23 ' A' ' 14' ' ' LEU . 28.0 t90 -60.41 -58.33 8.96 Favored 'General case' 0 N--CA 1.508 2.464 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 176.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.413 ' CD1' ' C ' ' A' ' 23' ' ' LEU . 0.0 OUTLIER -55.46 -31.3 61.84 Favored 'General case' 0 N--CA 1.509 2.498 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.175 178.604 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 -80.66 -46.67 15.24 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.764 -0.585 . . . . 0.0 109.931 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.54 -31.09 72.15 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.775 -0.578 . . . . 0.0 110.792 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.422 ' HD3' ' CE3' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -65.17 -41.4 94.68 Favored 'General case' 0 N--CA 1.51 2.55 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 178.661 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.61 -41.96 68.27 Favored 'General case' 0 N--CA 1.504 2.261 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 176.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -21.68 66.75 Favored 'General case' 0 N--CA 1.505 2.293 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 178.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.14 -43.9 97.81 Favored 'General case' 0 N--CA 1.506 2.356 0 CA-C-O 121.045 0.45 . . . . 0.0 110.372 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 38.6 t -75.11 -31.91 25.65 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 178.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 17.3 m80 . . . . . 0 N--CA 1.512 2.673 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 179.173 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.601 ' HB3' ' CA ' ' A' ' 19' ' ' ARG . 3.8 mt . . . . . 0 N--CA 1.51 2.535 0 CA-C-O 121.334 0.588 . . . . 0.0 112.051 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -148.96 -65.15 0.23 Allowed 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.673 -0.642 . . . . 0.0 111.272 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.3 t -139.45 -97.52 0.16 Allowed 'General case' 0 N--CA 1.512 2.657 0 CA-C-N 119.413 1.006 . . . . 0.0 110.331 -179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.664 ' HA ' ' CG2' ' A' ' 20' ' ' VAL . 5.3 ttt -70.74 -13.23 61.98 Favored 'General case' 0 N--CA 1.519 2.986 0 CA-C-N 119.826 1.194 . . . . 0.0 110.358 178.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.409 ' O ' HD23 ' A' ' 14' ' ' LEU . 1.9 mm-40 -76.21 -51.87 11.21 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 103.697 -2.705 . . . . 0.0 103.697 174.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.601 ' CA ' ' HB3' ' A' ' 14' ' ' LEU . 1.4 tmm_? -51.21 -31.02 19.01 Favored 'General case' 0 N--CA 1.506 2.33 0 CA-C-N 114.262 -1.335 . . . . 0.0 112.53 177.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.664 ' CG2' ' HA ' ' A' ' 17' ' ' MET . 29.6 m -85.17 -47.41 16.97 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.216 0 C-N-CA 119.601 -0.839 . . . . 0.0 111.596 -177.602 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -52.57 -39.39 61.47 Favored 'General case' 0 N--CA 1.523 3.224 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 176.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.6 ' HB2' HD23 ' A' ' 14' ' ' LEU . 8.4 t90 -64.84 -59.1 4.59 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 176.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.438 ' HB3' ' HA ' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -50.24 -35.04 25.16 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 124.26 1.024 . . . . 0.0 110.154 178.212 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.43 -49.1 23.78 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.894 -0.504 . . . . 0.0 109.936 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.4 tptp -64.93 -41.77 95.25 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.927 -0.483 . . . . 0.0 110.807 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.515 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -64.28 -43.29 95.24 Favored 'General case' 0 N--CA 1.511 2.601 0 CA-C-O 120.911 0.386 . . . . 0.0 110.408 179.643 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.34 -40.16 93.29 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.424 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 32.9 tp60 -70.08 -28.23 65.26 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 122.078 -0.389 . . . . 0.0 111.137 178.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -68.62 -47.26 67.1 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-O 121.48 0.657 . . . . 0.0 109.386 178.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.9 t -90.18 20.48 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.51 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.361 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.161 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 177.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.619 HD23 ' HB2' ' A' ' 22' ' ' TRP . 87.2 mt . . . . . 0 N--CA 1.501 2.125 0 CA-C-O 122.372 1.082 . . . . 0.0 112.648 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -167.68 -52.54 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.757 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.944 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.8 p -153.63 -91.1 0.05 OUTLIER 'General case' 0 N--CA 1.511 2.589 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.691 ' HA ' ' CG2' ' A' ' 20' ' ' VAL . 2.3 mmt -72.41 -14.82 61.79 Favored 'General case' 0 N--CA 1.514 2.775 0 CA-C-N 119.343 0.974 . . . . 0.0 109.068 176.282 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.602 ' HB3' HD21 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -72.47 -55.67 6.62 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 103.871 -2.64 . . . . 0.0 103.871 173.375 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.593 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -49.79 -28.62 6.52 Favored 'General case' 0 N--CA 1.508 2.443 0 CA-C-N 114.058 -1.428 . . . . 0.0 112.687 178.499 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.691 ' CG2' ' HA ' ' A' ' 17' ' ' MET . 32.7 m -87.13 -48.95 15.17 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.152 0 C-N-CA 119.308 -0.957 . . . . 0.0 111.213 -178.316 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.435 ' HA ' ' HD2' ' A' ' 24' ' ' ARG . 0.5 OUTLIER -51.26 -35.74 38.73 Favored 'General case' 0 N--CA 1.514 2.766 0 N-CA-C 107.85 -1.166 . . . . 0.0 107.85 176.171 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.662 ' CE3' ' HG2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -67.89 -73.52 0.14 Allowed 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 106.513 -1.662 . . . . 0.0 106.513 175.124 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.587 ' HA ' ' HG3' ' A' ' 26' ' ' LYS . 0.4 OUTLIER -39.7 -30.06 0.07 Allowed 'General case' 0 N--CA 1.511 2.612 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -178.898 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.435 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -59.23 -40.66 86.58 Favored 'General case' 0 N--CA 1.512 2.655 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 176.026 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? -85.15 -17.18 38.02 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 123.416 0.686 . . . . 0.0 111.561 177.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.662 ' HG2' ' CE3' ' A' ' 22' ' ' TRP . 0.2 OUTLIER -71.16 -38.12 72.2 Favored 'General case' 0 N--CA 1.525 3.292 0 O-C-N 121.473 -0.767 . . . . 0.0 109.969 179.314 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 tp -71.38 -48.13 51.85 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 177.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -66.81 -15.94 63.94 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 122.309 -0.244 . . . . 0.0 111.289 177.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.98 -46.57 87.06 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.932 -0.48 . . . . 0.0 110.547 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 17.2 t -81.85 -8.23 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.2 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 . . . . . 0 N--CA 1.505 2.322 0 O-C-N 121.338 -0.851 . . . . 0.0 109.448 179.169 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.632 ' CD1' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.511 2.589 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -148.43 -66.52 0.24 Allowed 'General case' 0 N--CA 1.515 2.783 0 O-C-N 121.241 -0.912 . . . . 0.0 111.311 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.0 t -141.26 -79.2 0.26 Allowed 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.437 -0.789 . . . . 0.0 109.124 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.6 tmm? -69.1 -26.1 64.75 Favored 'General case' 0 N--CA 1.514 2.75 0 O-C-N 121.365 -0.835 . . . . 0.0 109.329 177.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.455 ' HB3' ' HB3' ' A' ' 14' ' ' LEU . 27.3 mt-10 -76.89 -46.85 22.94 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 174.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.632 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . 0.1 OUTLIER -53.36 -19.25 3.21 Favored 'General case' 0 N--CA 1.516 2.843 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 179.843 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.448 ' HA ' HD21 ' A' ' 23' ' ' LEU . 4.0 p -79.14 -33.34 15.72 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.534 0 C-N-CA 119.53 -0.868 . . . . 0.0 109.788 178.007 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -54.44 -35.12 62.64 Favored 'General case' 0 N--CA 1.516 2.831 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 175.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.523 ' CH2' ' HD3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -63.56 -79.95 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 105.534 -2.024 . . . . 0.0 105.534 175.205 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.448 HD21 ' HA ' ' A' ' 20' ' ' VAL . 0.2 OUTLIER -40.88 -30.19 0.12 Allowed 'General case' 0 N--CA 1.5 2.04 0 C-N-CA 123.466 0.706 . . . . 0.0 112.674 -179.837 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 34.9 mtm180 -64.57 -46.53 82.33 Favored 'General case' 0 N--CA 1.512 2.655 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 177.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.8 tptp -65.66 -43.0 90.71 Favored 'General case' 0 N--CA 1.501 2.091 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.523 ' HD3' ' CH2' ' A' ' 22' ' ' TRP . 8.0 ttpp -56.89 -43.0 80.87 Favored 'General case' 0 N--CA 1.517 2.897 0 CA-C-O 121.208 0.528 . . . . 0.0 110.327 178.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -71.42 -40.53 70.4 Favored 'General case' 0 N--CA 1.505 2.301 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -67.85 -26.51 66.07 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.936 -0.478 . . . . 0.0 110.604 178.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -65.73 -52.53 50.49 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.1 p -72.21 -20.19 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.454 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.073 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.505 2.303 0 O-C-N 121.905 -0.497 . . . . 0.0 110.119 178.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.571 ' CD1' ' HA ' ' A' ' 16' ' ' SER . 0.9 OUTLIER . . . . . 0 N--CA 1.507 2.418 0 CA-C-O 120.703 0.287 . . . . 0.0 110.845 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -77.88 -43.78 29.12 Favored 'General case' 0 N--CA 1.504 2.231 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 176.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.571 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . 28.7 t 150.52 -57.62 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.851 0 C-N-CA 125.155 1.382 . . . . 0.0 107.694 177.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.1 mmt -58.52 -30.37 67.01 Favored 'General case' 0 N--CA 1.526 3.334 0 CA-C-N 121.357 1.889 . . . . 0.0 107.972 175.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.444 ' HB3' ' HD3' ' A' ' 19' ' ' ARG . 2.0 tt0 -55.9 -46.74 78.29 Favored 'General case' 0 N--CA 1.503 2.224 0 CA-C-O 122.396 1.093 . . . . 0.0 109.38 174.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.564 ' HD3' ' HB3' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -142.24 68.11 1.32 Allowed 'General case' 0 C--N 1.305 -1.346 0 CA-C-O 123.353 1.549 . . . . 0.0 109.391 -176.512 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.409 ' N ' ' O ' ' A' ' 16' ' ' SER . 11.5 p -90.7 -41.84 13.63 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.557 0 N-CA-C 105.874 -1.899 . . . . 0.0 105.874 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.49 -33.45 68.03 Favored 'General case' 0 N--CA 1.511 2.581 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 173.064 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.544 ' HB3' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -53.45 -58.17 8.08 Favored 'General case' 0 N--CA 1.519 3.017 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 174.923 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.5 mt -55.97 -44.75 78.83 Favored 'General case' 0 N--CA 1.51 2.568 0 CA-C-N 114.742 -1.117 . . . . 0.0 109.269 178.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.1 ttm105 -63.92 -48.74 75.36 Favored 'General case' 0 N--CA 1.513 2.701 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.205 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -66.83 -39.37 87.65 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.832 -0.542 . . . . 0.0 110.912 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.452 ' HD3' ' CE3' ' A' ' 22' ' ' TRP . 2.5 mptp? -61.93 -33.6 74.55 Favored 'General case' 0 N--CA 1.513 2.68 0 CA-C-O 120.734 0.302 . . . . 0.0 110.563 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.25 -43.36 70.7 Favored 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 176.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 22.3 tp60 -66.32 -25.28 66.75 Favored 'General case' 0 N--CA 1.504 2.248 0 O-C-N 122.087 -0.383 . . . . 0.0 111.271 178.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -62.24 -55.75 25.32 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.891 -0.506 . . . . 0.0 109.872 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 27.6 m -65.06 -26.21 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.979 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.619 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 . . . . . 0 N--CA 1.509 2.479 0 O-C-N 121.965 -0.459 . . . . 0.0 110.885 179.14 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.643 ' CD2' ' HB2' ' A' ' 22' ' ' TRP . 17.1 mt . . . . . 0 N--CA 1.5 2.047 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 56.75 110.2 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.977 0 C-N-CA 125.029 1.332 . . . . 0.0 111.718 -176.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.3 t 80.02 -142.84 0.02 OUTLIER 'General case' 0 N--CA 1.525 3.28 0 C-N-CA 123.753 0.821 . . . . 0.0 111.538 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.694 ' HA ' ' CG2' ' A' ' 20' ' ' VAL . 5.4 mmm -61.92 -11.42 13.02 Favored 'General case' 0 N--CA 1.524 3.266 0 O-C-N 120.904 -1.123 . . . . 0.0 112.928 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.434 ' HB2' ' O ' ' A' ' 14' ' ' LEU . 8.9 mm-40 -74.18 -55.13 6.43 Favored 'General case' 0 N--CA 1.503 2.185 0 N-CA-C 103.841 -2.651 . . . . 0.0 103.841 174.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.588 ' CA ' ' HB3' ' A' ' 14' ' ' LEU . 2.0 tmt_? -49.78 -27.79 5.41 Favored 'General case' 0 N--CA 1.507 2.384 0 CA-C-N 114.088 -1.415 . . . . 0.0 112.865 177.368 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.694 ' CG2' ' HA ' ' A' ' 17' ' ' MET . 23.3 m -88.82 -47.34 15.28 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.012 0 C-N-CA 119.491 -0.884 . . . . 0.0 111.598 -178.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -51.77 -34.16 38.38 Favored 'General case' 0 N--CA 1.518 2.931 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 176.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.643 ' HB2' ' CD2' ' A' ' 14' ' ' LEU . 14.9 t90 -61.55 -60.4 3.76 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 176.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.57 -31.18 61.96 Favored 'General case' 0 N--CA 1.507 2.378 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.545 178.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -77.62 -45.19 25.85 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.792 -0.568 . . . . 0.0 109.755 179.22 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.4 tptp -67.09 -34.02 76.73 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 122.047 -0.408 . . . . 0.0 111.078 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -44.62 95.06 Favored 'General case' 0 N--CA 1.513 2.708 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.54 -41.45 75.92 Favored 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 177.027 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -68.24 -18.94 64.69 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 122.017 -0.427 . . . . 0.0 111.502 178.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -73.64 -45.64 51.56 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.626 -0.671 . . . . 0.0 110.132 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.9 t -93.29 21.03 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.615 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.936 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 45.2 m80 . . . . . 0 N--CA 1.508 2.468 0 O-C-N 120.93 -1.106 . . . . 0.0 109.41 178.946 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 59.2 t . . . . . 0 N--CA 1.504 2.25 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.6 t 86.31 -20.72 0.23 Allowed 'General case' 0 N--CA 1.526 3.352 0 C-N-CA 123.429 0.691 . . . . 0.0 112.621 -179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -90.58 51.28 1.97 Allowed 'General case' 0 N--CA 1.509 2.513 0 CA-C-O 121.697 0.76 . . . . 0.0 108.999 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.471 HG13 ' HB2' ' A' ' 7' ' ' MET . 1.1 pt -63.2 176.8 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.516 2.847 0 O-C-N 121.813 -0.554 . . . . 0.0 111.339 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -47.87 -51.37 23.29 Favored 'General case' 0 N--CA 1.518 2.926 0 O-C-N 121.653 -0.655 . . . . 0.0 111.716 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.98 -42.07 85.72 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.814 -0.554 . . . . 0.0 110.284 179.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.471 ' HB2' HG13 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -62.5 -50.94 69.4 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.946 -0.471 . . . . 0.0 109.851 179.511 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.4 ' HA ' ' CE1' ' A' ' 13' ' ' HIS . 0.5 OUTLIER -60.13 -35.8 76.09 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 122.084 -0.385 . . . . 0.0 110.214 178.649 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -65.85 -23.34 66.65 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.983 -0.448 . . . . 0.0 110.788 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.422 ' HG ' ' HE2' ' A' ' 26' ' ' LYS . 7.1 tp -61.93 109.98 1.42 Allowed 'General case' 0 N--CA 1.504 2.272 0 CA-C-N 118.87 0.759 . . . . 0.0 109.596 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 56.69 28.09 56.18 Favored Glycine 0 N--CA 1.511 3.649 0 N-CA-C 109.919 -1.272 . . . . 0.0 109.919 -176.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 50.7 13.31 0.13 Allowed 'General case' 0 N--CA 1.523 3.177 0 C-N-CA 124.295 1.038 . . . . 0.0 112.91 -177.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.4 ' CE1' ' HA ' ' A' ' 8' ' ' HIS . 4.8 m170 63.6 123.62 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.352 0 CA-C-O 122.279 1.038 . . . . 0.0 109.279 -177.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.654 ' CD1' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -130.83 -158.3 0.88 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.454 -0.779 . . . . 0.0 112.702 -172.847 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -138.79 -65.56 0.49 Allowed 'General case' 0 N--CA 1.512 2.63 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.354 -178.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.2 t -143.53 -78.41 0.22 Allowed 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.253 -0.904 . . . . 0.0 109.529 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.411 ' O ' HG11 ' A' ' 20' ' ' VAL . 6.1 mmm -67.9 -26.82 66.18 Favored 'General case' 0 N--CA 1.518 2.927 0 O-C-N 121.381 -0.824 . . . . 0.0 109.499 177.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -76.78 -47.97 20.03 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 105.531 -2.026 . . . . 0.0 105.531 174.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.654 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -53.09 -17.22 1.43 Allowed 'General case' 0 N--CA 1.514 2.743 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 -179.886 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.412 ' HA ' HD22 ' A' ' 23' ' ' LEU . 5.3 p -78.52 -39.27 23.28 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.743 0 C-N-CA 119.411 -0.916 . . . . 0.0 110.093 178.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -52.75 -35.44 56.2 Favored 'General case' 0 N--CA 1.519 3.016 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.591 ' HB2' ' CD2' ' A' ' 14' ' ' LEU . 54.0 t90 -60.88 -56.01 26.25 Favored 'General case' 0 N--CA 1.507 2.41 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 176.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -60.41 -28.93 68.64 Favored 'General case' 0 N--CA 1.505 2.292 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.149 178.871 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.404 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -75.33 -47.63 26.87 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.621 -0.674 . . . . 0.0 109.29 178.912 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.25 -24.94 64.06 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 122.148 -0.345 . . . . 0.0 110.994 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.422 ' HE2' ' HG ' ' A' ' 10' ' ' LEU . 0.1 OUTLIER -70.03 -40.39 75.19 Favored 'General case' 0 N--CA 1.507 2.418 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.422 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tt -67.34 -39.89 85.82 Favored 'General case' 0 N--CA 1.503 2.192 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 176.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.432 ' O ' ' HA ' ' A' ' 32' ' ' ASN . 57.1 tt0 -78.52 -1.59 34.63 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 122.058 -0.401 . . . . 0.0 111.346 177.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -88.43 -34.32 17.55 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.44 -1.412 . . . . 0.0 107.812 176.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 84.0 t -52.83 -32.02 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.807 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -164.38 28.56 0.07 Allowed 'General case' 0 N--CA 1.502 2.172 0 O-C-N 122.186 -0.321 . . . . 0.0 111.244 -177.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.432 ' HA ' ' O ' ' A' ' 28' ' ' GLN . 13.1 t-20 55.27 36.77 27.76 Favored 'General case' 0 N--CA 1.513 2.705 0 N-CA-C 105.041 -2.207 . . . . 0.0 105.041 -172.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -84.86 82.84 8.26 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-N 114.189 -1.369 . . . . 0.0 110.341 -176.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 8.0 p -47.9 123.82 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 CA-C-O 122.603 1.192 . . . . 0.0 111.543 -178.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -99.65 -147.52 0.34 Allowed 'General case' 0 N--CA 1.493 1.694 0 CA-C-N 114.262 -1.335 . . . . 0.0 108.684 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.512 2.639 0 CA-C-O 117.549 -1.215 . . . . 0.0 110.898 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 11.6 p . . . . . 0 N--CA 1.502 2.138 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 t 66.91 -178.94 0.21 Allowed 'General case' 0 N--CA 1.515 2.797 0 CA-C-O 121.085 0.469 . . . . 0.0 110.578 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -104.79 41.42 1.33 Allowed 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.518 -0.739 . . . . 0.0 109.677 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.1 pt -140.08 82.55 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.392 0 O-C-N 121.442 -0.787 . . . . 0.0 109.532 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -123.96 -64.84 1.11 Allowed 'General case' 0 N--CA 1.503 2.204 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.36 -45.82 78.83 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.642 -0.661 . . . . 0.0 109.224 178.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 49.5 mtt -93.65 59.03 2.8 Favored 'General case' 0 N--CA 1.503 2.204 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 178.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -173.98 -47.88 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.693 -0.629 . . . . 0.0 109.814 -179.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.448 ' HB3' ' CE1' ' A' ' 13' ' ' HIS . 5.1 m120 -64.08 -45.53 88.28 Favored 'General case' 0 N--CA 1.504 2.232 0 CA-C-O 119.405 -0.331 . . . . 0.0 111.211 -179.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.71 116.35 2.08 Favored 'General case' 0 N--CA 1.517 2.898 0 CA-C-N 118.679 0.672 . . . . 0.0 110.444 -179.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 96.93 -45.67 1.79 Allowed Glycine 0 N--CA 1.506 3.338 0 N-CA-C 109.337 -1.505 . . . . 0.0 109.337 -178.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -53.84 24.21 Favored 'General case' 0 N--CA 1.509 2.518 0 CA-C-N 118.039 0.919 . . . . 0.0 108.869 178.589 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.448 ' CE1' ' HB3' ' A' ' 9' ' ' ASN . 0.8 OUTLIER -78.87 -2.94 42.19 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.898 -0.502 . . . . 0.0 110.903 177.706 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.713 ' CG ' ' HA ' ' A' ' 19' ' ' ARG . 17.4 tp -60.65 131.63 51.32 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.453 -0.779 . . . . 0.0 109.762 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -163.83 152.82 13.93 Favored 'General case' 0 N--CA 1.514 2.733 0 O-C-N 121.609 -0.682 . . . . 0.0 112.084 -178.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.7 t 52.52 -136.54 1.34 Allowed 'General case' 0 N--CA 1.514 2.764 0 C-N-CA 122.991 0.516 . . . . 0.0 111.916 178.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.492 ' O ' HG11 ' A' ' 20' ' ' VAL . 0.1 OUTLIER -56.64 -34.51 67.37 Favored 'General case' 0 N--CA 1.519 2.976 0 O-C-N 121.085 -1.009 . . . . 0.0 111.524 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.441 ' O ' HD12 ' A' ' 14' ' ' LEU . 22.2 mt-10 -59.94 -43.64 94.86 Favored 'General case' 0 N--CA 1.513 2.702 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 177.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.713 ' HA ' ' CG ' ' A' ' 14' ' ' LEU . 20.9 ttt85 -61.6 -11.6 12.13 Favored 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.492 HG11 ' O ' ' A' ' 17' ' ' MET . 1.1 p -98.3 -37.21 6.29 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.725 0 C-N-CA 119.053 -1.059 . . . . 0.0 110.651 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -59.65 -40.4 87.58 Favored 'General case' 0 N--CA 1.514 2.769 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 177.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.651 ' HB2' HD12 ' A' ' 14' ' ' LEU . 7.8 t90 -61.36 -59.79 4.73 Favored 'General case' 0 N--CA 1.501 2.099 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 177.072 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.406 HD21 ' HA ' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -59.1 -30.79 68.36 Favored 'General case' 0 N--CA 1.506 2.368 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.233 179.432 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -72.83 -44.23 61.7 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.1 tptp -69.1 -47.03 66.26 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.905 -0.497 . . . . 0.0 110.165 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.49 -42.03 86.64 Favored 'General case' 0 N--CA 1.515 2.777 0 CA-C-O 120.822 0.344 . . . . 0.0 110.297 179.146 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -69.24 -35.3 76.0 Favored 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 176.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -83.16 14.91 3.13 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.657 -0.652 . . . . 0.0 111.179 178.027 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -108.18 -51.35 2.91 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.087 -1.008 . . . . 0.0 110.318 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 t -102.42 23.32 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.514 2.731 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.085 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 74.4 m80 -139.92 -46.61 0.44 Allowed 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.961 -1.087 . . . . 0.0 110.296 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -76.82 86.02 3.41 Favored 'General case' 0 N--CA 1.503 2.178 0 CA-C-O 121.419 0.628 . . . . 0.0 109.675 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -160.1 107.38 1.63 Allowed 'General case' 0 N--CA 1.502 2.163 0 N-CA-C 109.344 -0.614 . . . . 0.0 109.344 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 21.3 t 70.76 133.45 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.517 2.898 0 CA-C-O 121.633 0.73 . . . . 0.0 110.322 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -154.22 138.18 16.34 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.75 -0.593 . . . . 0.0 109.429 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.518 2.949 0 CA-C-O 117.504 -1.236 . . . . 0.0 110.411 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 2.3 m . . . . . 0 N--CA 1.504 2.273 0 CA-C-O 121.281 0.562 . . . . 0.0 109.597 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.0 t -159.47 -148.14 0.17 Allowed 'General case' 0 N--CA 1.506 2.368 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 62.77 27.95 16.28 Favored 'General case' 0 N--CA 1.517 2.879 0 O-C-N 121.49 -0.757 . . . . 0.0 111.14 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -163.37 148.2 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.309 0 O-C-N 121.218 -0.926 . . . . 0.0 109.256 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 75.59 -55.08 0.63 Allowed 'General case' 0 N--CA 1.516 2.841 0 C-N-CA 122.887 0.475 . . . . 0.0 110.482 -179.389 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.7 tt -56.76 -48.42 77.9 Favored 'General case' 0 N--CA 1.512 2.647 0 CA-C-N 119.03 0.832 . . . . 0.0 109.411 178.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 8.1 mtt -61.06 -40.12 92.43 Favored 'General case' 0 N--CA 1.508 2.45 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 56.4 m-70 -68.72 -41.26 79.28 Favored 'General case' 0 N--CA 1.509 2.524 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -74.29 -10.93 60.08 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 122.008 -0.432 . . . . 0.0 111.77 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.38 -149.21 0.04 OUTLIER 'General case' 0 N--CA 1.508 2.425 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 178.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.86 59.95 4.18 Favored Glycine 0 N--CA 1.511 3.678 0 O-C-N 120.3 -1.5 . . . . 0.0 109.68 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.93 20.55 2.84 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 122.108 -0.642 . . . . 0.0 110.537 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -168.84 43.74 0.03 OUTLIER 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.307 -0.87 . . . . 0.0 109.985 179.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.602 ' CD1' ' HB2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -104.46 -178.26 3.6 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 120.835 -1.166 . . . . 0.0 111.321 -179.489 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -52.89 14.63 Favored 'General case' 0 N--CA 1.507 2.381 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.539 ' HB3' HG21 ' A' ' 20' ' ' VAL . 0.5 OUTLIER 171.63 -96.0 0.0 OUTLIER 'General case' 0 C--O 1.174 -2.882 0 CA-C-O 116.657 -1.64 . . . . 0.0 107.893 178.287 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.433 ' HA ' ' HB ' ' A' ' 20' ' ' VAL . 3.0 ttm -24.21 -43.19 0.01 OUTLIER 'General case' 0 N--CA 1.539 4.0 0 CA-C-N 121.584 1.993 . . . . 0.0 116.254 -177.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -51.37 -41.54 60.72 Favored 'General case' 0 N--CA 1.534 3.754 0 CA-C-O 122.464 1.126 . . . . 0.0 108.741 176.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.727 ' HB3' ' CB ' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -117.7 -64.93 1.23 Allowed 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 125.3 1.44 . . . . 0.0 108.251 177.332 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.539 HG21 ' HB3' ' A' ' 16' ' ' SER . 0.3 OUTLIER 62.19 -53.76 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.518 2.968 0 C-N-CA 127.195 2.198 . . . . 0.0 112.087 175.491 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.16 -26.71 51.53 Favored 'General case' 0 N--CA 1.524 3.264 0 N-CA-C 104.842 -2.281 . . . . 0.0 104.842 169.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.727 ' CB ' ' HB3' ' A' ' 19' ' ' ARG 0.255 18.8 t90 -55.41 -57.52 11.51 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 126.826 2.051 . . . . 0.0 108.316 173.433 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 20' ' ' VAL . 0.5 OUTLIER -59.63 -28.92 67.64 Favored 'General case' 0 N--CA 1.511 2.597 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.761 178.741 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.91 -39.91 55.35 Favored 'General case' 0 N--CA 1.508 2.46 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 11.5 tttp -83.22 -4.3 58.26 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 122.074 -0.391 . . . . 0.0 111.648 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.403 ' HD3' ' CZ2' ' A' ' 22' ' ' TRP . 0.8 OUTLIER -58.23 -47.73 82.61 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 121.453 -0.779 . . . . 0.0 109.801 179.897 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 pp -67.49 -36.73 81.67 Favored 'General case' 0 N--CA 1.511 2.585 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 176.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -92.87 53.28 1.98 Allowed 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -142.63 -51.33 0.37 Allowed 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.658 -0.651 . . . . 0.0 110.072 -178.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.8 t -95.76 34.98 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.622 0 CA-C-O 121.561 0.696 . . . . 0.0 109.514 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -163.89 -50.95 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.2 -0.938 . . . . 0.0 109.644 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -111.95 -49.69 2.96 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 122.07 -0.394 . . . . 0.0 110.466 -179.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 23.0 t80 56.36 53.21 9.02 Favored 'General case' 0 N--CA 1.508 2.432 0 CA-C-O 121.743 0.782 . . . . 0.0 109.847 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 2.2 m -144.72 87.37 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.375 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . 179.92 180.0 0.5 Allowed 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.2 mp . . . . . 0 N--CA 1.505 2.312 0 CA-C-O 117.683 -1.151 . . . . 0.0 109.382 179.111 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 21.7 t . . . . . 0 N--CA 1.503 2.216 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 57.8 m -98.94 139.6 34.35 Favored 'General case' 0 N--CA 1.503 2.193 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -126.02 53.34 1.61 Allowed 'General case' 0 N--CA 1.501 2.076 0 CA-C-O 121.536 0.684 . . . . 0.0 109.772 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.432 ' O ' ' HB2' ' A' ' 5' ' ' GLN . 14.4 tt -64.2 154.42 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.604 0 O-C-N 121.344 -0.847 . . . . 0.0 109.138 178.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.432 ' HB2' ' O ' ' A' ' 4' ' ' ILE . 1.4 mp0 75.97 -54.29 0.61 Allowed 'General case' 0 N--CA 1.519 3.017 0 C-N-CA 123.054 0.541 . . . . 0.0 110.0 -178.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.98 -52.42 42.91 Favored 'General case' 0 N--CA 1.506 2.361 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 178.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 35.8 mtt -67.75 -32.72 73.51 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.539 -0.726 . . . . 0.0 109.043 177.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.402 ' HA ' ' HG3' ' A' ' 12' ' ' LYS . 50.8 t-80 -75.18 -16.08 60.53 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.94 -0.475 . . . . 0.0 111.804 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 24.1 m120 -133.57 -61.94 0.79 Allowed 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.796 -1.19 . . . . 0.0 110.755 -178.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.8 tt -66.82 103.28 1.08 Allowed 'General case' 0 N--CA 1.506 2.326 0 CA-C-O 121.532 0.682 . . . . 0.0 109.705 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.43 ' HA2' ' HG3' ' A' ' 19' ' ' ARG . . . 77.76 15.56 81.12 Favored Glycine 0 N--CA 1.5 2.91 0 CA-C-O 119.403 -0.665 . . . . 0.0 111.621 -179.207 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.402 ' HG3' ' HA ' ' A' ' 8' ' ' HIS . 0.0 OUTLIER -66.18 -37.9 86.74 Favored 'General case' 0 N--CA 1.508 2.463 0 CA-C-N 119.714 1.757 . . . . 0.0 109.037 178.38 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -73.76 -29.35 62.16 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 122.179 -0.325 . . . . 0.0 111.623 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.711 ' CD1' ' HA ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -120.85 27.74 8.32 Favored 'General case' 0 N--CA 1.504 2.268 0 CA-C-N 118.84 0.745 . . . . 0.0 111.432 -178.221 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.602 ' CB ' ' HB2' ' A' ' 18' ' ' GLU . 1.3 m-20 70.52 159.36 0.19 Allowed 'General case' 0 N--CA 1.528 3.433 0 O-C-N 120.93 -1.106 . . . . 0.0 111.119 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.3 m -66.24 -75.89 0.09 Allowed 'General case' 0 N--CA 1.519 2.993 0 O-C-N 121.343 -0.848 . . . . 0.0 112.015 -177.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.511 ' O ' HG11 ' A' ' 20' ' ' VAL . 0.3 OUTLIER -68.26 -22.93 64.73 Favored 'General case' 0 N--CA 1.516 2.869 0 O-C-N 121.196 -0.94 . . . . 0.0 110.435 179.475 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.602 ' HB2' ' CB ' ' A' ' 15' ' ' ASN . 4.6 mt-10 -65.81 -37.92 87.56 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 175.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.711 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . 0.1 OUTLIER -59.17 -35.06 72.89 Favored 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -179.936 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.511 HG11 ' O ' ' A' ' 17' ' ' MET . 0.9 OUTLIER -79.61 -43.21 23.23 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.113 0 C-N-CA 118.216 -1.394 . . . . 0.0 110.312 -178.938 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -56.17 -40.03 73.28 Favored 'General case' 0 N--CA 1.511 2.576 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 177.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.618 ' HB2' HD12 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -68.96 -70.05 0.29 Allowed 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 176.891 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.482 ' HA ' ' HB2' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -39.61 -33.17 0.16 Allowed 'General case' 0 N--CA 1.518 2.953 0 C-N-CA 123.333 0.653 . . . . 0.0 112.102 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.18 -50.56 72.64 Favored 'General case' 0 N--CA 1.509 2.483 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 177.115 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -31.39 67.03 Favored 'General case' 0 N--CA 1.504 2.273 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 175.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.616 ' HD2' ' CE3' ' A' ' 22' ' ' TRP . 1.5 tttm -62.68 -32.4 73.46 Favored 'General case' 0 N--CA 1.52 3.037 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 178.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tt -74.47 -44.61 50.77 Favored 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 176.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.727 ' HA ' ' HB2' ' A' ' 32' ' ' ASN . 22.9 mt-30 -68.14 -8.16 36.06 Favored 'General case' 0 N--CA 1.519 3.021 0 O-C-N 122.172 -0.33 . . . . 0.0 111.379 176.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.83 -37.93 76.35 Favored 'General case' 0 C--N 1.31 -1.11 0 C-N-CA 119.702 -0.799 . . . . 0.0 108.876 178.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.5 t -90.55 43.26 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.331 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 173.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 77.3 m80 64.11 8.61 4.14 Favored 'General case' 0 N--CA 1.503 2.209 0 C-N-CA 124.107 0.963 . . . . 0.0 112.316 -177.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.727 ' HB2' ' HA ' ' A' ' 28' ' ' GLN . 8.8 t-20 64.57 49.51 2.35 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 -179.041 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -85.13 91.24 8.07 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.146 -178.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.5 p -150.67 129.18 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 CA-C-O 121.577 0.703 . . . . 0.0 109.183 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -159.38 138.46 11.12 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.332 0.586 . . . . 0.0 109.593 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.7 tp . . . . . 0 N--CA 1.504 2.23 0 CA-C-O 117.661 -1.161 . . . . 0.0 110.207 -179.981 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 41.9 t . . . . . 0 N--CA 1.506 2.333 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.3 m 73.17 139.52 0.06 Allowed 'General case' 0 N--CA 1.52 3.032 0 C-N-CA 123.002 0.521 . . . . 0.0 110.36 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 58.08 37.43 26.47 Favored 'General case' 0 N--CA 1.517 2.901 0 CA-C-O 121.156 0.503 . . . . 0.0 110.38 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.67 ' HA ' ' HB3' ' A' ' 8' ' ' HIS . 1.1 pt -162.65 79.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.517 2.914 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.1 pm0 -97.66 56.71 1.31 Allowed 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.908 -178.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.6 tp 51.84 41.95 29.71 Favored 'General case' 0 N--CA 1.521 3.086 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 -177.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.7 mtp -174.27 -59.24 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 -174.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.67 ' HB3' ' HA ' ' A' ' 4' ' ' ILE . 5.6 t-160 -64.21 -19.41 65.33 Favored 'General case' 0 CA--C 1.567 1.626 0 CA-C-N 114.308 -1.315 . . . . 0.0 109.328 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.469 ' HB2' ' HB ' ' A' ' 4' ' ' ILE . 5.6 t-20 -81.15 -33.26 33.24 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.262 -0.899 . . . . 0.0 109.524 176.106 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.462 ' HB3' ' HA ' ' A' ' 13' ' ' HIS . 8.4 mp -83.64 133.81 34.81 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.506 -0.746 . . . . 0.0 110.722 -178.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -79.08 93.04 1.28 Allowed Glycine 0 N--CA 1.5 2.948 0 N-CA-C 107.251 -2.34 . . . . 0.0 107.251 178.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 47.08 38.03 6.01 Favored 'General case' 0 N--CA 1.528 3.428 0 CA-C-O 122.025 0.917 . . . . 0.0 108.607 -175.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.462 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 12.2 t-160 68.52 108.64 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.927 0.891 . . . . 0.0 108.967 -175.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.608 ' HB3' ' CA ' ' A' ' 19' ' ' ARG . 59.3 mt -79.98 -172.72 3.54 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.958 0.885 . . . . 0.0 110.432 179.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -160.86 -83.24 0.04 OUTLIER 'General case' 0 N--CA 1.51 2.569 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.75 179.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.7 t -128.66 -63.0 1.0 Allowed 'General case' 0 N--CA 1.506 2.356 0 CA-C-N 119.411 1.005 . . . . 0.0 109.414 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.704 ' HA ' ' CG2' ' A' ' 20' ' ' VAL . 32.9 mmt -92.12 -10.1 40.14 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.482 -0.761 . . . . 0.0 109.77 177.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.509 ' HB3' HD21 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -81.26 -50.1 9.95 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 105.335 -2.098 . . . . 0.0 105.335 174.564 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.608 ' CA ' ' HB3' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -54.16 -27.66 35.09 Favored 'General case' 0 N--CA 1.514 2.729 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.639 178.013 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.704 ' CG2' ' HA ' ' A' ' 17' ' ' MET . 33.8 m -86.88 -45.23 16.46 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.142 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.914 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -50.26 -41.18 50.0 Favored 'General case' 0 N--CA 1.52 3.075 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 176.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.571 ' HB2' HD23 ' A' ' 14' ' ' LEU . 28.0 t90 -60.41 -58.33 8.96 Favored 'General case' 0 N--CA 1.508 2.464 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 176.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.413 ' CD1' ' C ' ' A' ' 23' ' ' LEU . 0.0 OUTLIER -55.46 -31.3 61.84 Favored 'General case' 0 N--CA 1.509 2.498 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.175 178.604 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 -80.66 -46.67 15.24 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.764 -0.585 . . . . 0.0 109.931 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.54 -31.09 72.15 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.775 -0.578 . . . . 0.0 110.792 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.422 ' HD3' ' CE3' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -65.17 -41.4 94.68 Favored 'General case' 0 N--CA 1.51 2.55 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 178.661 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.61 -41.96 68.27 Favored 'General case' 0 N--CA 1.504 2.261 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 176.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -21.68 66.75 Favored 'General case' 0 N--CA 1.505 2.293 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 178.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.14 -43.9 97.81 Favored 'General case' 0 N--CA 1.506 2.356 0 CA-C-O 121.045 0.45 . . . . 0.0 110.372 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 38.6 t -75.11 -31.91 25.65 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 178.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 17.3 m80 -57.34 -40.54 78.22 Favored 'General case' 0 N--CA 1.512 2.673 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -71.38 -54.4 10.85 Favored 'General case' 0 N--CA 1.504 2.242 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 71.31 132.73 0.04 OUTLIER 'General case' 0 N--CA 1.508 2.463 0 CA-C-O 121.462 0.649 . . . . 0.0 110.592 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.7 t -100.41 35.25 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.513 2.721 0 O-C-N 121.624 -0.672 . . . . 0.0 109.979 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -165.05 133.98 3.43 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.059 -1.026 . . . . 0.0 109.663 179.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.512 2.629 0 CA-C-O 117.638 -1.173 . . . . 0.0 110.361 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.506 ' HA ' ' HB2' ' A' ' 7' ' ' MET . 47.8 t . . . . . 0 N--CA 1.507 2.409 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 t 79.69 -49.28 0.38 Allowed 'General case' 0 N--CA 1.521 3.084 0 C-N-CA 123.234 0.613 . . . . 0.0 111.692 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 -100.01 43.43 1.06 Allowed 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 24.2 mm 70.5 154.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.519 3.002 0 O-C-N 121.801 -0.562 . . . . 0.0 110.673 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 72.89 148.61 0.09 Allowed 'General case' 0 N--CA 1.513 2.686 0 C-N-CA 123.086 0.555 . . . . 0.0 109.634 -178.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.2 mp 71.75 -73.13 0.1 Allowed 'General case' 0 N--CA 1.523 3.192 0 N-CA-C 104.388 -2.449 . . . . 0.0 104.388 -175.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.506 ' HB2' ' HA ' ' A' ' 1' ' ' VAL . 1.9 ttp -71.87 135.32 46.53 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 103.89 -2.633 . . . . 0.0 103.89 171.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.434 ' CB ' ' O ' ' A' ' 7' ' ' MET . 1.9 t60 89.11 -53.95 0.03 OUTLIER 'General case' 0 N--CA 1.525 3.291 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -177.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -60.41 -41.88 94.83 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 122.022 -0.423 . . . . 0.0 110.221 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.414 ' HB2' ' CD2' ' A' ' 13' ' ' HIS . 1.4 pt? -66.36 136.68 56.12 Favored 'General case' 0 N--CA 1.505 2.305 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 178.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -118.79 -58.65 0.27 Allowed Glycine 0 N--CA 1.507 3.391 0 C-N-CA 120.593 -0.813 . . . . 0.0 113.036 -176.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.44 53.75 2.4 Favored 'General case' 0 N--CA 1.517 2.925 0 CA-C-N 119.036 1.418 . . . . 0.0 110.288 -178.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.414 ' CD2' ' HB2' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -174.74 -60.85 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 -179.767 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.601 ' HB3' ' CA ' ' A' ' 19' ' ' ARG . 3.8 mt 54.59 -166.2 0.09 Allowed 'General case' 0 N--CA 1.51 2.535 0 C-N-CA 123.288 0.635 . . . . 0.0 112.051 178.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -148.96 -65.15 0.23 Allowed 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.673 -0.642 . . . . 0.0 111.272 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.3 t -139.45 -97.52 0.16 Allowed 'General case' 0 N--CA 1.512 2.657 0 CA-C-N 119.413 1.006 . . . . 0.0 110.331 -179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.664 ' HA ' ' CG2' ' A' ' 20' ' ' VAL . 5.3 ttt -70.74 -13.23 61.98 Favored 'General case' 0 N--CA 1.519 2.986 0 CA-C-N 119.826 1.194 . . . . 0.0 110.358 178.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.463 ' HG3' ' HG2' ' A' ' 7' ' ' MET . 1.9 mm-40 -76.21 -51.87 11.21 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 103.697 -2.705 . . . . 0.0 103.697 174.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.601 ' CA ' ' HB3' ' A' ' 14' ' ' LEU . 1.4 tmm_? -51.21 -31.02 19.01 Favored 'General case' 0 N--CA 1.506 2.33 0 CA-C-N 114.262 -1.335 . . . . 0.0 112.53 177.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.664 ' CG2' ' HA ' ' A' ' 17' ' ' MET . 29.6 m -85.17 -47.41 16.97 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.216 0 C-N-CA 119.601 -0.839 . . . . 0.0 111.596 -177.602 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -52.57 -39.39 61.47 Favored 'General case' 0 N--CA 1.523 3.224 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 176.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.6 ' HB2' HD23 ' A' ' 14' ' ' LEU . 8.4 t90 -64.84 -59.1 4.59 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 176.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.438 ' HB3' ' HA ' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -50.24 -35.04 25.16 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 124.26 1.024 . . . . 0.0 110.154 178.212 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.43 -49.1 23.78 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.894 -0.504 . . . . 0.0 109.936 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.4 tptp -64.93 -41.77 95.25 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.927 -0.483 . . . . 0.0 110.807 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.515 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -64.28 -43.29 95.24 Favored 'General case' 0 N--CA 1.511 2.601 0 CA-C-O 120.911 0.386 . . . . 0.0 110.408 179.643 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.34 -40.16 93.29 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.424 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 32.9 tp60 -70.08 -28.23 65.26 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 122.078 -0.389 . . . . 0.0 111.137 178.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -68.62 -47.26 67.1 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-O 121.48 0.657 . . . . 0.0 109.386 178.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.9 t -90.18 20.48 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.51 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.361 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -88.78 -48.12 7.73 Favored 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 177.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.56 158.13 25.85 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 178.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 66.59 24.14 10.22 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 122.183 -0.323 . . . . 0.0 111.736 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 5.3 t -135.66 34.87 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.513 2.695 0 O-C-N 121.254 -0.904 . . . . 0.0 108.936 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . 72.57 133.55 0.04 OUTLIER 'General case' 0 N--CA 1.512 2.627 0 CA-C-O 121.564 0.697 . . . . 0.0 109.839 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.505 2.316 0 CA-C-O 117.676 -1.154 . . . . 0.0 110.192 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 10.7 m . . . . . 0 N--CA 1.507 2.425 0 CA-C-O 120.909 0.385 . . . . 0.0 110.182 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.18 163.47 24.03 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.716 -0.615 . . . . 0.0 109.732 179.29 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -108.87 48.45 0.86 Allowed 'General case' 0 N--CA 1.504 2.239 0 CA-C-O 121.7 0.762 . . . . 0.0 108.969 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.6 mm 62.43 21.77 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.516 2.843 0 O-C-N 121.763 -0.585 . . . . 0.0 110.938 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.56 -37.41 73.99 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 120.835 -1.165 . . . . 0.0 110.127 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.5 mt -68.3 -48.02 66.05 Favored 'General case' 0 N--CA 1.504 2.25 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 23.5 mmt -61.27 -41.07 96.32 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 122.132 -0.355 . . . . 0.0 110.101 178.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 3.6 m80 -62.74 -23.42 67.18 Favored 'General case' 0 N--CA 1.514 2.734 0 CA-C-N 118.174 0.443 . . . . 0.0 111.069 178.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -118.54 40.22 3.28 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.542 -0.724 . . . . 0.0 109.185 179.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.4 -170.51 2.04 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.517 -0.739 . . . . 0.0 110.552 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.67 70.92 2.18 Favored Glycine 0 N--CA 1.505 3.239 0 O-C-N 121.264 -0.897 . . . . 0.0 111.412 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -153.67 23.83 0.52 Allowed 'General case' 0 N--CA 1.513 2.707 0 O-C-N 122.137 -0.625 . . . . 0.0 110.113 178.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -174.79 -52.88 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.996 0 O-C-N 121.224 -0.923 . . . . 0.0 108.54 -178.333 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.619 HD23 ' HB2' ' A' ' 22' ' ' TRP . 87.2 mt 66.9 175.88 0.24 Allowed 'General case' 0 N--CA 1.501 2.125 0 CA-C-O 122.372 1.082 . . . . 0.0 112.648 179.403 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -167.68 -52.54 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.757 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.944 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.8 p -153.63 -91.1 0.05 OUTLIER 'General case' 0 N--CA 1.511 2.589 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.691 ' HA ' ' CG2' ' A' ' 20' ' ' VAL . 2.3 mmt -72.41 -14.82 61.79 Favored 'General case' 0 N--CA 1.514 2.775 0 CA-C-N 119.343 0.974 . . . . 0.0 109.068 176.282 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.602 ' HB3' HD21 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -72.47 -55.67 6.62 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 103.871 -2.64 . . . . 0.0 103.871 173.375 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.593 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -49.79 -28.62 6.52 Favored 'General case' 0 N--CA 1.508 2.443 0 CA-C-N 114.058 -1.428 . . . . 0.0 112.687 178.499 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.691 ' CG2' ' HA ' ' A' ' 17' ' ' MET . 32.7 m -87.13 -48.95 15.17 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.152 0 C-N-CA 119.308 -0.957 . . . . 0.0 111.213 -178.316 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.435 ' HA ' ' HD2' ' A' ' 24' ' ' ARG . 0.5 OUTLIER -51.26 -35.74 38.73 Favored 'General case' 0 N--CA 1.514 2.766 0 N-CA-C 107.85 -1.166 . . . . 0.0 107.85 176.171 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.662 ' CE3' ' HG2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -67.89 -73.52 0.14 Allowed 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 106.513 -1.662 . . . . 0.0 106.513 175.124 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.587 ' HA ' ' HG3' ' A' ' 26' ' ' LYS . 0.4 OUTLIER -39.7 -30.06 0.07 Allowed 'General case' 0 N--CA 1.511 2.612 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -178.898 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.435 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -59.23 -40.66 86.58 Favored 'General case' 0 N--CA 1.512 2.655 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 176.026 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? -85.15 -17.18 38.02 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 123.416 0.686 . . . . 0.0 111.561 177.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.662 ' HG2' ' CE3' ' A' ' 22' ' ' TRP . 0.2 OUTLIER -71.16 -38.12 72.2 Favored 'General case' 0 N--CA 1.525 3.292 0 O-C-N 121.473 -0.767 . . . . 0.0 109.969 179.314 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 tp -71.38 -48.13 51.85 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 177.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -66.81 -15.94 63.94 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 122.309 -0.244 . . . . 0.0 111.289 177.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.521 ' HB3' ' HA ' ' A' ' 35' ' ' ALA . 0.3 OUTLIER -62.98 -46.57 87.06 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.932 -0.48 . . . . 0.0 110.547 179.434 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 17.2 t -81.85 -8.23 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.2 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -89.08 -49.94 6.46 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.338 -0.851 . . . . 0.0 109.448 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -95.63 -41.15 9.05 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 122.022 -0.424 . . . . 0.0 110.683 -179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -106.96 -151.9 0.47 Allowed 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.0 t -125.04 42.91 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.494 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.521 ' HA ' ' HB3' ' A' ' 29' ' ' ASP . . . 76.18 139.3 0.07 Allowed 'General case' 0 N--CA 1.509 2.515 0 CA-C-O 121.536 0.684 . . . . 0.0 110.477 -179.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.7 tt . . . . . 0 N--CA 1.504 2.275 0 CA-C-O 118.564 -0.731 . . . . 0.0 109.593 -179.719 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 51.8 t . . . . . 0 N--CA 1.503 2.198 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.3 m -131.13 160.99 33.12 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 122.024 -0.423 . . . . 0.0 109.97 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.469 ' HB3' ' HE2' ' A' ' 7' ' ' MET . 0.0 OUTLIER -107.16 48.17 0.85 Allowed 'General case' 0 N--CA 1.503 2.19 0 CA-C-O 121.836 0.827 . . . . 0.0 109.067 179.36 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.3 mt -94.77 150.84 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.384 0 O-C-N 121.526 -0.734 . . . . 0.0 109.278 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 75.09 -62.29 0.46 Allowed 'General case' 0 N--CA 1.521 3.122 0 C-N-CA 123.401 0.681 . . . . 0.0 110.718 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.4 -43.99 92.88 Favored 'General case' 0 N--CA 1.511 2.597 0 CA-C-N 118.639 0.654 . . . . 0.0 110.26 179.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.469 ' HE2' ' HB3' ' A' ' 3' ' ' GLU . 29.3 ttm -60.69 -47.45 86.19 Favored 'General case' 0 N--CA 1.51 2.555 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 64.9 t60 -64.05 -36.23 83.32 Favored 'General case' 0 N--CA 1.507 2.415 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 178.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.42 ' HB3' ' CE1' ' A' ' 13' ' ' HIS . 0.1 OUTLIER -65.55 -19.05 65.76 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.788 -0.57 . . . . 0.0 111.528 179.667 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.6 tt -55.6 118.68 4.73 Favored 'General case' 0 N--CA 1.51 2.574 0 CA-C-N 119.048 0.84 . . . . 0.0 109.631 179.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 108.18 -30.63 8.72 Favored Glycine 0 N--CA 1.504 3.187 0 N-CA-C 110.258 -1.137 . . . . 0.0 110.258 -178.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.7 mttp -91.68 -42.0 10.41 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-N 118.783 1.292 . . . . 0.0 109.908 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.42 ' CE1' ' HB3' ' A' ' 9' ' ' ASN . 0.8 OUTLIER -85.78 63.66 8.17 Favored 'General case' 0 N--CA 1.512 2.674 0 CA-C-O 121.4 0.619 . . . . 0.0 111.333 -179.211 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.632 ' CD1' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -101.15 -152.45 0.43 Allowed 'General case' 0 N--CA 1.511 2.589 0 O-C-N 121.064 -1.022 . . . . 0.0 108.718 178.663 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -148.43 -66.52 0.24 Allowed 'General case' 0 N--CA 1.515 2.783 0 O-C-N 121.241 -0.912 . . . . 0.0 111.311 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.0 t -141.26 -79.2 0.26 Allowed 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.437 -0.789 . . . . 0.0 109.124 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.6 tmm? -69.1 -26.1 64.75 Favored 'General case' 0 N--CA 1.514 2.75 0 O-C-N 121.365 -0.835 . . . . 0.0 109.329 177.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.455 ' HB3' ' HB3' ' A' ' 14' ' ' LEU . 27.3 mt-10 -76.89 -46.85 22.94 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 174.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.632 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . 0.1 OUTLIER -53.36 -19.25 3.21 Favored 'General case' 0 N--CA 1.516 2.843 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 179.843 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.448 ' HA ' HD21 ' A' ' 23' ' ' LEU . 4.0 p -79.14 -33.34 15.72 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.534 0 C-N-CA 119.53 -0.868 . . . . 0.0 109.788 178.007 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -54.44 -35.12 62.64 Favored 'General case' 0 N--CA 1.516 2.831 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 175.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.523 ' CH2' ' HD3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -63.56 -79.95 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 105.534 -2.024 . . . . 0.0 105.534 175.205 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.448 HD21 ' HA ' ' A' ' 20' ' ' VAL . 0.2 OUTLIER -40.88 -30.19 0.12 Allowed 'General case' 0 N--CA 1.5 2.04 0 C-N-CA 123.466 0.706 . . . . 0.0 112.674 -179.837 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 34.9 mtm180 -64.57 -46.53 82.33 Favored 'General case' 0 N--CA 1.512 2.655 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 177.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.8 tptp -65.66 -43.0 90.71 Favored 'General case' 0 N--CA 1.501 2.091 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.523 ' HD3' ' CH2' ' A' ' 22' ' ' TRP . 8.0 ttpp -56.89 -43.0 80.87 Favored 'General case' 0 N--CA 1.517 2.897 0 CA-C-O 121.208 0.528 . . . . 0.0 110.327 178.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -71.42 -40.53 70.4 Favored 'General case' 0 N--CA 1.505 2.301 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -67.85 -26.51 66.07 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.936 -0.478 . . . . 0.0 110.604 178.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -65.73 -52.53 50.49 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.1 p -72.21 -20.19 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.454 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.073 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -76.69 -35.16 58.06 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.905 -0.497 . . . . 0.0 110.119 178.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.9 m120 -97.74 112.55 24.4 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.59 -0.694 . . . . 0.0 109.553 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 17.5 p90 -147.08 45.78 1.16 Allowed 'General case' 0 N--CA 1.512 2.63 0 CA-C-O 121.537 0.684 . . . . 0.0 109.687 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.0 m -115.03 97.55 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 O-C-N 121.318 -0.864 . . . . 0.0 109.561 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.28 -27.27 38.58 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.817 -0.552 . . . . 0.0 111.237 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.507 2.375 0 CA-C-O 119.037 -0.506 . . . . 0.0 110.492 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 47.9 t . . . . . 0 N--CA 1.505 2.296 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -81.97 168.56 17.74 Favored 'General case' 0 N--CA 1.507 2.413 0 CA-C-O 121.238 0.542 . . . . 0.0 110.385 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.85 -23.86 66.76 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.944 -0.472 . . . . 0.0 112.01 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.459 HG22 HD11 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -120.88 140.98 43.33 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.125 0 CA-C-O 121.351 0.596 . . . . 0.0 109.734 179.722 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -161.57 -70.75 0.06 Allowed 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.71 -27.41 69.19 Favored 'General case' 0 N--CA 1.514 2.752 0 O-C-N 121.787 -0.571 . . . . 0.0 110.997 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 12.6 ttt -60.26 -39.46 86.87 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 121.407 -0.808 . . . . 0.0 108.948 178.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 75.9 t60 -76.46 -45.21 32.25 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 108.677 -0.861 . . . . 0.0 108.677 177.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.459 ' HA ' ' HA ' ' A' ' 15' ' ' ASN . 0.2 OUTLIER -108.42 87.25 2.45 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 178.935 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.448 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 0.4 OUTLIER -74.2 143.29 45.25 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.686 -0.634 . . . . 0.0 110.372 -179.856 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 92.65 -13.08 68.31 Favored Glycine 0 CA--C 1.555 2.555 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 -177.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 88.67 25.76 0.03 OUTLIER 'General case' 0 N--CA 1.526 3.341 0 C-N-CA 125.132 1.373 . . . . 0.0 109.861 -177.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.454 ' N ' ' CD2' ' A' ' 13' ' ' HIS . 0.0 OUTLIER -170.74 -76.63 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.49 0 O-C-N 120.931 -1.105 . . . . 0.0 110.405 -179.368 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.571 ' CD1' ' HA ' ' A' ' 16' ' ' SER . 0.9 OUTLIER -64.26 159.97 19.67 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.684 -0.635 . . . . 0.0 110.845 179.834 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.459 ' HA ' ' HA ' ' A' ' 9' ' ' ASN . 9.8 p30 -77.88 -43.78 29.12 Favored 'General case' 0 N--CA 1.504 2.231 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 176.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.571 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . 28.7 t 150.52 -57.62 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.851 0 C-N-CA 125.155 1.382 . . . . 0.0 107.694 177.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.1 mmt -58.52 -30.37 67.01 Favored 'General case' 0 N--CA 1.526 3.334 0 CA-C-N 121.357 1.889 . . . . 0.0 107.972 175.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.444 ' HB3' ' HD3' ' A' ' 19' ' ' ARG . 2.0 tt0 -55.9 -46.74 78.29 Favored 'General case' 0 N--CA 1.503 2.224 0 CA-C-O 122.396 1.093 . . . . 0.0 109.38 174.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.564 ' HD3' ' HB3' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -142.24 68.11 1.32 Allowed 'General case' 0 C--N 1.305 -1.346 0 CA-C-O 123.353 1.549 . . . . 0.0 109.391 -176.512 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.409 ' N ' ' O ' ' A' ' 16' ' ' SER . 11.5 p -90.7 -41.84 13.63 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.557 0 N-CA-C 105.874 -1.899 . . . . 0.0 105.874 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.49 -33.45 68.03 Favored 'General case' 0 N--CA 1.511 2.581 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 173.064 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.544 ' HB3' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -53.45 -58.17 8.08 Favored 'General case' 0 N--CA 1.519 3.017 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 174.923 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.5 mt -55.97 -44.75 78.83 Favored 'General case' 0 N--CA 1.51 2.568 0 CA-C-N 114.742 -1.117 . . . . 0.0 109.269 178.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.1 ttm105 -63.92 -48.74 75.36 Favored 'General case' 0 N--CA 1.513 2.701 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.205 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -66.83 -39.37 87.65 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.832 -0.542 . . . . 0.0 110.912 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.452 ' HD3' ' CE3' ' A' ' 22' ' ' TRP . 2.5 mptp? -61.93 -33.6 74.55 Favored 'General case' 0 N--CA 1.513 2.68 0 CA-C-O 120.734 0.302 . . . . 0.0 110.563 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.25 -43.36 70.7 Favored 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 176.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 22.3 tp60 -66.32 -25.28 66.75 Favored 'General case' 0 N--CA 1.504 2.248 0 O-C-N 122.087 -0.383 . . . . 0.0 111.271 178.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -62.24 -55.75 25.32 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.891 -0.506 . . . . 0.0 109.872 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 27.6 m -65.06 -26.21 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.979 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.619 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -82.17 -17.48 46.1 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.965 -0.459 . . . . 0.0 110.885 179.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -88.81 -14.11 37.78 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.251 -0.906 . . . . 0.0 112.255 -179.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -110.37 71.56 0.76 Allowed 'General case' 0 N--CA 1.507 2.392 0 CA-C-N 119.524 1.056 . . . . 0.0 110.277 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -149.07 104.97 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.606 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -148.7 -152.21 0.43 Allowed 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.663 -0.648 . . . . 0.0 109.343 -179.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.1 tp . . . . . 0 N--CA 1.503 2.224 0 CA-C-O 117.646 -1.169 . . . . 0.0 109.929 -179.972 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 11.1 m . . . . . 0 N--CA 1.508 2.428 0 CA-C-O 121.126 0.488 . . . . 0.0 110.456 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.5 t -83.44 -176.52 6.35 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.887 -0.508 . . . . 0.0 110.49 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 63.05 49.84 3.3 Favored 'General case' 0 N--CA 1.509 2.505 0 CA-C-O 121.494 0.664 . . . . 0.0 110.635 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.4 pt -81.56 90.8 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.508 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 178.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.645 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 1.4 mp0 -94.59 -67.57 0.85 Allowed 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.761 -0.587 . . . . 0.0 110.075 -178.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.0 pp -53.68 -18.18 2.83 Favored 'General case' 0 N--CA 1.523 3.207 0 CA-C-N 119.353 0.978 . . . . 0.0 110.455 177.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 15.2 mmm -59.04 -42.13 89.51 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-N 118.964 0.802 . . . . 0.0 109.808 177.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.539 ' HB3' ' HB2' ' A' ' 10' ' ' LEU . 55.2 t60 -109.35 24.25 13.35 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 176.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 44.04 53.3 6.5 Favored 'General case' 0 N--CA 1.525 3.279 0 CA-C-O 124.548 2.118 . . . . 0.0 105.372 -175.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.645 ' HB3' ' HA ' ' A' ' 5' ' ' GLN . 2.7 tp -109.58 152.37 25.6 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 110.989 -2.823 . . . . 0.0 111.937 -171.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -116.96 27.91 7.58 Favored Glycine 0 N--CA 1.499 2.896 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 178.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 76.82 26.59 0.79 Allowed 'General case' 0 N--CA 1.513 2.709 0 CA-C-N 117.767 0.783 . . . . 0.0 109.109 -177.347 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 178.17 -106.27 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.653 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.643 ' CD2' ' HB2' ' A' ' 22' ' ' TRP . 17.1 mt 65.72 -108.37 0.15 Allowed 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 119.558 1.072 . . . . 0.0 112.986 176.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 56.75 110.2 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.977 0 C-N-CA 125.029 1.332 . . . . 0.0 111.718 -176.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.3 t 80.02 -142.84 0.02 OUTLIER 'General case' 0 N--CA 1.525 3.28 0 C-N-CA 123.753 0.821 . . . . 0.0 111.538 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.694 ' HA ' ' CG2' ' A' ' 20' ' ' VAL . 5.4 mmm -61.92 -11.42 13.02 Favored 'General case' 0 N--CA 1.524 3.266 0 O-C-N 120.904 -1.123 . . . . 0.0 112.928 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.434 ' HB2' ' O ' ' A' ' 14' ' ' LEU . 8.9 mm-40 -74.18 -55.13 6.43 Favored 'General case' 0 N--CA 1.503 2.185 0 N-CA-C 103.841 -2.651 . . . . 0.0 103.841 174.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.588 ' CA ' ' HB3' ' A' ' 14' ' ' LEU . 2.0 tmt_? -49.78 -27.79 5.41 Favored 'General case' 0 N--CA 1.507 2.384 0 CA-C-N 114.088 -1.415 . . . . 0.0 112.865 177.368 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.694 ' CG2' ' HA ' ' A' ' 17' ' ' MET . 23.3 m -88.82 -47.34 15.28 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.012 0 C-N-CA 119.491 -0.884 . . . . 0.0 111.598 -178.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -51.77 -34.16 38.38 Favored 'General case' 0 N--CA 1.518 2.931 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 176.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.643 ' HB2' ' CD2' ' A' ' 14' ' ' LEU . 14.9 t90 -61.55 -60.4 3.76 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 176.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.57 -31.18 61.96 Favored 'General case' 0 N--CA 1.507 2.378 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.545 178.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -77.62 -45.19 25.85 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.792 -0.568 . . . . 0.0 109.755 179.22 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.4 tptp -67.09 -34.02 76.73 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 122.047 -0.408 . . . . 0.0 111.078 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -44.62 95.06 Favored 'General case' 0 N--CA 1.513 2.708 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.54 -41.45 75.92 Favored 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 177.027 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -68.24 -18.94 64.69 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 122.017 -0.427 . . . . 0.0 111.502 178.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -73.64 -45.64 51.56 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.626 -0.671 . . . . 0.0 110.132 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.9 t -93.29 21.03 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.615 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.936 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 45.2 m80 -139.31 -52.66 0.55 Allowed 'General case' 0 N--CA 1.508 2.468 0 O-C-N 120.93 -1.106 . . . . 0.0 109.41 178.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.7 m-80 -103.39 88.64 3.16 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 5.8 p90 -132.23 75.16 1.62 Allowed 'General case' 0 N--CA 1.506 2.369 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.5 m 39.89 73.97 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.522 3.139 0 CA-C-O 121.999 0.904 . . . . 0.0 111.886 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -147.69 -149.44 0.29 Allowed 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.505 2.287 0 CA-C-O 117.689 -1.148 . . . . 0.0 110.124 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.899 HD13 ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.942 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.403 ' C ' ' HB2' ' A' ' 19' ' ' ARG . 0.6 OUTLIER -138.79 -65.56 0.49 Allowed 'General case' 0 N--CA 1.512 2.63 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.354 -178.324 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.2 t -143.53 -78.41 0.22 Allowed 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.253 -0.904 . . . . 0.0 109.529 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.656 ' O ' HG12 ' A' ' 20' ' ' VAL . 6.1 mmm -67.9 -26.82 66.18 Favored 'General case' 0 N--CA 1.518 2.927 0 O-C-N 121.381 -0.824 . . . . 0.0 109.499 177.782 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.608 ' O ' HD22 ' A' ' 14' ' ' LEU . 13.5 mt-10 -76.78 -47.97 20.03 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 105.531 -2.026 . . . . 0.0 105.531 174.344 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.899 ' HA ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -53.09 -17.22 1.43 Allowed 'General case' 0 N--CA 1.514 2.743 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 -179.886 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.656 HG12 ' O ' ' A' ' 17' ' ' MET . 5.3 p -78.52 -39.27 23.28 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.743 0 C-N-CA 119.411 -0.916 . . . . 0.0 110.093 178.747 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -52.75 -35.44 56.2 Favored 'General case' 0 N--CA 1.519 3.016 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.824 ' HB2' HD21 ' A' ' 14' ' ' LEU . 54.0 t90 -60.88 -56.01 26.25 Favored 'General case' 0 N--CA 1.507 2.41 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 176.152 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.51 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -60.41 -28.93 68.64 Favored 'General case' 0 N--CA 1.505 2.292 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.149 178.871 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.424 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -75.33 -47.63 26.87 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.621 -0.674 . . . . 0.0 109.29 178.912 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.25 -24.94 64.06 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 122.148 -0.345 . . . . 0.0 110.994 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.405 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 0.1 OUTLIER -70.03 -40.39 75.19 Favored 'General case' 0 N--CA 1.507 2.418 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.422 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tt -67.34 -39.89 85.82 Favored 'General case' 0 N--CA 1.503 2.192 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 176.067 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -78.52 -1.59 34.63 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 122.058 -0.401 . . . . 0.0 111.346 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -88.43 -34.32 17.55 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.44 -1.412 . . . . 0.0 107.812 176.454 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 84.0 t -52.83 -32.02 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.807 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.172 0 O-C-N 122.186 -0.321 . . . . 0.0 111.244 -177.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.777 ' CG ' ' HA ' ' A' ' 19' ' ' ARG . 17.4 tp . . . . . 0 N--CA 1.499 1.981 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.406 ' CA ' ' HB2' ' A' ' 19' ' ' ARG . 3.9 p30 -163.83 152.82 13.93 Favored 'General case' 0 N--CA 1.514 2.733 0 O-C-N 121.609 -0.682 . . . . 0.0 112.084 -178.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.7 t 52.52 -136.54 1.34 Allowed 'General case' 0 N--CA 1.514 2.764 0 C-N-CA 122.991 0.516 . . . . 0.0 111.916 178.226 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.649 ' O ' HG12 ' A' ' 20' ' ' VAL . 0.1 OUTLIER -56.64 -34.51 67.37 Favored 'General case' 0 N--CA 1.519 2.976 0 O-C-N 121.085 -1.009 . . . . 0.0 111.524 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.579 ' O ' HD11 ' A' ' 14' ' ' LEU . 22.2 mt-10 -59.94 -43.64 94.86 Favored 'General case' 0 N--CA 1.513 2.702 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 177.208 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.777 ' HA ' ' CG ' ' A' ' 14' ' ' LEU . 20.9 ttt85 -61.6 -11.6 12.13 Favored 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.649 HG12 ' O ' ' A' ' 17' ' ' MET . 1.1 p -98.3 -37.21 6.29 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.725 0 C-N-CA 119.053 -1.059 . . . . 0.0 110.651 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -59.65 -40.4 87.58 Favored 'General case' 0 N--CA 1.514 2.769 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 177.17 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.591 ' HB2' ' CD1' ' A' ' 14' ' ' LEU . 7.8 t90 -61.36 -59.79 4.73 Favored 'General case' 0 N--CA 1.501 2.099 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 177.072 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.613 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -59.1 -30.79 68.36 Favored 'General case' 0 N--CA 1.506 2.368 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.233 179.432 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -72.83 -44.23 61.7 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.1 tptp -69.1 -47.03 66.26 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.905 -0.497 . . . . 0.0 110.165 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.403 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -58.49 -42.03 86.64 Favored 'General case' 0 N--CA 1.515 2.777 0 CA-C-O 120.822 0.344 . . . . 0.0 110.297 179.146 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.419 HD13 ' HA ' ' A' ' 27' ' ' LEU . 1.6 mm? -69.24 -35.3 76.0 Favored 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 176.786 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -83.16 14.91 3.13 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.657 -0.652 . . . . 0.0 111.179 178.027 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -108.18 -51.35 2.91 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.087 -1.008 . . . . 0.0 110.318 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 t -102.42 23.32 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.514 2.731 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.085 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 74.4 m80 . . . . . 0 N--CA 1.513 2.699 0 O-C-N 120.961 -1.087 . . . . 0.0 110.296 179.702 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.728 HD11 ' CB ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.508 2.433 0 CA-C-O 120.772 0.32 . . . . 0.0 111.321 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -52.89 14.63 Favored 'General case' 0 N--CA 1.507 2.381 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.608 ' HB3' HG23 ' A' ' 20' ' ' VAL . 0.5 OUTLIER 171.63 -96.0 0.0 OUTLIER 'General case' 0 C--O 1.174 -2.882 0 CA-C-O 116.657 -1.64 . . . . 0.0 107.893 178.287 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.48 ' HA ' ' HB ' ' A' ' 20' ' ' VAL . 3.0 ttm -24.21 -43.19 0.01 OUTLIER 'General case' 0 N--CA 1.539 4.0 0 CA-C-N 121.584 1.993 . . . . 0.0 116.254 -177.823 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -51.37 -41.54 60.72 Favored 'General case' 0 N--CA 1.534 3.754 0 CA-C-O 122.464 1.126 . . . . 0.0 108.741 176.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.762 ' HB3' ' CB ' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -117.7 -64.93 1.23 Allowed 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 125.3 1.44 . . . . 0.0 108.251 177.332 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.608 HG23 ' HB3' ' A' ' 16' ' ' SER . 0.3 OUTLIER 62.19 -53.76 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.518 2.968 0 C-N-CA 127.195 2.198 . . . . 0.0 112.087 175.491 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.16 -26.71 51.53 Favored 'General case' 0 N--CA 1.524 3.264 0 N-CA-C 104.842 -2.281 . . . . 0.0 104.842 169.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.762 ' CB ' ' HB3' ' A' ' 19' ' ' ARG 0.255 18.8 t90 -55.41 -57.52 11.51 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 126.826 2.051 . . . . 0.0 108.316 173.433 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 20' ' ' VAL . 0.5 OUTLIER -59.63 -28.92 67.64 Favored 'General case' 0 N--CA 1.511 2.597 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.761 178.741 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.409 ' NH1' HG13 ' A' ' 20' ' ' VAL . 0.2 OUTLIER -75.91 -39.91 55.35 Favored 'General case' 0 N--CA 1.508 2.46 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.113 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 11.5 tttp -83.22 -4.3 58.26 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 122.074 -0.391 . . . . 0.0 111.648 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.42 ' HD3' ' CZ2' ' A' ' 22' ' ' TRP . 0.8 OUTLIER -58.23 -47.73 82.61 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 121.453 -0.779 . . . . 0.0 109.801 179.897 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 pp -67.49 -36.73 81.67 Favored 'General case' 0 N--CA 1.511 2.585 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 176.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -92.87 53.28 1.98 Allowed 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.349 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -142.63 -51.33 0.37 Allowed 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.658 -0.651 . . . . 0.0 110.072 -178.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.8 t -95.76 34.98 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.622 0 CA-C-O 121.561 0.696 . . . . 0.0 109.514 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 7.1 t60 . . . . . 0 N--CA 1.503 2.185 0 O-C-N 121.2 -0.938 . . . . 0.0 109.644 179.912 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.961 HD11 ' HA ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.504 2.268 0 CA-C-O 120.698 0.285 . . . . 0.0 111.432 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.613 ' CB ' ' HB2' ' A' ' 18' ' ' GLU . 1.3 m-20 70.52 159.36 0.19 Allowed 'General case' 0 N--CA 1.528 3.433 0 O-C-N 120.93 -1.106 . . . . 0.0 111.119 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.3 m -66.24 -75.89 0.09 Allowed 'General case' 0 N--CA 1.519 2.993 0 O-C-N 121.343 -0.848 . . . . 0.0 112.015 -177.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.524 ' O ' HG12 ' A' ' 20' ' ' VAL . 0.3 OUTLIER -68.26 -22.93 64.73 Favored 'General case' 0 N--CA 1.516 2.869 0 O-C-N 121.196 -0.94 . . . . 0.0 110.435 179.475 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.613 ' HB2' ' CB ' ' A' ' 15' ' ' ASN . 4.6 mt-10 -65.81 -37.92 87.56 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 175.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.961 ' HA ' HD11 ' A' ' 14' ' ' LEU . 0.1 OUTLIER -59.17 -35.06 72.89 Favored 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -179.936 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.76 ' HA ' HD23 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -79.61 -43.21 23.23 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.113 0 C-N-CA 118.216 -1.394 . . . . 0.0 110.312 -178.938 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -56.17 -40.03 73.28 Favored 'General case' 0 N--CA 1.511 2.576 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 177.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.61 ' CE3' ' HD2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -68.96 -70.05 0.29 Allowed 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 176.891 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.76 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -39.61 -33.17 0.16 Allowed 'General case' 0 N--CA 1.518 2.953 0 C-N-CA 123.333 0.653 . . . . 0.0 112.102 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.18 -50.56 72.64 Favored 'General case' 0 N--CA 1.509 2.483 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 177.115 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -31.39 67.03 Favored 'General case' 0 N--CA 1.504 2.273 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 175.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.61 ' HD2' ' CE3' ' A' ' 22' ' ' TRP . 1.5 tttm -62.68 -32.4 73.46 Favored 'General case' 0 N--CA 1.52 3.037 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 178.733 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tt -74.47 -44.61 50.77 Favored 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 176.149 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -68.14 -8.16 36.06 Favored 'General case' 0 N--CA 1.519 3.021 0 O-C-N 122.172 -0.33 . . . . 0.0 111.379 176.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.83 -37.93 76.35 Favored 'General case' 0 C--N 1.31 -1.11 0 C-N-CA 119.702 -0.799 . . . . 0.0 108.876 178.746 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.5 t -90.55 43.26 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.331 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 173.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 77.3 m80 . . . . . 0 N--CA 1.503 2.209 0 C-N-CA 124.107 0.963 . . . . 0.0 112.316 -177.892 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.863 HD13 ' HA ' ' A' ' 19' ' ' ARG . 59.3 mt . . . . . 0 N--CA 1.494 1.734 0 CA-C-O 121.958 0.885 . . . . 0.0 110.432 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -160.86 -83.24 0.04 OUTLIER 'General case' 0 N--CA 1.51 2.569 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.75 179.094 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.537 ' O ' HG13 ' A' ' 20' ' ' VAL . 16.7 t -128.66 -63.0 1.0 Allowed 'General case' 0 N--CA 1.506 2.356 0 CA-C-N 119.411 1.005 . . . . 0.0 109.414 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.728 ' HA ' HG22 ' A' ' 20' ' ' VAL . 32.9 mmt -92.12 -10.1 40.14 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.482 -0.761 . . . . 0.0 109.77 177.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.685 ' C ' HD22 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -81.26 -50.1 9.95 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 105.335 -2.098 . . . . 0.0 105.335 174.564 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.863 ' HA ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -54.16 -27.66 35.09 Favored 'General case' 0 N--CA 1.514 2.729 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.639 178.013 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.728 HG22 ' HA ' ' A' ' 17' ' ' MET . 33.8 m -86.88 -45.23 16.46 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.142 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.914 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -50.26 -41.18 50.0 Favored 'General case' 0 N--CA 1.52 3.075 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 176.001 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.653 ' HB2' HD21 ' A' ' 14' ' ' LEU . 28.0 t90 -60.41 -58.33 8.96 Favored 'General case' 0 N--CA 1.508 2.464 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 176.099 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.698 ' C ' HD13 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -55.46 -31.3 61.84 Favored 'General case' 0 N--CA 1.509 2.498 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.175 178.604 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.577 ' N ' HD13 ' A' ' 23' ' ' LEU . 1.4 ttp85 -80.66 -46.67 15.24 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.764 -0.585 . . . . 0.0 109.931 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.54 -31.09 72.15 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.775 -0.578 . . . . 0.0 110.792 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.441 ' HD3' ' CE3' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -65.17 -41.4 94.68 Favored 'General case' 0 N--CA 1.51 2.55 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 178.661 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.61 -41.96 68.27 Favored 'General case' 0 N--CA 1.504 2.261 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 176.789 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -21.68 66.75 Favored 'General case' 0 N--CA 1.505 2.293 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 178.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.14 -43.9 97.81 Favored 'General case' 0 N--CA 1.506 2.356 0 CA-C-O 121.045 0.45 . . . . 0.0 110.372 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 38.6 t -75.11 -31.91 25.65 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 178.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 17.3 m80 . . . . . 0 N--CA 1.512 2.673 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 179.173 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.761 HD22 ' HA ' ' A' ' 19' ' ' ARG . 3.8 mt . . . . . 0 N--CA 1.51 2.535 0 CA-C-O 121.334 0.588 . . . . 0.0 112.051 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -148.96 -65.15 0.23 Allowed 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.673 -0.642 . . . . 0.0 111.272 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.481 ' O ' HG13 ' A' ' 20' ' ' VAL . 35.3 t -139.45 -97.52 0.16 Allowed 'General case' 0 N--CA 1.512 2.657 0 CA-C-N 119.413 1.006 . . . . 0.0 110.331 -179.073 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.797 ' HA ' HG22 ' A' ' 20' ' ' VAL . 5.3 ttt -70.74 -13.23 61.98 Favored 'General case' 0 N--CA 1.519 2.986 0 CA-C-N 119.826 1.194 . . . . 0.0 110.358 178.585 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.644 ' C ' HD22 ' A' ' 14' ' ' LEU . 1.9 mm-40 -76.21 -51.87 11.21 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 103.697 -2.705 . . . . 0.0 103.697 174.105 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.761 ' HA ' HD22 ' A' ' 14' ' ' LEU . 1.4 tmm_? -51.21 -31.02 19.01 Favored 'General case' 0 N--CA 1.506 2.33 0 CA-C-N 114.262 -1.335 . . . . 0.0 112.53 177.516 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.797 HG22 ' HA ' ' A' ' 17' ' ' MET . 29.6 m -85.17 -47.41 16.97 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.216 0 C-N-CA 119.601 -0.839 . . . . 0.0 111.596 -177.602 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -52.57 -39.39 61.47 Favored 'General case' 0 N--CA 1.523 3.224 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 176.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.64 ' CG ' HD11 ' A' ' 14' ' ' LEU . 8.4 t90 -64.84 -59.1 4.59 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 176.482 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.667 ' C ' HD13 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -50.24 -35.04 25.16 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 124.26 1.024 . . . . 0.0 110.154 178.212 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.568 ' N ' HD13 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -74.43 -49.1 23.78 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.894 -0.504 . . . . 0.0 109.936 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.401 ' HA ' ' HD2' ' A' ' 25' ' ' LYS . 7.4 tptp -64.93 -41.77 95.25 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.927 -0.483 . . . . 0.0 110.807 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.535 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -64.28 -43.29 95.24 Favored 'General case' 0 N--CA 1.511 2.601 0 CA-C-O 120.911 0.386 . . . . 0.0 110.408 179.643 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.34 -40.16 93.29 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.424 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 32.9 tp60 -70.08 -28.23 65.26 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 122.078 -0.389 . . . . 0.0 111.137 178.465 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -68.62 -47.26 67.1 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-O 121.48 0.657 . . . . 0.0 109.386 178.723 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.9 t -90.18 20.48 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.51 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.361 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.161 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 177.721 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.869 HD21 ' HB2' ' A' ' 22' ' ' TRP . 87.2 mt . . . . . 0 N--CA 1.501 2.125 0 CA-C-O 122.372 1.082 . . . . 0.0 112.648 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -167.68 -52.54 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.757 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.944 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.486 ' O ' HG13 ' A' ' 20' ' ' VAL . 18.8 p -153.63 -91.1 0.05 OUTLIER 'General case' 0 N--CA 1.511 2.589 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.825 ' HA ' HG22 ' A' ' 20' ' ' VAL . 2.3 mmt -72.41 -14.82 61.79 Favored 'General case' 0 N--CA 1.514 2.775 0 CA-C-N 119.343 0.974 . . . . 0.0 109.068 176.282 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.727 ' C ' HD22 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -72.47 -55.67 6.62 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 103.871 -2.64 . . . . 0.0 103.871 173.375 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.83 ' HA ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -49.79 -28.62 6.52 Favored 'General case' 0 N--CA 1.508 2.443 0 CA-C-N 114.058 -1.428 . . . . 0.0 112.687 178.499 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.825 HG22 ' HA ' ' A' ' 17' ' ' MET . 32.7 m -87.13 -48.95 15.17 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.152 0 C-N-CA 119.308 -0.957 . . . . 0.0 111.213 -178.316 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.428 ' HA ' ' HD2' ' A' ' 24' ' ' ARG . 0.5 OUTLIER -51.26 -35.74 38.73 Favored 'General case' 0 N--CA 1.514 2.766 0 N-CA-C 107.85 -1.166 . . . . 0.0 107.85 176.171 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.869 ' HB2' HD21 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -67.89 -73.52 0.14 Allowed 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 106.513 -1.662 . . . . 0.0 106.513 175.124 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.706 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.4 OUTLIER -39.7 -30.06 0.07 Allowed 'General case' 0 N--CA 1.511 2.612 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -178.898 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -59.23 -40.66 86.58 Favored 'General case' 0 N--CA 1.512 2.655 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 176.026 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? -85.15 -17.18 38.02 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 123.416 0.686 . . . . 0.0 111.561 177.043 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.708 ' HG2' ' CE3' ' A' ' 22' ' ' TRP . 0.2 OUTLIER -71.16 -38.12 72.2 Favored 'General case' 0 N--CA 1.525 3.292 0 O-C-N 121.473 -0.767 . . . . 0.0 109.969 179.314 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 tp -71.38 -48.13 51.85 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 177.273 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -66.81 -15.94 63.94 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 122.309 -0.244 . . . . 0.0 111.289 177.301 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.98 -46.57 87.06 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.932 -0.48 . . . . 0.0 110.547 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 17.2 t -81.85 -8.23 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.2 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 . . . . . 0 N--CA 1.505 2.322 0 O-C-N 121.338 -0.851 . . . . 0.0 109.448 179.169 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.934 HD13 ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.511 2.589 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -148.43 -66.52 0.24 Allowed 'General case' 0 N--CA 1.515 2.783 0 O-C-N 121.241 -0.912 . . . . 0.0 111.311 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.0 t -141.26 -79.2 0.26 Allowed 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.437 -0.789 . . . . 0.0 109.124 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.718 ' O ' HG12 ' A' ' 20' ' ' VAL . 3.6 tmm? -69.1 -26.1 64.75 Favored 'General case' 0 N--CA 1.514 2.75 0 O-C-N 121.365 -0.835 . . . . 0.0 109.329 177.61 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.646 ' O ' HD22 ' A' ' 14' ' ' LEU . 27.3 mt-10 -76.89 -46.85 22.94 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 174.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.934 ' HA ' HD13 ' A' ' 14' ' ' LEU . 0.1 OUTLIER -53.36 -19.25 3.21 Favored 'General case' 0 N--CA 1.516 2.843 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 179.843 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.718 HG12 ' O ' ' A' ' 17' ' ' MET . 4.0 p -79.14 -33.34 15.72 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.534 0 C-N-CA 119.53 -0.868 . . . . 0.0 109.788 178.007 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.43 ' HA ' ' CZ ' ' A' ' 24' ' ' ARG . 3.6 mt-10 -54.44 -35.12 62.64 Favored 'General case' 0 N--CA 1.516 2.831 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 175.809 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.632 ' HB2' HD11 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -63.56 -79.95 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 105.534 -2.024 . . . . 0.0 105.534 175.205 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.569 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.2 OUTLIER -40.88 -30.19 0.12 Allowed 'General case' 0 N--CA 1.5 2.04 0 C-N-CA 123.466 0.706 . . . . 0.0 112.674 -179.837 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.43 ' CZ ' ' HA ' ' A' ' 21' ' ' GLU . 34.9 mtm180 -64.57 -46.53 82.33 Favored 'General case' 0 N--CA 1.512 2.655 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 177.398 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.8 tptp -65.66 -43.0 90.71 Favored 'General case' 0 N--CA 1.501 2.091 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.526 ' HD3' ' CH2' ' A' ' 22' ' ' TRP . 8.0 ttpp -56.89 -43.0 80.87 Favored 'General case' 0 N--CA 1.517 2.897 0 CA-C-O 121.208 0.528 . . . . 0.0 110.327 178.52 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.505 HD23 HD12 ' A' ' 23' ' ' LEU . 2.0 mm? -71.42 -40.53 70.4 Favored 'General case' 0 N--CA 1.505 2.301 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.383 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -67.85 -26.51 66.07 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.936 -0.478 . . . . 0.0 110.604 178.375 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -65.73 -52.53 50.49 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.1 p -72.21 -20.19 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.454 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.073 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.505 2.303 0 O-C-N 121.905 -0.497 . . . . 0.0 110.119 178.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.885 HD22 ' CB ' ' A' ' 19' ' ' ARG . 0.9 OUTLIER . . . . . 0 N--CA 1.507 2.418 0 CA-C-O 120.703 0.287 . . . . 0.0 110.845 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -77.88 -43.78 29.12 Favored 'General case' 0 N--CA 1.504 2.231 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 176.603 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.583 ' HA ' HD12 ' A' ' 14' ' ' LEU . 28.7 t 150.52 -57.62 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.851 0 C-N-CA 125.155 1.382 . . . . 0.0 107.694 177.602 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.1 mmt -58.52 -30.37 67.01 Favored 'General case' 0 N--CA 1.526 3.334 0 CA-C-N 121.357 1.889 . . . . 0.0 107.972 175.31 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.478 ' HB3' ' HB2' ' A' ' 14' ' ' LEU . 2.0 tt0 -55.9 -46.74 78.29 Favored 'General case' 0 N--CA 1.503 2.224 0 CA-C-O 122.396 1.093 . . . . 0.0 109.38 174.732 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.885 ' CB ' HD22 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -142.24 68.11 1.32 Allowed 'General case' 0 C--N 1.305 -1.346 0 CA-C-O 123.353 1.549 . . . . 0.0 109.391 -176.512 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.845 ' HA ' HD12 ' A' ' 23' ' ' LEU . 11.5 p -90.7 -41.84 13.63 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.557 0 N-CA-C 105.874 -1.899 . . . . 0.0 105.874 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.49 -33.45 68.03 Favored 'General case' 0 N--CA 1.511 2.581 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 173.064 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.558 ' HB3' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -53.45 -58.17 8.08 Favored 'General case' 0 N--CA 1.519 3.017 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 174.923 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.845 HD12 ' HA ' ' A' ' 20' ' ' VAL . 11.5 mt -55.97 -44.75 78.83 Favored 'General case' 0 N--CA 1.51 2.568 0 CA-C-N 114.742 -1.117 . . . . 0.0 109.269 178.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.1 ttm105 -63.92 -48.74 75.36 Favored 'General case' 0 N--CA 1.513 2.701 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.205 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -66.83 -39.37 87.65 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.832 -0.542 . . . . 0.0 110.912 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.457 ' HD3' ' CE3' ' A' ' 22' ' ' TRP . 2.5 mptp? -61.93 -33.6 74.55 Favored 'General case' 0 N--CA 1.513 2.68 0 CA-C-O 120.734 0.302 . . . . 0.0 110.563 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.25 -43.36 70.7 Favored 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 176.472 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -66.32 -25.28 66.75 Favored 'General case' 0 N--CA 1.504 2.248 0 O-C-N 122.087 -0.383 . . . . 0.0 111.271 178.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -62.24 -55.75 25.32 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.891 -0.506 . . . . 0.0 109.872 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 27.6 m -65.06 -26.21 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.979 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.619 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 . . . . . 0 N--CA 1.509 2.479 0 O-C-N 121.965 -0.459 . . . . 0.0 110.885 179.14 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.84 HD21 ' HB2' ' A' ' 22' ' ' TRP . 17.1 mt . . . . . 0 N--CA 1.5 2.047 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 56.75 110.2 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.977 0 C-N-CA 125.029 1.332 . . . . 0.0 111.718 -176.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.3 t 80.02 -142.84 0.02 OUTLIER 'General case' 0 N--CA 1.525 3.28 0 C-N-CA 123.753 0.821 . . . . 0.0 111.538 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.857 ' HA ' HG22 ' A' ' 20' ' ' VAL . 5.4 mmm -61.92 -11.42 13.02 Favored 'General case' 0 N--CA 1.524 3.266 0 O-C-N 120.904 -1.123 . . . . 0.0 112.928 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.604 ' C ' HD22 ' A' ' 14' ' ' LEU . 8.9 mm-40 -74.18 -55.13 6.43 Favored 'General case' 0 N--CA 1.503 2.185 0 N-CA-C 103.841 -2.651 . . . . 0.0 103.841 174.179 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.792 ' HA ' HD13 ' A' ' 14' ' ' LEU . 2.0 tmt_? -49.78 -27.79 5.41 Favored 'General case' 0 N--CA 1.507 2.384 0 CA-C-N 114.088 -1.415 . . . . 0.0 112.865 177.368 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.857 HG22 ' HA ' ' A' ' 17' ' ' MET . 23.3 m -88.82 -47.34 15.28 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.012 0 C-N-CA 119.491 -0.884 . . . . 0.0 111.598 -178.316 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -51.77 -34.16 38.38 Favored 'General case' 0 N--CA 1.518 2.931 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 176.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.84 ' HB2' HD21 ' A' ' 14' ' ' LEU . 14.9 t90 -61.55 -60.4 3.76 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 176.049 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.828 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -55.57 -31.18 61.96 Favored 'General case' 0 N--CA 1.507 2.378 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.545 178.654 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -77.62 -45.19 25.85 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.792 -0.568 . . . . 0.0 109.755 179.22 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.4 tptp -67.09 -34.02 76.73 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 122.047 -0.408 . . . . 0.0 111.078 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -44.62 95.06 Favored 'General case' 0 N--CA 1.513 2.708 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.54 -41.45 75.92 Favored 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 177.027 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -68.24 -18.94 64.69 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 122.017 -0.427 . . . . 0.0 111.502 178.387 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -73.64 -45.64 51.56 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.626 -0.671 . . . . 0.0 110.132 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.9 t -93.29 21.03 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.615 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.936 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 45.2 m80 . . . . . 0 N--CA 1.508 2.468 0 O-C-N 120.93 -1.106 . . . . 0.0 109.41 178.946 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 59.2 t . . . . . 0 N--CA 1.504 2.25 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.6 t 86.31 -20.72 0.23 Allowed 'General case' 0 N--CA 1.526 3.352 0 C-N-CA 123.429 0.691 . . . . 0.0 112.621 -179.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.404 ' HA ' ' HB3' ' A' ' 7' ' ' MET . 1.4 mt-10 -90.58 51.28 1.97 Allowed 'General case' 0 N--CA 1.509 2.513 0 CA-C-O 121.697 0.76 . . . . 0.0 108.999 179.401 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.511 HG13 ' HB2' ' A' ' 7' ' ' MET . 1.1 pt -63.2 176.8 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.516 2.847 0 O-C-N 121.813 -0.554 . . . . 0.0 111.339 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -47.87 -51.37 23.29 Favored 'General case' 0 N--CA 1.518 2.926 0 O-C-N 121.653 -0.655 . . . . 0.0 111.716 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.98 -42.07 85.72 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.814 -0.554 . . . . 0.0 110.284 179.522 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.511 ' HB2' HG13 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -62.5 -50.94 69.4 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.946 -0.471 . . . . 0.0 109.851 179.511 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.413 ' HA ' ' CE1' ' A' ' 13' ' ' HIS . 0.5 OUTLIER -60.13 -35.8 76.09 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 122.084 -0.385 . . . . 0.0 110.214 178.649 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -65.85 -23.34 66.65 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.983 -0.448 . . . . 0.0 110.788 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.449 ' HG ' ' HE2' ' A' ' 26' ' ' LYS . 7.1 tp -61.93 109.98 1.42 Allowed 'General case' 0 N--CA 1.504 2.272 0 CA-C-N 118.87 0.759 . . . . 0.0 109.596 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 56.69 28.09 56.18 Favored Glycine 0 N--CA 1.511 3.649 0 N-CA-C 109.919 -1.272 . . . . 0.0 109.919 -176.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 50.7 13.31 0.13 Allowed 'General case' 0 N--CA 1.523 3.177 0 C-N-CA 124.295 1.038 . . . . 0.0 112.91 -177.533 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.413 ' CE1' ' HA ' ' A' ' 8' ' ' HIS . 4.8 m170 63.6 123.62 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.352 0 CA-C-O 122.279 1.038 . . . . 0.0 109.279 -177.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.899 HD13 ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -130.83 -158.3 0.88 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.454 -0.779 . . . . 0.0 112.702 -172.847 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.403 ' C ' ' HB2' ' A' ' 19' ' ' ARG . 0.6 OUTLIER -138.79 -65.56 0.49 Allowed 'General case' 0 N--CA 1.512 2.63 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.354 -178.324 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.2 t -143.53 -78.41 0.22 Allowed 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.253 -0.904 . . . . 0.0 109.529 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.656 ' O ' HG12 ' A' ' 20' ' ' VAL . 6.1 mmm -67.9 -26.82 66.18 Favored 'General case' 0 N--CA 1.518 2.927 0 O-C-N 121.381 -0.824 . . . . 0.0 109.499 177.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.608 ' O ' HD22 ' A' ' 14' ' ' LEU . 13.5 mt-10 -76.78 -47.97 20.03 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 105.531 -2.026 . . . . 0.0 105.531 174.344 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.899 ' HA ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -53.09 -17.22 1.43 Allowed 'General case' 0 N--CA 1.514 2.743 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 -179.886 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.656 HG12 ' O ' ' A' ' 17' ' ' MET . 5.3 p -78.52 -39.27 23.28 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.743 0 C-N-CA 119.411 -0.916 . . . . 0.0 110.093 178.747 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -52.75 -35.44 56.2 Favored 'General case' 0 N--CA 1.519 3.016 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.824 ' HB2' HD21 ' A' ' 14' ' ' LEU . 54.0 t90 -60.88 -56.01 26.25 Favored 'General case' 0 N--CA 1.507 2.41 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 176.152 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.51 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -60.41 -28.93 68.64 Favored 'General case' 0 N--CA 1.505 2.292 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.149 178.871 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.424 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -75.33 -47.63 26.87 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.621 -0.674 . . . . 0.0 109.29 178.912 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.25 -24.94 64.06 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 122.148 -0.345 . . . . 0.0 110.994 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.449 ' HE2' ' HG ' ' A' ' 10' ' ' LEU . 0.1 OUTLIER -70.03 -40.39 75.19 Favored 'General case' 0 N--CA 1.507 2.418 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.422 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tt -67.34 -39.89 85.82 Favored 'General case' 0 N--CA 1.503 2.192 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 176.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.411 ' HA ' ' N ' ' A' ' 33' ' ' PHE . 57.1 tt0 -78.52 -1.59 34.63 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 122.058 -0.401 . . . . 0.0 111.346 177.673 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -88.43 -34.32 17.55 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.44 -1.412 . . . . 0.0 107.812 176.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 84.0 t -52.83 -32.02 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.807 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -164.38 28.56 0.07 Allowed 'General case' 0 N--CA 1.502 2.172 0 O-C-N 122.186 -0.321 . . . . 0.0 111.244 -177.74 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 55.27 36.77 27.76 Favored 'General case' 0 N--CA 1.513 2.705 0 N-CA-C 105.041 -2.207 . . . . 0.0 105.041 -172.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.411 ' N ' ' HA ' ' A' ' 28' ' ' GLN . 3.8 t80 -84.86 82.84 8.26 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-N 114.189 -1.369 . . . . 0.0 110.341 -176.359 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 8.0 p -47.9 123.82 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 CA-C-O 122.603 1.192 . . . . 0.0 111.543 -178.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -99.65 -147.52 0.34 Allowed 'General case' 0 N--CA 1.493 1.694 0 CA-C-N 114.262 -1.335 . . . . 0.0 108.684 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.512 2.639 0 CA-C-O 117.549 -1.215 . . . . 0.0 110.898 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 11.6 p . . . . . 0 N--CA 1.502 2.138 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 t 66.91 -178.94 0.21 Allowed 'General case' 0 N--CA 1.515 2.797 0 CA-C-O 121.085 0.469 . . . . 0.0 110.578 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -104.79 41.42 1.33 Allowed 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.518 -0.739 . . . . 0.0 109.677 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.1 pt -140.08 82.55 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.392 0 O-C-N 121.442 -0.787 . . . . 0.0 109.532 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -123.96 -64.84 1.11 Allowed 'General case' 0 N--CA 1.503 2.204 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.36 -45.82 78.83 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.642 -0.661 . . . . 0.0 109.224 178.824 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 49.5 mtt -93.65 59.03 2.8 Favored 'General case' 0 N--CA 1.503 2.204 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 178.446 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -173.98 -47.88 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.693 -0.629 . . . . 0.0 109.814 -179.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.544 ' HB3' ' CD2' ' A' ' 13' ' ' HIS . 5.1 m120 -64.08 -45.53 88.28 Favored 'General case' 0 N--CA 1.504 2.232 0 CA-C-O 119.405 -0.331 . . . . 0.0 111.211 -179.466 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.71 116.35 2.08 Favored 'General case' 0 N--CA 1.517 2.898 0 CA-C-N 118.679 0.672 . . . . 0.0 110.444 -179.532 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 96.93 -45.67 1.79 Allowed Glycine 0 N--CA 1.506 3.338 0 N-CA-C 109.337 -1.505 . . . . 0.0 109.337 -178.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -53.84 24.21 Favored 'General case' 0 N--CA 1.509 2.518 0 CA-C-N 118.039 0.919 . . . . 0.0 108.869 178.589 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.544 ' CD2' ' HB3' ' A' ' 9' ' ' ASN . 0.0 OUTLIER -78.87 -2.94 42.19 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.898 -0.502 . . . . 0.0 110.903 177.706 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.777 ' CG ' ' HA ' ' A' ' 19' ' ' ARG . 17.4 tp -60.65 131.63 51.32 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.453 -0.779 . . . . 0.0 109.762 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.406 ' CA ' ' HB2' ' A' ' 19' ' ' ARG . 3.9 p30 -163.83 152.82 13.93 Favored 'General case' 0 N--CA 1.514 2.733 0 O-C-N 121.609 -0.682 . . . . 0.0 112.084 -178.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.7 t 52.52 -136.54 1.34 Allowed 'General case' 0 N--CA 1.514 2.764 0 C-N-CA 122.991 0.516 . . . . 0.0 111.916 178.226 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.649 ' O ' HG12 ' A' ' 20' ' ' VAL . 0.1 OUTLIER -56.64 -34.51 67.37 Favored 'General case' 0 N--CA 1.519 2.976 0 O-C-N 121.085 -1.009 . . . . 0.0 111.524 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.579 ' O ' HD11 ' A' ' 14' ' ' LEU . 22.2 mt-10 -59.94 -43.64 94.86 Favored 'General case' 0 N--CA 1.513 2.702 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 177.208 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.777 ' HA ' ' CG ' ' A' ' 14' ' ' LEU . 20.9 ttt85 -61.6 -11.6 12.13 Favored 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.649 HG12 ' O ' ' A' ' 17' ' ' MET . 1.1 p -98.3 -37.21 6.29 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.725 0 C-N-CA 119.053 -1.059 . . . . 0.0 110.651 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -59.65 -40.4 87.58 Favored 'General case' 0 N--CA 1.514 2.769 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 177.17 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.591 ' HB2' ' CD1' ' A' ' 14' ' ' LEU . 7.8 t90 -61.36 -59.79 4.73 Favored 'General case' 0 N--CA 1.501 2.099 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 177.072 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.613 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -59.1 -30.79 68.36 Favored 'General case' 0 N--CA 1.506 2.368 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.233 179.432 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -72.83 -44.23 61.7 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.1 tptp -69.1 -47.03 66.26 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.905 -0.497 . . . . 0.0 110.165 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.403 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -58.49 -42.03 86.64 Favored 'General case' 0 N--CA 1.515 2.777 0 CA-C-O 120.822 0.344 . . . . 0.0 110.297 179.146 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.419 HD13 ' HA ' ' A' ' 27' ' ' LEU . 1.6 mm? -69.24 -35.3 76.0 Favored 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 176.786 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -83.16 14.91 3.13 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.657 -0.652 . . . . 0.0 111.179 178.027 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -108.18 -51.35 2.91 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.087 -1.008 . . . . 0.0 110.318 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 t -102.42 23.32 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.514 2.731 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.085 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 74.4 m80 -139.92 -46.61 0.44 Allowed 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.961 -1.087 . . . . 0.0 110.296 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -76.82 86.02 3.41 Favored 'General case' 0 N--CA 1.503 2.178 0 CA-C-O 121.419 0.628 . . . . 0.0 109.675 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -160.1 107.38 1.63 Allowed 'General case' 0 N--CA 1.502 2.163 0 N-CA-C 109.344 -0.614 . . . . 0.0 109.344 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 21.3 t 70.76 133.45 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.517 2.898 0 CA-C-O 121.633 0.73 . . . . 0.0 110.322 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -154.22 138.18 16.34 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.75 -0.593 . . . . 0.0 109.429 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.518 2.949 0 CA-C-O 117.504 -1.236 . . . . 0.0 110.411 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 2.3 m . . . . . 0 N--CA 1.504 2.273 0 CA-C-O 121.281 0.562 . . . . 0.0 109.597 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.0 t -159.47 -148.14 0.17 Allowed 'General case' 0 N--CA 1.506 2.368 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 62.77 27.95 16.28 Favored 'General case' 0 N--CA 1.517 2.879 0 O-C-N 121.49 -0.757 . . . . 0.0 111.14 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.444 HD13 ' N ' ' A' ' 5' ' ' GLN . 0.0 OUTLIER -163.37 148.2 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.309 0 O-C-N 121.218 -0.926 . . . . 0.0 109.256 179.75 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.444 ' N ' HD13 ' A' ' 4' ' ' ILE . 0.1 OUTLIER 75.59 -55.08 0.63 Allowed 'General case' 0 N--CA 1.516 2.841 0 C-N-CA 122.887 0.475 . . . . 0.0 110.482 -179.389 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.7 tt -56.76 -48.42 77.9 Favored 'General case' 0 N--CA 1.512 2.647 0 CA-C-N 119.03 0.832 . . . . 0.0 109.411 178.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 8.1 mtt -61.06 -40.12 92.43 Favored 'General case' 0 N--CA 1.508 2.45 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 56.4 m-70 -68.72 -41.26 79.28 Favored 'General case' 0 N--CA 1.509 2.524 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -74.29 -10.93 60.08 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 122.008 -0.432 . . . . 0.0 111.77 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.38 -149.21 0.04 OUTLIER 'General case' 0 N--CA 1.508 2.425 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 178.659 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.86 59.95 4.18 Favored Glycine 0 N--CA 1.511 3.678 0 O-C-N 120.3 -1.5 . . . . 0.0 109.68 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.93 20.55 2.84 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 122.108 -0.642 . . . . 0.0 110.537 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -168.84 43.74 0.03 OUTLIER 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.307 -0.87 . . . . 0.0 109.985 179.284 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.728 HD11 ' CB ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -104.46 -178.26 3.6 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 120.835 -1.166 . . . . 0.0 111.321 -179.489 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -52.89 14.63 Favored 'General case' 0 N--CA 1.507 2.381 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.608 ' HB3' HG23 ' A' ' 20' ' ' VAL . 0.5 OUTLIER 171.63 -96.0 0.0 OUTLIER 'General case' 0 C--O 1.174 -2.882 0 CA-C-O 116.657 -1.64 . . . . 0.0 107.893 178.287 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.48 ' HA ' ' HB ' ' A' ' 20' ' ' VAL . 3.0 ttm -24.21 -43.19 0.01 OUTLIER 'General case' 0 N--CA 1.539 4.0 0 CA-C-N 121.584 1.993 . . . . 0.0 116.254 -177.823 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -51.37 -41.54 60.72 Favored 'General case' 0 N--CA 1.534 3.754 0 CA-C-O 122.464 1.126 . . . . 0.0 108.741 176.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.762 ' HB3' ' CB ' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -117.7 -64.93 1.23 Allowed 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 125.3 1.44 . . . . 0.0 108.251 177.332 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.608 HG23 ' HB3' ' A' ' 16' ' ' SER . 0.3 OUTLIER 62.19 -53.76 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.518 2.968 0 C-N-CA 127.195 2.198 . . . . 0.0 112.087 175.491 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.16 -26.71 51.53 Favored 'General case' 0 N--CA 1.524 3.264 0 N-CA-C 104.842 -2.281 . . . . 0.0 104.842 169.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.762 ' CB ' ' HB3' ' A' ' 19' ' ' ARG 0.255 18.8 t90 -55.41 -57.52 11.51 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 126.826 2.051 . . . . 0.0 108.316 173.433 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 20' ' ' VAL . 0.5 OUTLIER -59.63 -28.92 67.64 Favored 'General case' 0 N--CA 1.511 2.597 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.761 178.741 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.409 ' NH1' HG13 ' A' ' 20' ' ' VAL . 0.2 OUTLIER -75.91 -39.91 55.35 Favored 'General case' 0 N--CA 1.508 2.46 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.113 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.598 ' HG3' ' HB3' ' A' ' 35' ' ' ALA . 11.5 tttp -83.22 -4.3 58.26 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 122.074 -0.391 . . . . 0.0 111.648 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.42 ' HD3' ' CZ2' ' A' ' 22' ' ' TRP . 0.8 OUTLIER -58.23 -47.73 82.61 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 121.453 -0.779 . . . . 0.0 109.801 179.897 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 pp -67.49 -36.73 81.67 Favored 'General case' 0 N--CA 1.511 2.585 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 176.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -92.87 53.28 1.98 Allowed 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -142.63 -51.33 0.37 Allowed 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.658 -0.651 . . . . 0.0 110.072 -178.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.8 t -95.76 34.98 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.622 0 CA-C-O 121.561 0.696 . . . . 0.0 109.514 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -163.89 -50.95 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.2 -0.938 . . . . 0.0 109.644 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.42 ' HB3' HG22 ' A' ' 34' ' ' VAL . 37.7 m-80 -111.95 -49.69 2.96 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 122.07 -0.394 . . . . 0.0 110.466 -179.131 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 23.0 t80 56.36 53.21 9.02 Favored 'General case' 0 N--CA 1.508 2.432 0 CA-C-O 121.743 0.782 . . . . 0.0 109.847 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.42 HG22 ' HB3' ' A' ' 32' ' ' ASN . 2.2 m -144.72 87.37 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.375 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.598 ' HB3' ' HG3' ' A' ' 25' ' ' LYS . . . 179.92 180.0 0.5 Allowed 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 -179.306 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.2 mp . . . . . 0 N--CA 1.505 2.312 0 CA-C-O 117.683 -1.151 . . . . 0.0 109.382 179.111 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 21.7 t . . . . . 0 N--CA 1.503 2.216 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 57.8 m -98.94 139.6 34.35 Favored 'General case' 0 N--CA 1.503 2.193 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -126.02 53.34 1.61 Allowed 'General case' 0 N--CA 1.501 2.076 0 CA-C-O 121.536 0.684 . . . . 0.0 109.772 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.444 ' O ' ' HB2' ' A' ' 5' ' ' GLN . 14.4 tt -64.2 154.42 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.604 0 O-C-N 121.344 -0.847 . . . . 0.0 109.138 178.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.444 ' HB2' ' O ' ' A' ' 4' ' ' ILE . 1.4 mp0 75.97 -54.29 0.61 Allowed 'General case' 0 N--CA 1.519 3.017 0 C-N-CA 123.054 0.541 . . . . 0.0 110.0 -178.498 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.98 -52.42 42.91 Favored 'General case' 0 N--CA 1.506 2.361 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 178.365 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 35.8 mtt -67.75 -32.72 73.51 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.539 -0.726 . . . . 0.0 109.043 177.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.459 ' HA ' ' HG3' ' A' ' 12' ' ' LYS . 50.8 t-80 -75.18 -16.08 60.53 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.94 -0.475 . . . . 0.0 111.804 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 24.1 m120 -133.57 -61.94 0.79 Allowed 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.796 -1.19 . . . . 0.0 110.755 -178.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.8 tt -66.82 103.28 1.08 Allowed 'General case' 0 N--CA 1.506 2.326 0 CA-C-O 121.532 0.682 . . . . 0.0 109.705 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.452 ' HA2' ' HG3' ' A' ' 19' ' ' ARG . . . 77.76 15.56 81.12 Favored Glycine 0 N--CA 1.5 2.91 0 CA-C-O 119.403 -0.665 . . . . 0.0 111.621 -179.207 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.459 ' HG3' ' HA ' ' A' ' 8' ' ' HIS . 0.0 OUTLIER -66.18 -37.9 86.74 Favored 'General case' 0 N--CA 1.508 2.463 0 CA-C-N 119.714 1.757 . . . . 0.0 109.037 178.38 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -73.76 -29.35 62.16 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 122.179 -0.325 . . . . 0.0 111.623 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.961 HD11 ' HA ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -120.85 27.74 8.32 Favored 'General case' 0 N--CA 1.504 2.268 0 CA-C-N 118.84 0.745 . . . . 0.0 111.432 -178.221 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.613 ' CB ' ' HB2' ' A' ' 18' ' ' GLU . 1.3 m-20 70.52 159.36 0.19 Allowed 'General case' 0 N--CA 1.528 3.433 0 O-C-N 120.93 -1.106 . . . . 0.0 111.119 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.3 m -66.24 -75.89 0.09 Allowed 'General case' 0 N--CA 1.519 2.993 0 O-C-N 121.343 -0.848 . . . . 0.0 112.015 -177.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.524 ' O ' HG12 ' A' ' 20' ' ' VAL . 0.3 OUTLIER -68.26 -22.93 64.73 Favored 'General case' 0 N--CA 1.516 2.869 0 O-C-N 121.196 -0.94 . . . . 0.0 110.435 179.475 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.613 ' HB2' ' CB ' ' A' ' 15' ' ' ASN . 4.6 mt-10 -65.81 -37.92 87.56 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 175.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.961 ' HA ' HD11 ' A' ' 14' ' ' LEU . 0.1 OUTLIER -59.17 -35.06 72.89 Favored 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -179.936 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.76 ' HA ' HD23 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -79.61 -43.21 23.23 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.113 0 C-N-CA 118.216 -1.394 . . . . 0.0 110.312 -178.938 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -56.17 -40.03 73.28 Favored 'General case' 0 N--CA 1.511 2.576 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 177.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.61 ' CE3' ' HD2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -68.96 -70.05 0.29 Allowed 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 176.891 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.76 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -39.61 -33.17 0.16 Allowed 'General case' 0 N--CA 1.518 2.953 0 C-N-CA 123.333 0.653 . . . . 0.0 112.102 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.18 -50.56 72.64 Favored 'General case' 0 N--CA 1.509 2.483 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 177.115 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -31.39 67.03 Favored 'General case' 0 N--CA 1.504 2.273 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 175.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.61 ' HD2' ' CE3' ' A' ' 22' ' ' TRP . 1.5 tttm -62.68 -32.4 73.46 Favored 'General case' 0 N--CA 1.52 3.037 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 178.733 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tt -74.47 -44.61 50.77 Favored 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 176.149 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.73 ' HA ' ' HB2' ' A' ' 32' ' ' ASN . 22.9 mt-30 -68.14 -8.16 36.06 Favored 'General case' 0 N--CA 1.519 3.021 0 O-C-N 122.172 -0.33 . . . . 0.0 111.379 176.614 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.83 -37.93 76.35 Favored 'General case' 0 C--N 1.31 -1.11 0 C-N-CA 119.702 -0.799 . . . . 0.0 108.876 178.746 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.5 t -90.55 43.26 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.331 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 173.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 77.3 m80 64.11 8.61 4.14 Favored 'General case' 0 N--CA 1.503 2.209 0 C-N-CA 124.107 0.963 . . . . 0.0 112.316 -177.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.73 ' HB2' ' HA ' ' A' ' 28' ' ' GLN . 35.5 t30 64.57 49.51 2.35 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 -179.041 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -85.13 91.24 8.07 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.146 -178.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.5 p -150.67 129.18 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 CA-C-O 121.577 0.703 . . . . 0.0 109.183 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -159.38 138.46 11.12 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.332 0.586 . . . . 0.0 109.593 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.7 tp . . . . . 0 N--CA 1.504 2.23 0 CA-C-O 117.661 -1.161 . . . . 0.0 110.207 -179.981 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 41.9 t . . . . . 0 N--CA 1.506 2.333 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.3 m 73.17 139.52 0.06 Allowed 'General case' 0 N--CA 1.52 3.032 0 C-N-CA 123.002 0.521 . . . . 0.0 110.36 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.533 ' O ' HG23 ' A' ' 4' ' ' ILE . 4.7 mp0 58.08 37.43 26.47 Favored 'General case' 0 N--CA 1.517 2.901 0 CA-C-O 121.156 0.503 . . . . 0.0 110.38 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.764 HG22 ' HA ' ' A' ' 9' ' ' ASN . 1.1 pt -162.65 79.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.517 2.914 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.1 pm0 -97.66 56.71 1.31 Allowed 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.908 -178.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.6 tp 51.84 41.95 29.71 Favored 'General case' 0 N--CA 1.521 3.086 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 -177.058 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.7 mtp -174.27 -59.24 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 -174.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.657 ' HB3' ' HA ' ' A' ' 4' ' ' ILE . 5.6 t-160 -64.21 -19.41 65.33 Favored 'General case' 0 CA--C 1.567 1.626 0 CA-C-N 114.308 -1.315 . . . . 0.0 109.328 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.764 ' HA ' HG22 ' A' ' 4' ' ' ILE . 5.6 t-20 -81.15 -33.26 33.24 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.262 -0.899 . . . . 0.0 109.524 176.106 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.462 ' HB3' ' HA ' ' A' ' 13' ' ' HIS . 8.4 mp -83.64 133.81 34.81 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.506 -0.746 . . . . 0.0 110.722 -178.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -79.08 93.04 1.28 Allowed Glycine 0 N--CA 1.5 2.948 0 N-CA-C 107.251 -2.34 . . . . 0.0 107.251 178.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 47.08 38.03 6.01 Favored 'General case' 0 N--CA 1.528 3.428 0 CA-C-O 122.025 0.917 . . . . 0.0 108.607 -175.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.462 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 0.8 OUTLIER 68.52 108.64 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.927 0.891 . . . . 0.0 108.967 -175.959 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.863 HD13 ' HA ' ' A' ' 19' ' ' ARG . 59.3 mt -79.98 -172.72 3.54 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.958 0.885 . . . . 0.0 110.432 179.433 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -160.86 -83.24 0.04 OUTLIER 'General case' 0 N--CA 1.51 2.569 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.75 179.094 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.537 ' O ' HG13 ' A' ' 20' ' ' VAL . 16.7 t -128.66 -63.0 1.0 Allowed 'General case' 0 N--CA 1.506 2.356 0 CA-C-N 119.411 1.005 . . . . 0.0 109.414 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.728 ' HA ' HG22 ' A' ' 20' ' ' VAL . 32.9 mmt -92.12 -10.1 40.14 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.482 -0.761 . . . . 0.0 109.77 177.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.685 ' C ' HD22 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -81.26 -50.1 9.95 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 105.335 -2.098 . . . . 0.0 105.335 174.564 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.863 ' HA ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -54.16 -27.66 35.09 Favored 'General case' 0 N--CA 1.514 2.729 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.639 178.013 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.728 HG22 ' HA ' ' A' ' 17' ' ' MET . 33.8 m -86.88 -45.23 16.46 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.142 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.914 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -50.26 -41.18 50.0 Favored 'General case' 0 N--CA 1.52 3.075 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 176.001 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.653 ' HB2' HD21 ' A' ' 14' ' ' LEU . 28.0 t90 -60.41 -58.33 8.96 Favored 'General case' 0 N--CA 1.508 2.464 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 176.099 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.698 ' C ' HD13 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -55.46 -31.3 61.84 Favored 'General case' 0 N--CA 1.509 2.498 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.175 178.604 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.577 ' N ' HD13 ' A' ' 23' ' ' LEU . 1.4 ttp85 -80.66 -46.67 15.24 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.764 -0.585 . . . . 0.0 109.931 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.54 -31.09 72.15 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.775 -0.578 . . . . 0.0 110.792 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.441 ' HD3' ' CE3' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -65.17 -41.4 94.68 Favored 'General case' 0 N--CA 1.51 2.55 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 178.661 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.61 -41.96 68.27 Favored 'General case' 0 N--CA 1.504 2.261 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 176.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -21.68 66.75 Favored 'General case' 0 N--CA 1.505 2.293 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 178.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.14 -43.9 97.81 Favored 'General case' 0 N--CA 1.506 2.356 0 CA-C-O 121.045 0.45 . . . . 0.0 110.372 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 38.6 t -75.11 -31.91 25.65 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 178.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 17.3 m80 -57.34 -40.54 78.22 Favored 'General case' 0 N--CA 1.512 2.673 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -71.38 -54.4 10.85 Favored 'General case' 0 N--CA 1.504 2.242 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 71.31 132.73 0.04 OUTLIER 'General case' 0 N--CA 1.508 2.463 0 CA-C-O 121.462 0.649 . . . . 0.0 110.592 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.7 t -100.41 35.25 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.513 2.721 0 O-C-N 121.624 -0.672 . . . . 0.0 109.979 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -165.05 133.98 3.43 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.059 -1.026 . . . . 0.0 109.663 179.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.512 2.629 0 CA-C-O 117.638 -1.173 . . . . 0.0 110.361 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.527 ' HA ' ' HB2' ' A' ' 7' ' ' MET . 47.8 t . . . . . 0 N--CA 1.507 2.409 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 t 79.69 -49.28 0.38 Allowed 'General case' 0 N--CA 1.521 3.084 0 C-N-CA 123.234 0.613 . . . . 0.0 111.692 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 -100.01 43.43 1.06 Allowed 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 24.2 mm 70.5 154.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.519 3.002 0 O-C-N 121.801 -0.562 . . . . 0.0 110.673 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 72.89 148.61 0.09 Allowed 'General case' 0 N--CA 1.513 2.686 0 C-N-CA 123.086 0.555 . . . . 0.0 109.634 -178.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.2 mp 71.75 -73.13 0.1 Allowed 'General case' 0 N--CA 1.523 3.192 0 N-CA-C 104.388 -2.449 . . . . 0.0 104.388 -175.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.527 ' HB2' ' HA ' ' A' ' 1' ' ' VAL . 1.9 ttp -71.87 135.32 46.53 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 103.89 -2.633 . . . . 0.0 103.89 171.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.434 ' CB ' ' O ' ' A' ' 7' ' ' MET . 1.9 t60 89.11 -53.95 0.03 OUTLIER 'General case' 0 N--CA 1.525 3.291 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -177.577 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -60.41 -41.88 94.83 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 122.022 -0.423 . . . . 0.0 110.221 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -66.36 136.68 56.12 Favored 'General case' 0 N--CA 1.505 2.305 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 178.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -118.79 -58.65 0.27 Allowed Glycine 0 N--CA 1.507 3.391 0 C-N-CA 120.593 -0.813 . . . . 0.0 113.036 -176.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.44 53.75 2.4 Favored 'General case' 0 N--CA 1.517 2.925 0 CA-C-N 119.036 1.418 . . . . 0.0 110.288 -178.705 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -174.74 -60.85 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.761 HD22 ' HA ' ' A' ' 19' ' ' ARG . 3.8 mt 54.59 -166.2 0.09 Allowed 'General case' 0 N--CA 1.51 2.535 0 C-N-CA 123.288 0.635 . . . . 0.0 112.051 178.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -148.96 -65.15 0.23 Allowed 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.673 -0.642 . . . . 0.0 111.272 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.481 ' O ' HG13 ' A' ' 20' ' ' VAL . 35.3 t -139.45 -97.52 0.16 Allowed 'General case' 0 N--CA 1.512 2.657 0 CA-C-N 119.413 1.006 . . . . 0.0 110.331 -179.073 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.797 ' HA ' HG22 ' A' ' 20' ' ' VAL . 5.3 ttt -70.74 -13.23 61.98 Favored 'General case' 0 N--CA 1.519 2.986 0 CA-C-N 119.826 1.194 . . . . 0.0 110.358 178.585 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.644 ' C ' HD22 ' A' ' 14' ' ' LEU . 1.9 mm-40 -76.21 -51.87 11.21 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 103.697 -2.705 . . . . 0.0 103.697 174.105 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.761 ' HA ' HD22 ' A' ' 14' ' ' LEU . 1.4 tmm_? -51.21 -31.02 19.01 Favored 'General case' 0 N--CA 1.506 2.33 0 CA-C-N 114.262 -1.335 . . . . 0.0 112.53 177.516 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.797 HG22 ' HA ' ' A' ' 17' ' ' MET . 29.6 m -85.17 -47.41 16.97 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.216 0 C-N-CA 119.601 -0.839 . . . . 0.0 111.596 -177.602 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -52.57 -39.39 61.47 Favored 'General case' 0 N--CA 1.523 3.224 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 176.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.64 ' CG ' HD11 ' A' ' 14' ' ' LEU . 8.4 t90 -64.84 -59.1 4.59 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 176.482 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.667 ' C ' HD13 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -50.24 -35.04 25.16 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 124.26 1.024 . . . . 0.0 110.154 178.212 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.568 ' N ' HD13 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -74.43 -49.1 23.78 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.894 -0.504 . . . . 0.0 109.936 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.401 ' HA ' ' HD2' ' A' ' 25' ' ' LYS . 7.4 tptp -64.93 -41.77 95.25 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.927 -0.483 . . . . 0.0 110.807 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.535 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -64.28 -43.29 95.24 Favored 'General case' 0 N--CA 1.511 2.601 0 CA-C-O 120.911 0.386 . . . . 0.0 110.408 179.643 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.34 -40.16 93.29 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.424 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 32.9 tp60 -70.08 -28.23 65.26 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 122.078 -0.389 . . . . 0.0 111.137 178.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -68.62 -47.26 67.1 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-O 121.48 0.657 . . . . 0.0 109.386 178.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.9 t -90.18 20.48 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.51 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.361 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -88.78 -48.12 7.73 Favored 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 177.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.56 158.13 25.85 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 178.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 66.59 24.14 10.22 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 122.183 -0.323 . . . . 0.0 111.736 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 5.3 t -135.66 34.87 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.513 2.695 0 O-C-N 121.254 -0.904 . . . . 0.0 108.936 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . 72.57 133.55 0.04 OUTLIER 'General case' 0 N--CA 1.512 2.627 0 CA-C-O 121.564 0.697 . . . . 0.0 109.839 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.505 2.316 0 CA-C-O 117.676 -1.154 . . . . 0.0 110.192 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 10.7 m . . . . . 0 N--CA 1.507 2.425 0 CA-C-O 120.909 0.385 . . . . 0.0 110.182 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.18 163.47 24.03 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.716 -0.615 . . . . 0.0 109.732 179.29 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -108.87 48.45 0.86 Allowed 'General case' 0 N--CA 1.504 2.239 0 CA-C-O 121.7 0.762 . . . . 0.0 108.969 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.6 mm 62.43 21.77 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.516 2.843 0 O-C-N 121.763 -0.585 . . . . 0.0 110.938 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.56 -37.41 73.99 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 120.835 -1.165 . . . . 0.0 110.127 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.5 mt -68.3 -48.02 66.05 Favored 'General case' 0 N--CA 1.504 2.25 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 23.5 mmt -61.27 -41.07 96.32 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 122.132 -0.355 . . . . 0.0 110.101 178.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 3.6 m80 -62.74 -23.42 67.18 Favored 'General case' 0 N--CA 1.514 2.734 0 CA-C-N 118.174 0.443 . . . . 0.0 111.069 178.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -118.54 40.22 3.28 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.542 -0.724 . . . . 0.0 109.185 179.15 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.4 -170.51 2.04 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.517 -0.739 . . . . 0.0 110.552 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.67 70.92 2.18 Favored Glycine 0 N--CA 1.505 3.239 0 O-C-N 121.264 -0.897 . . . . 0.0 111.412 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -153.67 23.83 0.52 Allowed 'General case' 0 N--CA 1.513 2.707 0 O-C-N 122.137 -0.625 . . . . 0.0 110.113 178.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -174.79 -52.88 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.996 0 O-C-N 121.224 -0.923 . . . . 0.0 108.54 -178.333 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.869 HD21 ' HB2' ' A' ' 22' ' ' TRP . 87.2 mt 66.9 175.88 0.24 Allowed 'General case' 0 N--CA 1.501 2.125 0 CA-C-O 122.372 1.082 . . . . 0.0 112.648 179.403 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -167.68 -52.54 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.757 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.944 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.486 ' O ' HG13 ' A' ' 20' ' ' VAL . 18.8 p -153.63 -91.1 0.05 OUTLIER 'General case' 0 N--CA 1.511 2.589 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.825 ' HA ' HG22 ' A' ' 20' ' ' VAL . 2.3 mmt -72.41 -14.82 61.79 Favored 'General case' 0 N--CA 1.514 2.775 0 CA-C-N 119.343 0.974 . . . . 0.0 109.068 176.282 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.727 ' C ' HD22 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -72.47 -55.67 6.62 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 103.871 -2.64 . . . . 0.0 103.871 173.375 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.83 ' HA ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -49.79 -28.62 6.52 Favored 'General case' 0 N--CA 1.508 2.443 0 CA-C-N 114.058 -1.428 . . . . 0.0 112.687 178.499 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.825 HG22 ' HA ' ' A' ' 17' ' ' MET . 32.7 m -87.13 -48.95 15.17 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.152 0 C-N-CA 119.308 -0.957 . . . . 0.0 111.213 -178.316 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.428 ' HA ' ' HD2' ' A' ' 24' ' ' ARG . 0.5 OUTLIER -51.26 -35.74 38.73 Favored 'General case' 0 N--CA 1.514 2.766 0 N-CA-C 107.85 -1.166 . . . . 0.0 107.85 176.171 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.869 ' HB2' HD21 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -67.89 -73.52 0.14 Allowed 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 106.513 -1.662 . . . . 0.0 106.513 175.124 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.706 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.4 OUTLIER -39.7 -30.06 0.07 Allowed 'General case' 0 N--CA 1.511 2.612 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -178.898 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -59.23 -40.66 86.58 Favored 'General case' 0 N--CA 1.512 2.655 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 176.026 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? -85.15 -17.18 38.02 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 123.416 0.686 . . . . 0.0 111.561 177.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.708 ' HG2' ' CE3' ' A' ' 22' ' ' TRP . 0.2 OUTLIER -71.16 -38.12 72.2 Favored 'General case' 0 N--CA 1.525 3.292 0 O-C-N 121.473 -0.767 . . . . 0.0 109.969 179.314 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 tp -71.38 -48.13 51.85 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 177.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -66.81 -15.94 63.94 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 122.309 -0.244 . . . . 0.0 111.289 177.301 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.537 ' HB3' ' HA ' ' A' ' 35' ' ' ALA . 0.3 OUTLIER -62.98 -46.57 87.06 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.932 -0.48 . . . . 0.0 110.547 179.434 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.441 HG22 ' HB2' ' A' ' 35' ' ' ALA . 17.2 t -81.85 -8.23 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.2 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -89.08 -49.94 6.46 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.338 -0.851 . . . . 0.0 109.448 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -95.63 -41.15 9.05 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 122.022 -0.424 . . . . 0.0 110.683 -179.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -106.96 -151.9 0.47 Allowed 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.428 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 4.0 t -125.04 42.91 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.494 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.537 ' HA ' ' HB3' ' A' ' 29' ' ' ASP . . . 76.18 139.3 0.07 Allowed 'General case' 0 N--CA 1.509 2.515 0 CA-C-O 121.536 0.684 . . . . 0.0 110.477 -179.334 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.7 tt . . . . . 0 N--CA 1.504 2.275 0 CA-C-O 118.564 -0.731 . . . . 0.0 109.593 -179.719 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 51.8 t . . . . . 0 N--CA 1.503 2.198 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.3 m -131.13 160.99 33.12 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 122.024 -0.423 . . . . 0.0 109.97 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.16 48.17 0.85 Allowed 'General case' 0 N--CA 1.503 2.19 0 CA-C-O 121.836 0.827 . . . . 0.0 109.067 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.3 mt -94.77 150.84 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.384 0 O-C-N 121.526 -0.734 . . . . 0.0 109.278 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 75.09 -62.29 0.46 Allowed 'General case' 0 N--CA 1.521 3.122 0 C-N-CA 123.401 0.681 . . . . 0.0 110.718 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.4 -43.99 92.88 Favored 'General case' 0 N--CA 1.511 2.597 0 CA-C-N 118.639 0.654 . . . . 0.0 110.26 179.777 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 29.3 ttm -60.69 -47.45 86.19 Favored 'General case' 0 N--CA 1.51 2.555 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 64.9 t60 -64.05 -36.23 83.32 Favored 'General case' 0 N--CA 1.507 2.415 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 178.423 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.43 ' HB3' ' CE1' ' A' ' 13' ' ' HIS . 0.1 OUTLIER -65.55 -19.05 65.76 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.788 -0.57 . . . . 0.0 111.528 179.667 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.6 tt -55.6 118.68 4.73 Favored 'General case' 0 N--CA 1.51 2.574 0 CA-C-N 119.048 0.84 . . . . 0.0 109.631 179.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 108.18 -30.63 8.72 Favored Glycine 0 N--CA 1.504 3.187 0 N-CA-C 110.258 -1.137 . . . . 0.0 110.258 -178.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.7 mttp -91.68 -42.0 10.41 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-N 118.783 1.292 . . . . 0.0 109.908 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.43 ' CE1' ' HB3' ' A' ' 9' ' ' ASN . 0.8 OUTLIER -85.78 63.66 8.17 Favored 'General case' 0 N--CA 1.512 2.674 0 CA-C-O 121.4 0.619 . . . . 0.0 111.333 -179.211 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.934 HD13 ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -101.15 -152.45 0.43 Allowed 'General case' 0 N--CA 1.511 2.589 0 O-C-N 121.064 -1.022 . . . . 0.0 108.718 178.663 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -148.43 -66.52 0.24 Allowed 'General case' 0 N--CA 1.515 2.783 0 O-C-N 121.241 -0.912 . . . . 0.0 111.311 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.0 t -141.26 -79.2 0.26 Allowed 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.437 -0.789 . . . . 0.0 109.124 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.718 ' O ' HG12 ' A' ' 20' ' ' VAL . 3.6 tmm? -69.1 -26.1 64.75 Favored 'General case' 0 N--CA 1.514 2.75 0 O-C-N 121.365 -0.835 . . . . 0.0 109.329 177.61 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.646 ' O ' HD22 ' A' ' 14' ' ' LEU . 27.3 mt-10 -76.89 -46.85 22.94 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 174.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.934 ' HA ' HD13 ' A' ' 14' ' ' LEU . 0.1 OUTLIER -53.36 -19.25 3.21 Favored 'General case' 0 N--CA 1.516 2.843 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 179.843 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.718 HG12 ' O ' ' A' ' 17' ' ' MET . 4.0 p -79.14 -33.34 15.72 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.534 0 C-N-CA 119.53 -0.868 . . . . 0.0 109.788 178.007 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.43 ' HA ' ' CZ ' ' A' ' 24' ' ' ARG . 3.6 mt-10 -54.44 -35.12 62.64 Favored 'General case' 0 N--CA 1.516 2.831 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 175.809 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.632 ' HB2' HD11 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -63.56 -79.95 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 105.534 -2.024 . . . . 0.0 105.534 175.205 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.569 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.2 OUTLIER -40.88 -30.19 0.12 Allowed 'General case' 0 N--CA 1.5 2.04 0 C-N-CA 123.466 0.706 . . . . 0.0 112.674 -179.837 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.43 ' CZ ' ' HA ' ' A' ' 21' ' ' GLU . 34.9 mtm180 -64.57 -46.53 82.33 Favored 'General case' 0 N--CA 1.512 2.655 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 177.398 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.8 tptp -65.66 -43.0 90.71 Favored 'General case' 0 N--CA 1.501 2.091 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.526 ' HD3' ' CH2' ' A' ' 22' ' ' TRP . 8.0 ttpp -56.89 -43.0 80.87 Favored 'General case' 0 N--CA 1.517 2.897 0 CA-C-O 121.208 0.528 . . . . 0.0 110.327 178.52 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.505 HD23 HD12 ' A' ' 23' ' ' LEU . 2.0 mm? -71.42 -40.53 70.4 Favored 'General case' 0 N--CA 1.505 2.301 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.383 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -67.85 -26.51 66.07 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.936 -0.478 . . . . 0.0 110.604 178.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -65.73 -52.53 50.49 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.1 p -72.21 -20.19 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.454 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.073 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -76.69 -35.16 58.06 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.905 -0.497 . . . . 0.0 110.119 178.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.9 m120 -97.74 112.55 24.4 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.59 -0.694 . . . . 0.0 109.553 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 17.5 p90 -147.08 45.78 1.16 Allowed 'General case' 0 N--CA 1.512 2.63 0 CA-C-O 121.537 0.684 . . . . 0.0 109.687 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.0 m -115.03 97.55 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 O-C-N 121.318 -0.864 . . . . 0.0 109.561 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.28 -27.27 38.58 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.817 -0.552 . . . . 0.0 111.237 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.507 2.375 0 CA-C-O 119.037 -0.506 . . . . 0.0 110.492 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 47.9 t . . . . . 0 N--CA 1.505 2.296 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -81.97 168.56 17.74 Favored 'General case' 0 N--CA 1.507 2.413 0 CA-C-O 121.238 0.542 . . . . 0.0 110.385 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.85 -23.86 66.76 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.944 -0.472 . . . . 0.0 112.01 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.643 HD13 ' N ' ' A' ' 5' ' ' GLN . 0.0 OUTLIER -120.88 140.98 43.33 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.125 0 CA-C-O 121.351 0.596 . . . . 0.0 109.734 179.722 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.643 ' N ' HD13 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -161.57 -70.75 0.06 Allowed 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 179.585 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.441 HD13 ' O ' ' A' ' 9' ' ' ASN . 3.4 mm? -63.71 -27.41 69.19 Favored 'General case' 0 N--CA 1.514 2.752 0 O-C-N 121.787 -0.571 . . . . 0.0 110.997 179.552 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 12.6 ttt -60.26 -39.46 86.87 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 121.407 -0.808 . . . . 0.0 108.948 178.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 75.9 t60 -76.46 -45.21 32.25 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 108.677 -0.861 . . . . 0.0 108.677 177.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.445 ' HA ' ' HA ' ' A' ' 15' ' ' ASN . 0.2 OUTLIER -108.42 87.25 2.45 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 178.935 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.46 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 0.4 OUTLIER -74.2 143.29 45.25 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.686 -0.634 . . . . 0.0 110.372 -179.856 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 92.65 -13.08 68.31 Favored Glycine 0 CA--C 1.555 2.555 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 -177.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 88.67 25.76 0.03 OUTLIER 'General case' 0 N--CA 1.526 3.341 0 C-N-CA 125.132 1.373 . . . . 0.0 109.861 -177.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -170.74 -76.63 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.49 0 O-C-N 120.931 -1.105 . . . . 0.0 110.405 -179.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.885 HD22 ' CB ' ' A' ' 19' ' ' ARG . 0.9 OUTLIER -64.26 159.97 19.67 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.684 -0.635 . . . . 0.0 110.845 179.834 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.445 ' HA ' ' HA ' ' A' ' 9' ' ' ASN . 9.8 p30 -77.88 -43.78 29.12 Favored 'General case' 0 N--CA 1.504 2.231 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 176.603 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.583 ' HA ' HD12 ' A' ' 14' ' ' LEU . 28.7 t 150.52 -57.62 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.851 0 C-N-CA 125.155 1.382 . . . . 0.0 107.694 177.602 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.1 mmt -58.52 -30.37 67.01 Favored 'General case' 0 N--CA 1.526 3.334 0 CA-C-N 121.357 1.889 . . . . 0.0 107.972 175.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.478 ' HB3' ' HB2' ' A' ' 14' ' ' LEU . 2.0 tt0 -55.9 -46.74 78.29 Favored 'General case' 0 N--CA 1.503 2.224 0 CA-C-O 122.396 1.093 . . . . 0.0 109.38 174.732 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.885 ' CB ' HD22 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -142.24 68.11 1.32 Allowed 'General case' 0 C--N 1.305 -1.346 0 CA-C-O 123.353 1.549 . . . . 0.0 109.391 -176.512 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.845 ' HA ' HD12 ' A' ' 23' ' ' LEU . 11.5 p -90.7 -41.84 13.63 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.557 0 N-CA-C 105.874 -1.899 . . . . 0.0 105.874 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.49 -33.45 68.03 Favored 'General case' 0 N--CA 1.511 2.581 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 173.064 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.558 ' HB3' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -53.45 -58.17 8.08 Favored 'General case' 0 N--CA 1.519 3.017 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 174.923 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.845 HD12 ' HA ' ' A' ' 20' ' ' VAL . 11.5 mt -55.97 -44.75 78.83 Favored 'General case' 0 N--CA 1.51 2.568 0 CA-C-N 114.742 -1.117 . . . . 0.0 109.269 178.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.1 ttm105 -63.92 -48.74 75.36 Favored 'General case' 0 N--CA 1.513 2.701 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.205 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -66.83 -39.37 87.65 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.832 -0.542 . . . . 0.0 110.912 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.457 ' HD3' ' CE3' ' A' ' 22' ' ' TRP . 2.5 mptp? -61.93 -33.6 74.55 Favored 'General case' 0 N--CA 1.513 2.68 0 CA-C-O 120.734 0.302 . . . . 0.0 110.563 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.25 -43.36 70.7 Favored 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 176.472 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -66.32 -25.28 66.75 Favored 'General case' 0 N--CA 1.504 2.248 0 O-C-N 122.087 -0.383 . . . . 0.0 111.271 178.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -62.24 -55.75 25.32 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.891 -0.506 . . . . 0.0 109.872 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 27.6 m -65.06 -26.21 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.979 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.619 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -82.17 -17.48 46.1 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.965 -0.459 . . . . 0.0 110.885 179.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -88.81 -14.11 37.78 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.251 -0.906 . . . . 0.0 112.255 -179.57 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -110.37 71.56 0.76 Allowed 'General case' 0 N--CA 1.507 2.392 0 CA-C-N 119.524 1.056 . . . . 0.0 110.277 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -149.07 104.97 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.606 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.447 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -148.7 -152.21 0.43 Allowed 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.663 -0.648 . . . . 0.0 109.343 -179.548 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.1 tp . . . . . 0 N--CA 1.503 2.224 0 CA-C-O 117.646 -1.169 . . . . 0.0 109.929 -179.972 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 11.1 m . . . . . 0 N--CA 1.508 2.428 0 CA-C-O 121.126 0.488 . . . . 0.0 110.456 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.5 t -83.44 -176.52 6.35 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.887 -0.508 . . . . 0.0 110.49 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 63.05 49.84 3.3 Favored 'General case' 0 N--CA 1.509 2.505 0 CA-C-O 121.494 0.664 . . . . 0.0 110.635 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.425 ' HB ' ' HB2' ' A' ' 7' ' ' MET . 1.4 pt -81.56 90.8 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.508 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 178.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.673 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 1.4 mp0 -94.59 -67.57 0.85 Allowed 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.761 -0.587 . . . . 0.0 110.075 -178.291 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.0 pp -53.68 -18.18 2.83 Favored 'General case' 0 N--CA 1.523 3.207 0 CA-C-N 119.353 0.978 . . . . 0.0 110.455 177.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.425 ' HB2' ' HB ' ' A' ' 4' ' ' ILE . 15.2 mmm -59.04 -42.13 89.51 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-N 118.964 0.802 . . . . 0.0 109.808 177.083 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.538 ' HB3' ' HB2' ' A' ' 10' ' ' LEU . 55.2 t60 -109.35 24.25 13.35 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 176.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 44.04 53.3 6.5 Favored 'General case' 0 N--CA 1.525 3.279 0 CA-C-O 124.548 2.118 . . . . 0.0 105.372 -175.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.884 ' HA ' HD12 ' A' ' 14' ' ' LEU . 2.7 tp -109.58 152.37 25.6 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 110.989 -2.823 . . . . 0.0 111.937 -171.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -116.96 27.91 7.58 Favored Glycine 0 N--CA 1.499 2.896 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 178.276 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 76.82 26.59 0.79 Allowed 'General case' 0 N--CA 1.513 2.709 0 CA-C-N 117.767 0.783 . . . . 0.0 109.109 -177.347 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 178.17 -106.27 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.653 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.884 HD12 ' HA ' ' A' ' 10' ' ' LEU . 17.1 mt 65.72 -108.37 0.15 Allowed 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 119.558 1.072 . . . . 0.0 112.986 176.601 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 56.75 110.2 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.977 0 C-N-CA 125.029 1.332 . . . . 0.0 111.718 -176.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.3 t 80.02 -142.84 0.02 OUTLIER 'General case' 0 N--CA 1.525 3.28 0 C-N-CA 123.753 0.821 . . . . 0.0 111.538 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.857 ' HA ' HG22 ' A' ' 20' ' ' VAL . 5.4 mmm -61.92 -11.42 13.02 Favored 'General case' 0 N--CA 1.524 3.266 0 O-C-N 120.904 -1.123 . . . . 0.0 112.928 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.604 ' C ' HD22 ' A' ' 14' ' ' LEU . 8.9 mm-40 -74.18 -55.13 6.43 Favored 'General case' 0 N--CA 1.503 2.185 0 N-CA-C 103.841 -2.651 . . . . 0.0 103.841 174.179 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.792 ' HA ' HD13 ' A' ' 14' ' ' LEU . 2.0 tmt_? -49.78 -27.79 5.41 Favored 'General case' 0 N--CA 1.507 2.384 0 CA-C-N 114.088 -1.415 . . . . 0.0 112.865 177.368 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.857 HG22 ' HA ' ' A' ' 17' ' ' MET . 23.3 m -88.82 -47.34 15.28 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.012 0 C-N-CA 119.491 -0.884 . . . . 0.0 111.598 -178.316 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -51.77 -34.16 38.38 Favored 'General case' 0 N--CA 1.518 2.931 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 176.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.84 ' HB2' HD21 ' A' ' 14' ' ' LEU . 14.9 t90 -61.55 -60.4 3.76 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 176.049 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.828 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -55.57 -31.18 61.96 Favored 'General case' 0 N--CA 1.507 2.378 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.545 178.654 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -77.62 -45.19 25.85 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.792 -0.568 . . . . 0.0 109.755 179.22 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.4 tptp -67.09 -34.02 76.73 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 122.047 -0.408 . . . . 0.0 111.078 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -44.62 95.06 Favored 'General case' 0 N--CA 1.513 2.708 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.54 -41.45 75.92 Favored 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 177.027 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -68.24 -18.94 64.69 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 122.017 -0.427 . . . . 0.0 111.502 178.387 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -73.64 -45.64 51.56 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.626 -0.671 . . . . 0.0 110.132 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.9 t -93.29 21.03 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.615 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.936 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 45.2 m80 -139.31 -52.66 0.55 Allowed 'General case' 0 N--CA 1.508 2.468 0 O-C-N 120.93 -1.106 . . . . 0.0 109.41 178.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.7 m-80 -103.39 88.64 3.16 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 5.8 p90 -132.23 75.16 1.62 Allowed 'General case' 0 N--CA 1.506 2.369 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.5 m 39.89 73.97 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.522 3.139 0 CA-C-O 121.999 0.904 . . . . 0.0 111.886 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -147.69 -149.44 0.29 Allowed 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.505 2.287 0 CA-C-O 117.689 -1.148 . . . . 0.0 110.124 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.899 HD13 ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.942 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.403 ' C ' ' HB2' ' A' ' 19' ' ' ARG . 0.6 OUTLIER -138.79 -65.56 0.49 Allowed 'General case' 0 N--CA 1.512 2.63 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.354 -178.324 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.2 t -143.53 -78.41 0.22 Allowed 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.253 -0.904 . . . . 0.0 109.529 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.656 ' O ' HG12 ' A' ' 20' ' ' VAL . 6.1 mmm -67.9 -26.82 66.18 Favored 'General case' 0 N--CA 1.518 2.927 0 O-C-N 121.381 -0.824 . . . . 0.0 109.499 177.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.608 ' O ' HD22 ' A' ' 14' ' ' LEU . 13.5 mt-10 -76.78 -47.97 20.03 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 105.531 -2.026 . . . . 0.0 105.531 174.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.899 ' HA ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -53.09 -17.22 1.43 Allowed 'General case' 0 N--CA 1.514 2.743 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 -179.886 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.656 HG12 ' O ' ' A' ' 17' ' ' MET . 5.3 p -78.52 -39.27 23.28 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.743 0 C-N-CA 119.411 -0.916 . . . . 0.0 110.093 178.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -52.75 -35.44 56.2 Favored 'General case' 0 N--CA 1.519 3.016 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.824 ' HB2' HD21 ' A' ' 14' ' ' LEU . 54.0 t90 -60.88 -56.01 26.25 Favored 'General case' 0 N--CA 1.507 2.41 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 176.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.51 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -60.41 -28.93 68.64 Favored 'General case' 0 N--CA 1.505 2.292 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.149 178.871 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.424 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -75.33 -47.63 26.87 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.621 -0.674 . . . . 0.0 109.29 178.912 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.25 -24.94 64.06 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 122.148 -0.345 . . . . 0.0 110.994 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.405 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 0.1 OUTLIER -70.03 -40.39 75.19 Favored 'General case' 0 N--CA 1.507 2.418 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.422 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tt -67.34 -39.89 85.82 Favored 'General case' 0 N--CA 1.503 2.192 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 176.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -78.52 -1.59 34.63 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 122.058 -0.401 . . . . 0.0 111.346 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -88.43 -34.32 17.55 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.44 -1.412 . . . . 0.0 107.812 176.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 84.0 t -52.83 -32.02 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.807 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.172 0 O-C-N 122.186 -0.321 . . . . 0.0 111.244 -177.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.777 ' CG ' ' HA ' ' A' ' 19' ' ' ARG . 17.4 tp . . . . . 0 N--CA 1.499 1.981 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.406 ' CA ' ' HB2' ' A' ' 19' ' ' ARG . 3.9 p30 -163.83 152.82 13.93 Favored 'General case' 0 N--CA 1.514 2.733 0 O-C-N 121.609 -0.682 . . . . 0.0 112.084 -178.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.7 t 52.52 -136.54 1.34 Allowed 'General case' 0 N--CA 1.514 2.764 0 C-N-CA 122.991 0.516 . . . . 0.0 111.916 178.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.649 ' O ' HG12 ' A' ' 20' ' ' VAL . 0.1 OUTLIER -56.64 -34.51 67.37 Favored 'General case' 0 N--CA 1.519 2.976 0 O-C-N 121.085 -1.009 . . . . 0.0 111.524 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.579 ' O ' HD11 ' A' ' 14' ' ' LEU . 22.2 mt-10 -59.94 -43.64 94.86 Favored 'General case' 0 N--CA 1.513 2.702 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 177.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.777 ' HA ' ' CG ' ' A' ' 14' ' ' LEU . 20.9 ttt85 -61.6 -11.6 12.13 Favored 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.649 HG12 ' O ' ' A' ' 17' ' ' MET . 1.1 p -98.3 -37.21 6.29 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.725 0 C-N-CA 119.053 -1.059 . . . . 0.0 110.651 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -59.65 -40.4 87.58 Favored 'General case' 0 N--CA 1.514 2.769 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 177.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.591 ' HB2' ' CD1' ' A' ' 14' ' ' LEU . 7.8 t90 -61.36 -59.79 4.73 Favored 'General case' 0 N--CA 1.501 2.099 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 177.072 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.613 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -59.1 -30.79 68.36 Favored 'General case' 0 N--CA 1.506 2.368 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.233 179.432 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -72.83 -44.23 61.7 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.1 tptp -69.1 -47.03 66.26 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.905 -0.497 . . . . 0.0 110.165 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.403 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -58.49 -42.03 86.64 Favored 'General case' 0 N--CA 1.515 2.777 0 CA-C-O 120.822 0.344 . . . . 0.0 110.297 179.146 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.419 HD13 ' HA ' ' A' ' 27' ' ' LEU . 1.6 mm? -69.24 -35.3 76.0 Favored 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 176.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -83.16 14.91 3.13 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.657 -0.652 . . . . 0.0 111.179 178.027 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -108.18 -51.35 2.91 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.087 -1.008 . . . . 0.0 110.318 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 t -102.42 23.32 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.514 2.731 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.085 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 74.4 m80 . . . . . 0 N--CA 1.513 2.699 0 O-C-N 120.961 -1.087 . . . . 0.0 110.296 179.702 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.728 HD11 ' CB ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.508 2.433 0 CA-C-O 120.772 0.32 . . . . 0.0 111.321 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -52.89 14.63 Favored 'General case' 0 N--CA 1.507 2.381 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.608 ' HB3' HG23 ' A' ' 20' ' ' VAL . 0.5 OUTLIER 171.63 -96.0 0.0 OUTLIER 'General case' 0 C--O 1.174 -2.882 0 CA-C-O 116.657 -1.64 . . . . 0.0 107.893 178.287 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.48 ' HA ' ' HB ' ' A' ' 20' ' ' VAL . 3.0 ttm -24.21 -43.19 0.01 OUTLIER 'General case' 0 N--CA 1.539 4.0 0 CA-C-N 121.584 1.993 . . . . 0.0 116.254 -177.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -51.37 -41.54 60.72 Favored 'General case' 0 N--CA 1.534 3.754 0 CA-C-O 122.464 1.126 . . . . 0.0 108.741 176.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.762 ' HB3' ' CB ' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -117.7 -64.93 1.23 Allowed 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 125.3 1.44 . . . . 0.0 108.251 177.332 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.608 HG23 ' HB3' ' A' ' 16' ' ' SER . 0.3 OUTLIER 62.19 -53.76 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.518 2.968 0 C-N-CA 127.195 2.198 . . . . 0.0 112.087 175.491 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.16 -26.71 51.53 Favored 'General case' 0 N--CA 1.524 3.264 0 N-CA-C 104.842 -2.281 . . . . 0.0 104.842 169.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.762 ' CB ' ' HB3' ' A' ' 19' ' ' ARG 0.255 18.8 t90 -55.41 -57.52 11.51 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 126.826 2.051 . . . . 0.0 108.316 173.433 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 20' ' ' VAL . 0.5 OUTLIER -59.63 -28.92 67.64 Favored 'General case' 0 N--CA 1.511 2.597 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.761 178.741 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.409 ' NH1' HG13 ' A' ' 20' ' ' VAL . 0.2 OUTLIER -75.91 -39.91 55.35 Favored 'General case' 0 N--CA 1.508 2.46 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.113 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 11.5 tttp -83.22 -4.3 58.26 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 122.074 -0.391 . . . . 0.0 111.648 178.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.42 ' HD3' ' CZ2' ' A' ' 22' ' ' TRP . 0.8 OUTLIER -58.23 -47.73 82.61 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 121.453 -0.779 . . . . 0.0 109.801 179.897 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 pp -67.49 -36.73 81.67 Favored 'General case' 0 N--CA 1.511 2.585 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 176.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -92.87 53.28 1.98 Allowed 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -142.63 -51.33 0.37 Allowed 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.658 -0.651 . . . . 0.0 110.072 -178.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.8 t -95.76 34.98 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.622 0 CA-C-O 121.561 0.696 . . . . 0.0 109.514 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 7.1 t60 . . . . . 0 N--CA 1.503 2.185 0 O-C-N 121.2 -0.938 . . . . 0.0 109.644 179.912 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.961 HD11 ' HA ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.504 2.268 0 CA-C-O 120.698 0.285 . . . . 0.0 111.432 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.613 ' CB ' ' HB2' ' A' ' 18' ' ' GLU . 1.3 m-20 70.52 159.36 0.19 Allowed 'General case' 0 N--CA 1.528 3.433 0 O-C-N 120.93 -1.106 . . . . 0.0 111.119 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.3 m -66.24 -75.89 0.09 Allowed 'General case' 0 N--CA 1.519 2.993 0 O-C-N 121.343 -0.848 . . . . 0.0 112.015 -177.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.524 ' O ' HG12 ' A' ' 20' ' ' VAL . 0.3 OUTLIER -68.26 -22.93 64.73 Favored 'General case' 0 N--CA 1.516 2.869 0 O-C-N 121.196 -0.94 . . . . 0.0 110.435 179.475 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.613 ' HB2' ' CB ' ' A' ' 15' ' ' ASN . 4.6 mt-10 -65.81 -37.92 87.56 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 175.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.961 ' HA ' HD11 ' A' ' 14' ' ' LEU . 0.1 OUTLIER -59.17 -35.06 72.89 Favored 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -179.936 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.76 ' HA ' HD23 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -79.61 -43.21 23.23 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.113 0 C-N-CA 118.216 -1.394 . . . . 0.0 110.312 -178.938 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -56.17 -40.03 73.28 Favored 'General case' 0 N--CA 1.511 2.576 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 177.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.61 ' CE3' ' HD2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -68.96 -70.05 0.29 Allowed 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 176.891 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.76 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -39.61 -33.17 0.16 Allowed 'General case' 0 N--CA 1.518 2.953 0 C-N-CA 123.333 0.653 . . . . 0.0 112.102 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.18 -50.56 72.64 Favored 'General case' 0 N--CA 1.509 2.483 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 177.115 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -31.39 67.03 Favored 'General case' 0 N--CA 1.504 2.273 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 175.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.61 ' HD2' ' CE3' ' A' ' 22' ' ' TRP . 1.5 tttm -62.68 -32.4 73.46 Favored 'General case' 0 N--CA 1.52 3.037 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 178.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tt -74.47 -44.61 50.77 Favored 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 176.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -68.14 -8.16 36.06 Favored 'General case' 0 N--CA 1.519 3.021 0 O-C-N 122.172 -0.33 . . . . 0.0 111.379 176.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.83 -37.93 76.35 Favored 'General case' 0 C--N 1.31 -1.11 0 C-N-CA 119.702 -0.799 . . . . 0.0 108.876 178.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.5 t -90.55 43.26 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.331 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 173.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 77.3 m80 . . . . . 0 N--CA 1.503 2.209 0 C-N-CA 124.107 0.963 . . . . 0.0 112.316 -177.892 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.863 HD13 ' HA ' ' A' ' 19' ' ' ARG . 59.3 mt . . . . . 0 N--CA 1.494 1.734 0 CA-C-O 121.958 0.885 . . . . 0.0 110.432 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -160.86 -83.24 0.04 OUTLIER 'General case' 0 N--CA 1.51 2.569 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.75 179.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.537 ' O ' HG13 ' A' ' 20' ' ' VAL . 16.7 t -128.66 -63.0 1.0 Allowed 'General case' 0 N--CA 1.506 2.356 0 CA-C-N 119.411 1.005 . . . . 0.0 109.414 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.728 ' HA ' HG22 ' A' ' 20' ' ' VAL . 32.9 mmt -92.12 -10.1 40.14 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.482 -0.761 . . . . 0.0 109.77 177.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.685 ' C ' HD22 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -81.26 -50.1 9.95 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 105.335 -2.098 . . . . 0.0 105.335 174.564 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.863 ' HA ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -54.16 -27.66 35.09 Favored 'General case' 0 N--CA 1.514 2.729 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.639 178.013 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.728 HG22 ' HA ' ' A' ' 17' ' ' MET . 33.8 m -86.88 -45.23 16.46 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.142 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.914 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -50.26 -41.18 50.0 Favored 'General case' 0 N--CA 1.52 3.075 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 176.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.653 ' HB2' HD21 ' A' ' 14' ' ' LEU . 28.0 t90 -60.41 -58.33 8.96 Favored 'General case' 0 N--CA 1.508 2.464 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 176.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.698 ' C ' HD13 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -55.46 -31.3 61.84 Favored 'General case' 0 N--CA 1.509 2.498 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.175 178.604 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.577 ' N ' HD13 ' A' ' 23' ' ' LEU . 1.4 ttp85 -80.66 -46.67 15.24 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.764 -0.585 . . . . 0.0 109.931 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.54 -31.09 72.15 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.775 -0.578 . . . . 0.0 110.792 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.441 ' HD3' ' CE3' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -65.17 -41.4 94.68 Favored 'General case' 0 N--CA 1.51 2.55 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 178.661 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.61 -41.96 68.27 Favored 'General case' 0 N--CA 1.504 2.261 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 176.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -21.68 66.75 Favored 'General case' 0 N--CA 1.505 2.293 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 178.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.14 -43.9 97.81 Favored 'General case' 0 N--CA 1.506 2.356 0 CA-C-O 121.045 0.45 . . . . 0.0 110.372 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 38.6 t -75.11 -31.91 25.65 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 178.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 17.3 m80 . . . . . 0 N--CA 1.512 2.673 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 179.173 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.761 HD22 ' HA ' ' A' ' 19' ' ' ARG . 3.8 mt . . . . . 0 N--CA 1.51 2.535 0 CA-C-O 121.334 0.588 . . . . 0.0 112.051 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -148.96 -65.15 0.23 Allowed 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.673 -0.642 . . . . 0.0 111.272 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.481 ' O ' HG13 ' A' ' 20' ' ' VAL . 35.3 t -139.45 -97.52 0.16 Allowed 'General case' 0 N--CA 1.512 2.657 0 CA-C-N 119.413 1.006 . . . . 0.0 110.331 -179.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.797 ' HA ' HG22 ' A' ' 20' ' ' VAL . 5.3 ttt -70.74 -13.23 61.98 Favored 'General case' 0 N--CA 1.519 2.986 0 CA-C-N 119.826 1.194 . . . . 0.0 110.358 178.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.644 ' C ' HD22 ' A' ' 14' ' ' LEU . 1.9 mm-40 -76.21 -51.87 11.21 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 103.697 -2.705 . . . . 0.0 103.697 174.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.761 ' HA ' HD22 ' A' ' 14' ' ' LEU . 1.4 tmm_? -51.21 -31.02 19.01 Favored 'General case' 0 N--CA 1.506 2.33 0 CA-C-N 114.262 -1.335 . . . . 0.0 112.53 177.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.797 HG22 ' HA ' ' A' ' 17' ' ' MET . 29.6 m -85.17 -47.41 16.97 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.216 0 C-N-CA 119.601 -0.839 . . . . 0.0 111.596 -177.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -52.57 -39.39 61.47 Favored 'General case' 0 N--CA 1.523 3.224 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 176.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.64 ' CG ' HD11 ' A' ' 14' ' ' LEU . 8.4 t90 -64.84 -59.1 4.59 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 176.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.667 ' C ' HD13 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -50.24 -35.04 25.16 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 124.26 1.024 . . . . 0.0 110.154 178.212 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.568 ' N ' HD13 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -74.43 -49.1 23.78 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.894 -0.504 . . . . 0.0 109.936 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.401 ' HA ' ' HD2' ' A' ' 25' ' ' LYS . 7.4 tptp -64.93 -41.77 95.25 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.927 -0.483 . . . . 0.0 110.807 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.535 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -64.28 -43.29 95.24 Favored 'General case' 0 N--CA 1.511 2.601 0 CA-C-O 120.911 0.386 . . . . 0.0 110.408 179.643 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.34 -40.16 93.29 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 32.9 tp60 -70.08 -28.23 65.26 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 122.078 -0.389 . . . . 0.0 111.137 178.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -68.62 -47.26 67.1 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-O 121.48 0.657 . . . . 0.0 109.386 178.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.9 t -90.18 20.48 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.51 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.361 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.161 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 177.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.869 HD21 ' HB2' ' A' ' 22' ' ' TRP . 87.2 mt . . . . . 0 N--CA 1.501 2.125 0 CA-C-O 122.372 1.082 . . . . 0.0 112.648 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -167.68 -52.54 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.757 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.944 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.486 ' O ' HG13 ' A' ' 20' ' ' VAL . 18.8 p -153.63 -91.1 0.05 OUTLIER 'General case' 0 N--CA 1.511 2.589 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.825 ' HA ' HG22 ' A' ' 20' ' ' VAL . 2.3 mmt -72.41 -14.82 61.79 Favored 'General case' 0 N--CA 1.514 2.775 0 CA-C-N 119.343 0.974 . . . . 0.0 109.068 176.282 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.727 ' C ' HD22 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -72.47 -55.67 6.62 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 103.871 -2.64 . . . . 0.0 103.871 173.375 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.83 ' HA ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -49.79 -28.62 6.52 Favored 'General case' 0 N--CA 1.508 2.443 0 CA-C-N 114.058 -1.428 . . . . 0.0 112.687 178.499 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.825 HG22 ' HA ' ' A' ' 17' ' ' MET . 32.7 m -87.13 -48.95 15.17 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.152 0 C-N-CA 119.308 -0.957 . . . . 0.0 111.213 -178.316 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.428 ' HA ' ' HD2' ' A' ' 24' ' ' ARG . 0.5 OUTLIER -51.26 -35.74 38.73 Favored 'General case' 0 N--CA 1.514 2.766 0 N-CA-C 107.85 -1.166 . . . . 0.0 107.85 176.171 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.869 ' HB2' HD21 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -67.89 -73.52 0.14 Allowed 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 106.513 -1.662 . . . . 0.0 106.513 175.124 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.706 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.4 OUTLIER -39.7 -30.06 0.07 Allowed 'General case' 0 N--CA 1.511 2.612 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -178.898 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -59.23 -40.66 86.58 Favored 'General case' 0 N--CA 1.512 2.655 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 176.026 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? -85.15 -17.18 38.02 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 123.416 0.686 . . . . 0.0 111.561 177.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.708 ' HG2' ' CE3' ' A' ' 22' ' ' TRP . 0.2 OUTLIER -71.16 -38.12 72.2 Favored 'General case' 0 N--CA 1.525 3.292 0 O-C-N 121.473 -0.767 . . . . 0.0 109.969 179.314 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 tp -71.38 -48.13 51.85 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 177.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -66.81 -15.94 63.94 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 122.309 -0.244 . . . . 0.0 111.289 177.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.98 -46.57 87.06 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.932 -0.48 . . . . 0.0 110.547 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 17.2 t -81.85 -8.23 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.2 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 . . . . . 0 N--CA 1.505 2.322 0 O-C-N 121.338 -0.851 . . . . 0.0 109.448 179.169 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.934 HD13 ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.511 2.589 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -148.43 -66.52 0.24 Allowed 'General case' 0 N--CA 1.515 2.783 0 O-C-N 121.241 -0.912 . . . . 0.0 111.311 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.0 t -141.26 -79.2 0.26 Allowed 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.437 -0.789 . . . . 0.0 109.124 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.718 ' O ' HG12 ' A' ' 20' ' ' VAL . 3.6 tmm? -69.1 -26.1 64.75 Favored 'General case' 0 N--CA 1.514 2.75 0 O-C-N 121.365 -0.835 . . . . 0.0 109.329 177.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.646 ' O ' HD22 ' A' ' 14' ' ' LEU . 27.3 mt-10 -76.89 -46.85 22.94 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 174.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.934 ' HA ' HD13 ' A' ' 14' ' ' LEU . 0.1 OUTLIER -53.36 -19.25 3.21 Favored 'General case' 0 N--CA 1.516 2.843 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 179.843 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.718 HG12 ' O ' ' A' ' 17' ' ' MET . 4.0 p -79.14 -33.34 15.72 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.534 0 C-N-CA 119.53 -0.868 . . . . 0.0 109.788 178.007 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.43 ' HA ' ' CZ ' ' A' ' 24' ' ' ARG . 3.6 mt-10 -54.44 -35.12 62.64 Favored 'General case' 0 N--CA 1.516 2.831 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 175.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.632 ' HB2' HD11 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -63.56 -79.95 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 105.534 -2.024 . . . . 0.0 105.534 175.205 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.569 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.2 OUTLIER -40.88 -30.19 0.12 Allowed 'General case' 0 N--CA 1.5 2.04 0 C-N-CA 123.466 0.706 . . . . 0.0 112.674 -179.837 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.43 ' CZ ' ' HA ' ' A' ' 21' ' ' GLU . 34.9 mtm180 -64.57 -46.53 82.33 Favored 'General case' 0 N--CA 1.512 2.655 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 177.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.8 tptp -65.66 -43.0 90.71 Favored 'General case' 0 N--CA 1.501 2.091 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.526 ' HD3' ' CH2' ' A' ' 22' ' ' TRP . 8.0 ttpp -56.89 -43.0 80.87 Favored 'General case' 0 N--CA 1.517 2.897 0 CA-C-O 121.208 0.528 . . . . 0.0 110.327 178.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.505 HD23 HD12 ' A' ' 23' ' ' LEU . 2.0 mm? -71.42 -40.53 70.4 Favored 'General case' 0 N--CA 1.505 2.301 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -67.85 -26.51 66.07 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.936 -0.478 . . . . 0.0 110.604 178.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -65.73 -52.53 50.49 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.1 p -72.21 -20.19 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.454 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.073 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.505 2.303 0 O-C-N 121.905 -0.497 . . . . 0.0 110.119 178.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.885 HD22 ' CB ' ' A' ' 19' ' ' ARG . 0.9 OUTLIER . . . . . 0 N--CA 1.507 2.418 0 CA-C-O 120.703 0.287 . . . . 0.0 110.845 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -77.88 -43.78 29.12 Favored 'General case' 0 N--CA 1.504 2.231 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 176.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.583 ' HA ' HD12 ' A' ' 14' ' ' LEU . 28.7 t 150.52 -57.62 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.851 0 C-N-CA 125.155 1.382 . . . . 0.0 107.694 177.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.1 mmt -58.52 -30.37 67.01 Favored 'General case' 0 N--CA 1.526 3.334 0 CA-C-N 121.357 1.889 . . . . 0.0 107.972 175.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.478 ' HB3' ' HB2' ' A' ' 14' ' ' LEU . 2.0 tt0 -55.9 -46.74 78.29 Favored 'General case' 0 N--CA 1.503 2.224 0 CA-C-O 122.396 1.093 . . . . 0.0 109.38 174.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.885 ' CB ' HD22 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -142.24 68.11 1.32 Allowed 'General case' 0 C--N 1.305 -1.346 0 CA-C-O 123.353 1.549 . . . . 0.0 109.391 -176.512 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.845 ' HA ' HD12 ' A' ' 23' ' ' LEU . 11.5 p -90.7 -41.84 13.63 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.557 0 N-CA-C 105.874 -1.899 . . . . 0.0 105.874 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.49 -33.45 68.03 Favored 'General case' 0 N--CA 1.511 2.581 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 173.064 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.558 ' HB3' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -53.45 -58.17 8.08 Favored 'General case' 0 N--CA 1.519 3.017 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 174.923 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.845 HD12 ' HA ' ' A' ' 20' ' ' VAL . 11.5 mt -55.97 -44.75 78.83 Favored 'General case' 0 N--CA 1.51 2.568 0 CA-C-N 114.742 -1.117 . . . . 0.0 109.269 178.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.1 ttm105 -63.92 -48.74 75.36 Favored 'General case' 0 N--CA 1.513 2.701 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.205 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -66.83 -39.37 87.65 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.832 -0.542 . . . . 0.0 110.912 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.457 ' HD3' ' CE3' ' A' ' 22' ' ' TRP . 2.5 mptp? -61.93 -33.6 74.55 Favored 'General case' 0 N--CA 1.513 2.68 0 CA-C-O 120.734 0.302 . . . . 0.0 110.563 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.25 -43.36 70.7 Favored 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 176.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 22.3 tp60 -66.32 -25.28 66.75 Favored 'General case' 0 N--CA 1.504 2.248 0 O-C-N 122.087 -0.383 . . . . 0.0 111.271 178.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -62.24 -55.75 25.32 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.891 -0.506 . . . . 0.0 109.872 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 27.6 m -65.06 -26.21 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.979 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.619 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 . . . . . 0 N--CA 1.509 2.479 0 O-C-N 121.965 -0.459 . . . . 0.0 110.885 179.14 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.84 HD21 ' HB2' ' A' ' 22' ' ' TRP . 17.1 mt . . . . . 0 N--CA 1.5 2.047 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 56.75 110.2 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.977 0 C-N-CA 125.029 1.332 . . . . 0.0 111.718 -176.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.3 t 80.02 -142.84 0.02 OUTLIER 'General case' 0 N--CA 1.525 3.28 0 C-N-CA 123.753 0.821 . . . . 0.0 111.538 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.857 ' HA ' HG22 ' A' ' 20' ' ' VAL . 5.4 mmm -61.92 -11.42 13.02 Favored 'General case' 0 N--CA 1.524 3.266 0 O-C-N 120.904 -1.123 . . . . 0.0 112.928 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.604 ' C ' HD22 ' A' ' 14' ' ' LEU . 8.9 mm-40 -74.18 -55.13 6.43 Favored 'General case' 0 N--CA 1.503 2.185 0 N-CA-C 103.841 -2.651 . . . . 0.0 103.841 174.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.792 ' HA ' HD13 ' A' ' 14' ' ' LEU . 2.0 tmt_? -49.78 -27.79 5.41 Favored 'General case' 0 N--CA 1.507 2.384 0 CA-C-N 114.088 -1.415 . . . . 0.0 112.865 177.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.857 HG22 ' HA ' ' A' ' 17' ' ' MET . 23.3 m -88.82 -47.34 15.28 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.012 0 C-N-CA 119.491 -0.884 . . . . 0.0 111.598 -178.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -51.77 -34.16 38.38 Favored 'General case' 0 N--CA 1.518 2.931 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 176.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.84 ' HB2' HD21 ' A' ' 14' ' ' LEU . 14.9 t90 -61.55 -60.4 3.76 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 176.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.828 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -55.57 -31.18 61.96 Favored 'General case' 0 N--CA 1.507 2.378 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.545 178.654 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -77.62 -45.19 25.85 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.792 -0.568 . . . . 0.0 109.755 179.22 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.4 tptp -67.09 -34.02 76.73 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 122.047 -0.408 . . . . 0.0 111.078 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -44.62 95.06 Favored 'General case' 0 N--CA 1.513 2.708 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.54 -41.45 75.92 Favored 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 177.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -68.24 -18.94 64.69 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 122.017 -0.427 . . . . 0.0 111.502 178.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -73.64 -45.64 51.56 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.626 -0.671 . . . . 0.0 110.132 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.9 t -93.29 21.03 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.615 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.936 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 45.2 m80 . . . . . 0 N--CA 1.508 2.468 0 O-C-N 120.93 -1.106 . . . . 0.0 109.41 178.946 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 59.2 t . . . . . 0 N--CA 1.504 2.25 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.6 t 86.31 -20.72 0.23 Allowed 'General case' 0 N--CA 1.526 3.352 0 C-N-CA 123.429 0.691 . . . . 0.0 112.621 -179.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.404 ' HA ' ' HB3' ' A' ' 7' ' ' MET . 1.4 mt-10 -90.58 51.28 1.97 Allowed 'General case' 0 N--CA 1.509 2.513 0 CA-C-O 121.697 0.76 . . . . 0.0 108.999 179.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.511 HG13 ' HB2' ' A' ' 7' ' ' MET . 1.1 pt -63.2 176.8 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.516 2.847 0 O-C-N 121.813 -0.554 . . . . 0.0 111.339 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -47.87 -51.37 23.29 Favored 'General case' 0 N--CA 1.518 2.926 0 O-C-N 121.653 -0.655 . . . . 0.0 111.716 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.98 -42.07 85.72 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.814 -0.554 . . . . 0.0 110.284 179.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.511 ' HB2' HG13 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -62.5 -50.94 69.4 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.946 -0.471 . . . . 0.0 109.851 179.511 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.413 ' HA ' ' CE1' ' A' ' 13' ' ' HIS . 0.5 OUTLIER -60.13 -35.8 76.09 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 122.084 -0.385 . . . . 0.0 110.214 178.649 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -65.85 -23.34 66.65 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.983 -0.448 . . . . 0.0 110.788 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.449 ' HG ' ' HE2' ' A' ' 26' ' ' LYS . 7.1 tp -61.93 109.98 1.42 Allowed 'General case' 0 N--CA 1.504 2.272 0 CA-C-N 118.87 0.759 . . . . 0.0 109.596 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 56.69 28.09 56.18 Favored Glycine 0 N--CA 1.511 3.649 0 N-CA-C 109.919 -1.272 . . . . 0.0 109.919 -176.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 50.7 13.31 0.13 Allowed 'General case' 0 N--CA 1.523 3.177 0 C-N-CA 124.295 1.038 . . . . 0.0 112.91 -177.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.413 ' CE1' ' HA ' ' A' ' 8' ' ' HIS . 4.8 m170 63.6 123.62 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.352 0 CA-C-O 122.279 1.038 . . . . 0.0 109.279 -177.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.899 HD13 ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -130.83 -158.3 0.88 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.454 -0.779 . . . . 0.0 112.702 -172.847 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.403 ' C ' ' HB2' ' A' ' 19' ' ' ARG . 0.6 OUTLIER -138.79 -65.56 0.49 Allowed 'General case' 0 N--CA 1.512 2.63 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.354 -178.324 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.2 t -143.53 -78.41 0.22 Allowed 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.253 -0.904 . . . . 0.0 109.529 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.656 ' O ' HG12 ' A' ' 20' ' ' VAL . 6.1 mmm -67.9 -26.82 66.18 Favored 'General case' 0 N--CA 1.518 2.927 0 O-C-N 121.381 -0.824 . . . . 0.0 109.499 177.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.608 ' O ' HD22 ' A' ' 14' ' ' LEU . 13.5 mt-10 -76.78 -47.97 20.03 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 105.531 -2.026 . . . . 0.0 105.531 174.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.899 ' HA ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -53.09 -17.22 1.43 Allowed 'General case' 0 N--CA 1.514 2.743 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 -179.886 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.656 HG12 ' O ' ' A' ' 17' ' ' MET . 5.3 p -78.52 -39.27 23.28 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.743 0 C-N-CA 119.411 -0.916 . . . . 0.0 110.093 178.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -52.75 -35.44 56.2 Favored 'General case' 0 N--CA 1.519 3.016 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.824 ' HB2' HD21 ' A' ' 14' ' ' LEU . 54.0 t90 -60.88 -56.01 26.25 Favored 'General case' 0 N--CA 1.507 2.41 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 176.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.51 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -60.41 -28.93 68.64 Favored 'General case' 0 N--CA 1.505 2.292 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.149 178.871 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.424 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -75.33 -47.63 26.87 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.621 -0.674 . . . . 0.0 109.29 178.912 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.25 -24.94 64.06 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 122.148 -0.345 . . . . 0.0 110.994 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.449 ' HE2' ' HG ' ' A' ' 10' ' ' LEU . 0.1 OUTLIER -70.03 -40.39 75.19 Favored 'General case' 0 N--CA 1.507 2.418 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.422 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tt -67.34 -39.89 85.82 Favored 'General case' 0 N--CA 1.503 2.192 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 176.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.411 ' HA ' ' N ' ' A' ' 33' ' ' PHE . 57.1 tt0 -78.52 -1.59 34.63 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 122.058 -0.401 . . . . 0.0 111.346 177.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -88.43 -34.32 17.55 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.44 -1.412 . . . . 0.0 107.812 176.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 84.0 t -52.83 -32.02 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.807 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -164.38 28.56 0.07 Allowed 'General case' 0 N--CA 1.502 2.172 0 O-C-N 122.186 -0.321 . . . . 0.0 111.244 -177.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 55.27 36.77 27.76 Favored 'General case' 0 N--CA 1.513 2.705 0 N-CA-C 105.041 -2.207 . . . . 0.0 105.041 -172.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.411 ' N ' ' HA ' ' A' ' 28' ' ' GLN . 3.8 t80 -84.86 82.84 8.26 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-N 114.189 -1.369 . . . . 0.0 110.341 -176.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 8.0 p -47.9 123.82 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 CA-C-O 122.603 1.192 . . . . 0.0 111.543 -178.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -99.65 -147.52 0.34 Allowed 'General case' 0 N--CA 1.493 1.694 0 CA-C-N 114.262 -1.335 . . . . 0.0 108.684 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.512 2.639 0 CA-C-O 117.549 -1.215 . . . . 0.0 110.898 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 11.6 p . . . . . 0 N--CA 1.502 2.138 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 t 66.91 -178.94 0.21 Allowed 'General case' 0 N--CA 1.515 2.797 0 CA-C-O 121.085 0.469 . . . . 0.0 110.578 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -104.79 41.42 1.33 Allowed 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.518 -0.739 . . . . 0.0 109.677 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.1 pt -140.08 82.55 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.392 0 O-C-N 121.442 -0.787 . . . . 0.0 109.532 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -123.96 -64.84 1.11 Allowed 'General case' 0 N--CA 1.503 2.204 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.36 -45.82 78.83 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.642 -0.661 . . . . 0.0 109.224 178.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 49.5 mtt -93.65 59.03 2.8 Favored 'General case' 0 N--CA 1.503 2.204 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 178.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -173.98 -47.88 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.693 -0.629 . . . . 0.0 109.814 -179.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.468 ' HB3' ' CE1' ' A' ' 13' ' ' HIS . 5.1 m120 -64.08 -45.53 88.28 Favored 'General case' 0 N--CA 1.504 2.232 0 CA-C-O 119.405 -0.331 . . . . 0.0 111.211 -179.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.71 116.35 2.08 Favored 'General case' 0 N--CA 1.517 2.898 0 CA-C-N 118.679 0.672 . . . . 0.0 110.444 -179.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 96.93 -45.67 1.79 Allowed Glycine 0 N--CA 1.506 3.338 0 N-CA-C 109.337 -1.505 . . . . 0.0 109.337 -178.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -53.84 24.21 Favored 'General case' 0 N--CA 1.509 2.518 0 CA-C-N 118.039 0.919 . . . . 0.0 108.869 178.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.468 ' CE1' ' HB3' ' A' ' 9' ' ' ASN . 0.8 OUTLIER -78.87 -2.94 42.19 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.898 -0.502 . . . . 0.0 110.903 177.706 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.777 ' CG ' ' HA ' ' A' ' 19' ' ' ARG . 17.4 tp -60.65 131.63 51.32 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.453 -0.779 . . . . 0.0 109.762 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.406 ' CA ' ' HB2' ' A' ' 19' ' ' ARG . 3.9 p30 -163.83 152.82 13.93 Favored 'General case' 0 N--CA 1.514 2.733 0 O-C-N 121.609 -0.682 . . . . 0.0 112.084 -178.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.7 t 52.52 -136.54 1.34 Allowed 'General case' 0 N--CA 1.514 2.764 0 C-N-CA 122.991 0.516 . . . . 0.0 111.916 178.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.649 ' O ' HG12 ' A' ' 20' ' ' VAL . 0.1 OUTLIER -56.64 -34.51 67.37 Favored 'General case' 0 N--CA 1.519 2.976 0 O-C-N 121.085 -1.009 . . . . 0.0 111.524 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.579 ' O ' HD11 ' A' ' 14' ' ' LEU . 22.2 mt-10 -59.94 -43.64 94.86 Favored 'General case' 0 N--CA 1.513 2.702 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 177.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.777 ' HA ' ' CG ' ' A' ' 14' ' ' LEU . 20.9 ttt85 -61.6 -11.6 12.13 Favored 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.649 HG12 ' O ' ' A' ' 17' ' ' MET . 1.1 p -98.3 -37.21 6.29 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.725 0 C-N-CA 119.053 -1.059 . . . . 0.0 110.651 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -59.65 -40.4 87.58 Favored 'General case' 0 N--CA 1.514 2.769 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 177.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.591 ' HB2' ' CD1' ' A' ' 14' ' ' LEU . 7.8 t90 -61.36 -59.79 4.73 Favored 'General case' 0 N--CA 1.501 2.099 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 177.072 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.613 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -59.1 -30.79 68.36 Favored 'General case' 0 N--CA 1.506 2.368 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.233 179.432 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -72.83 -44.23 61.7 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.1 tptp -69.1 -47.03 66.26 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.905 -0.497 . . . . 0.0 110.165 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.403 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -58.49 -42.03 86.64 Favored 'General case' 0 N--CA 1.515 2.777 0 CA-C-O 120.822 0.344 . . . . 0.0 110.297 179.146 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.419 HD13 ' HA ' ' A' ' 27' ' ' LEU . 1.6 mm? -69.24 -35.3 76.0 Favored 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 176.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -83.16 14.91 3.13 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.657 -0.652 . . . . 0.0 111.179 178.027 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -108.18 -51.35 2.91 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.087 -1.008 . . . . 0.0 110.318 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 t -102.42 23.32 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.514 2.731 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.085 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 74.4 m80 -139.92 -46.61 0.44 Allowed 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.961 -1.087 . . . . 0.0 110.296 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -76.82 86.02 3.41 Favored 'General case' 0 N--CA 1.503 2.178 0 CA-C-O 121.419 0.628 . . . . 0.0 109.675 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -160.1 107.38 1.63 Allowed 'General case' 0 N--CA 1.502 2.163 0 N-CA-C 109.344 -0.614 . . . . 0.0 109.344 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 21.3 t 70.76 133.45 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.517 2.898 0 CA-C-O 121.633 0.73 . . . . 0.0 110.322 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -154.22 138.18 16.34 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.75 -0.593 . . . . 0.0 109.429 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.518 2.949 0 CA-C-O 117.504 -1.236 . . . . 0.0 110.411 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 2.3 m . . . . . 0 N--CA 1.504 2.273 0 CA-C-O 121.281 0.562 . . . . 0.0 109.597 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.0 t -159.47 -148.14 0.17 Allowed 'General case' 0 N--CA 1.506 2.368 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 62.77 27.95 16.28 Favored 'General case' 0 N--CA 1.517 2.879 0 O-C-N 121.49 -0.757 . . . . 0.0 111.14 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.444 HD13 ' N ' ' A' ' 5' ' ' GLN . 0.0 OUTLIER -163.37 148.2 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.309 0 O-C-N 121.218 -0.926 . . . . 0.0 109.256 179.75 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.444 ' N ' HD13 ' A' ' 4' ' ' ILE . 0.1 OUTLIER 75.59 -55.08 0.63 Allowed 'General case' 0 N--CA 1.516 2.841 0 C-N-CA 122.887 0.475 . . . . 0.0 110.482 -179.389 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.7 tt -56.76 -48.42 77.9 Favored 'General case' 0 N--CA 1.512 2.647 0 CA-C-N 119.03 0.832 . . . . 0.0 109.411 178.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 8.1 mtt -61.06 -40.12 92.43 Favored 'General case' 0 N--CA 1.508 2.45 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 56.4 m-70 -68.72 -41.26 79.28 Favored 'General case' 0 N--CA 1.509 2.524 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -74.29 -10.93 60.08 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 122.008 -0.432 . . . . 0.0 111.77 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.38 -149.21 0.04 OUTLIER 'General case' 0 N--CA 1.508 2.425 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 178.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.86 59.95 4.18 Favored Glycine 0 N--CA 1.511 3.678 0 O-C-N 120.3 -1.5 . . . . 0.0 109.68 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.93 20.55 2.84 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 122.108 -0.642 . . . . 0.0 110.537 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -168.84 43.74 0.03 OUTLIER 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.307 -0.87 . . . . 0.0 109.985 179.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.728 HD11 ' CB ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -104.46 -178.26 3.6 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 120.835 -1.166 . . . . 0.0 111.321 -179.489 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -52.89 14.63 Favored 'General case' 0 N--CA 1.507 2.381 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.608 ' HB3' HG23 ' A' ' 20' ' ' VAL . 0.5 OUTLIER 171.63 -96.0 0.0 OUTLIER 'General case' 0 C--O 1.174 -2.882 0 CA-C-O 116.657 -1.64 . . . . 0.0 107.893 178.287 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.48 ' HA ' ' HB ' ' A' ' 20' ' ' VAL . 3.0 ttm -24.21 -43.19 0.01 OUTLIER 'General case' 0 N--CA 1.539 4.0 0 CA-C-N 121.584 1.993 . . . . 0.0 116.254 -177.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -51.37 -41.54 60.72 Favored 'General case' 0 N--CA 1.534 3.754 0 CA-C-O 122.464 1.126 . . . . 0.0 108.741 176.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.762 ' HB3' ' CB ' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -117.7 -64.93 1.23 Allowed 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 125.3 1.44 . . . . 0.0 108.251 177.332 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.608 HG23 ' HB3' ' A' ' 16' ' ' SER . 0.3 OUTLIER 62.19 -53.76 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.518 2.968 0 C-N-CA 127.195 2.198 . . . . 0.0 112.087 175.491 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.16 -26.71 51.53 Favored 'General case' 0 N--CA 1.524 3.264 0 N-CA-C 104.842 -2.281 . . . . 0.0 104.842 169.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.762 ' CB ' ' HB3' ' A' ' 19' ' ' ARG 0.255 18.8 t90 -55.41 -57.52 11.51 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 126.826 2.051 . . . . 0.0 108.316 173.433 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 20' ' ' VAL . 0.5 OUTLIER -59.63 -28.92 67.64 Favored 'General case' 0 N--CA 1.511 2.597 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.761 178.741 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.409 ' NH1' HG13 ' A' ' 20' ' ' VAL . 0.2 OUTLIER -75.91 -39.91 55.35 Favored 'General case' 0 N--CA 1.508 2.46 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.113 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.598 ' HG3' ' HB3' ' A' ' 35' ' ' ALA . 11.5 tttp -83.22 -4.3 58.26 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 122.074 -0.391 . . . . 0.0 111.648 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.42 ' HD3' ' CZ2' ' A' ' 22' ' ' TRP . 0.8 OUTLIER -58.23 -47.73 82.61 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 121.453 -0.779 . . . . 0.0 109.801 179.897 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 pp -67.49 -36.73 81.67 Favored 'General case' 0 N--CA 1.511 2.585 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 176.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -92.87 53.28 1.98 Allowed 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -142.63 -51.33 0.37 Allowed 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.658 -0.651 . . . . 0.0 110.072 -178.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.8 t -95.76 34.98 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.622 0 CA-C-O 121.561 0.696 . . . . 0.0 109.514 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -163.89 -50.95 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.2 -0.938 . . . . 0.0 109.644 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.42 ' HB3' HG22 ' A' ' 34' ' ' VAL . 37.7 m-80 -111.95 -49.69 2.96 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 122.07 -0.394 . . . . 0.0 110.466 -179.131 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 23.0 t80 56.36 53.21 9.02 Favored 'General case' 0 N--CA 1.508 2.432 0 CA-C-O 121.743 0.782 . . . . 0.0 109.847 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.42 HG22 ' HB3' ' A' ' 32' ' ' ASN . 2.2 m -144.72 87.37 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.375 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.598 ' HB3' ' HG3' ' A' ' 25' ' ' LYS . . . 179.92 180.0 0.5 Allowed 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 -179.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.2 mp . . . . . 0 N--CA 1.505 2.312 0 CA-C-O 117.683 -1.151 . . . . 0.0 109.382 179.111 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 21.7 t . . . . . 0 N--CA 1.503 2.216 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 57.8 m -98.94 139.6 34.35 Favored 'General case' 0 N--CA 1.503 2.193 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -126.02 53.34 1.61 Allowed 'General case' 0 N--CA 1.501 2.076 0 CA-C-O 121.536 0.684 . . . . 0.0 109.772 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.444 ' O ' ' HB2' ' A' ' 5' ' ' GLN . 14.4 tt -64.2 154.42 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.604 0 O-C-N 121.344 -0.847 . . . . 0.0 109.138 178.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.444 ' HB2' ' O ' ' A' ' 4' ' ' ILE . 1.4 mp0 75.97 -54.29 0.61 Allowed 'General case' 0 N--CA 1.519 3.017 0 C-N-CA 123.054 0.541 . . . . 0.0 110.0 -178.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.98 -52.42 42.91 Favored 'General case' 0 N--CA 1.506 2.361 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 178.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 35.8 mtt -67.75 -32.72 73.51 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.539 -0.726 . . . . 0.0 109.043 177.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.459 ' HA ' ' HG3' ' A' ' 12' ' ' LYS . 50.8 t-80 -75.18 -16.08 60.53 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.94 -0.475 . . . . 0.0 111.804 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 24.1 m120 -133.57 -61.94 0.79 Allowed 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.796 -1.19 . . . . 0.0 110.755 -178.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.8 tt -66.82 103.28 1.08 Allowed 'General case' 0 N--CA 1.506 2.326 0 CA-C-O 121.532 0.682 . . . . 0.0 109.705 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.452 ' HA2' ' HG3' ' A' ' 19' ' ' ARG . . . 77.76 15.56 81.12 Favored Glycine 0 N--CA 1.5 2.91 0 CA-C-O 119.403 -0.665 . . . . 0.0 111.621 -179.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.459 ' HG3' ' HA ' ' A' ' 8' ' ' HIS . 0.0 OUTLIER -66.18 -37.9 86.74 Favored 'General case' 0 N--CA 1.508 2.463 0 CA-C-N 119.714 1.757 . . . . 0.0 109.037 178.38 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -73.76 -29.35 62.16 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 122.179 -0.325 . . . . 0.0 111.623 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.961 HD11 ' HA ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -120.85 27.74 8.32 Favored 'General case' 0 N--CA 1.504 2.268 0 CA-C-N 118.84 0.745 . . . . 0.0 111.432 -178.221 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.613 ' CB ' ' HB2' ' A' ' 18' ' ' GLU . 1.3 m-20 70.52 159.36 0.19 Allowed 'General case' 0 N--CA 1.528 3.433 0 O-C-N 120.93 -1.106 . . . . 0.0 111.119 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.3 m -66.24 -75.89 0.09 Allowed 'General case' 0 N--CA 1.519 2.993 0 O-C-N 121.343 -0.848 . . . . 0.0 112.015 -177.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.524 ' O ' HG12 ' A' ' 20' ' ' VAL . 0.3 OUTLIER -68.26 -22.93 64.73 Favored 'General case' 0 N--CA 1.516 2.869 0 O-C-N 121.196 -0.94 . . . . 0.0 110.435 179.475 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.613 ' HB2' ' CB ' ' A' ' 15' ' ' ASN . 4.6 mt-10 -65.81 -37.92 87.56 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 175.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.961 ' HA ' HD11 ' A' ' 14' ' ' LEU . 0.1 OUTLIER -59.17 -35.06 72.89 Favored 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -179.936 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.76 ' HA ' HD23 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -79.61 -43.21 23.23 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.113 0 C-N-CA 118.216 -1.394 . . . . 0.0 110.312 -178.938 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -56.17 -40.03 73.28 Favored 'General case' 0 N--CA 1.511 2.576 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 177.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.61 ' CE3' ' HD2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -68.96 -70.05 0.29 Allowed 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 176.891 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.76 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -39.61 -33.17 0.16 Allowed 'General case' 0 N--CA 1.518 2.953 0 C-N-CA 123.333 0.653 . . . . 0.0 112.102 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.18 -50.56 72.64 Favored 'General case' 0 N--CA 1.509 2.483 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 177.115 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -31.39 67.03 Favored 'General case' 0 N--CA 1.504 2.273 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 175.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.61 ' HD2' ' CE3' ' A' ' 22' ' ' TRP . 1.5 tttm -62.68 -32.4 73.46 Favored 'General case' 0 N--CA 1.52 3.037 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 178.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tt -74.47 -44.61 50.77 Favored 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 176.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.73 ' HA ' ' HB2' ' A' ' 32' ' ' ASN . 22.9 mt-30 -68.14 -8.16 36.06 Favored 'General case' 0 N--CA 1.519 3.021 0 O-C-N 122.172 -0.33 . . . . 0.0 111.379 176.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.83 -37.93 76.35 Favored 'General case' 0 C--N 1.31 -1.11 0 C-N-CA 119.702 -0.799 . . . . 0.0 108.876 178.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.5 t -90.55 43.26 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.331 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 173.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 77.3 m80 64.11 8.61 4.14 Favored 'General case' 0 N--CA 1.503 2.209 0 C-N-CA 124.107 0.963 . . . . 0.0 112.316 -177.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.73 ' HB2' ' HA ' ' A' ' 28' ' ' GLN . 8.8 t-20 64.57 49.51 2.35 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 -179.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -85.13 91.24 8.07 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.146 -178.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.5 p -150.67 129.18 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 CA-C-O 121.577 0.703 . . . . 0.0 109.183 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -159.38 138.46 11.12 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.332 0.586 . . . . 0.0 109.593 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.7 tp . . . . . 0 N--CA 1.504 2.23 0 CA-C-O 117.661 -1.161 . . . . 0.0 110.207 -179.981 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 41.9 t . . . . . 0 N--CA 1.506 2.333 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.3 m 73.17 139.52 0.06 Allowed 'General case' 0 N--CA 1.52 3.032 0 C-N-CA 123.002 0.521 . . . . 0.0 110.36 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.533 ' O ' HG23 ' A' ' 4' ' ' ILE . 4.7 mp0 58.08 37.43 26.47 Favored 'General case' 0 N--CA 1.517 2.901 0 CA-C-O 121.156 0.503 . . . . 0.0 110.38 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.764 HG22 ' HA ' ' A' ' 9' ' ' ASN . 1.1 pt -162.65 79.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.517 2.914 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.1 pm0 -97.66 56.71 1.31 Allowed 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.908 -178.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.6 tp 51.84 41.95 29.71 Favored 'General case' 0 N--CA 1.521 3.086 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 -177.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.7 mtp -174.27 -59.24 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 -174.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.657 ' HB3' ' HA ' ' A' ' 4' ' ' ILE . 5.6 t-160 -64.21 -19.41 65.33 Favored 'General case' 0 CA--C 1.567 1.626 0 CA-C-N 114.308 -1.315 . . . . 0.0 109.328 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.764 ' HA ' HG22 ' A' ' 4' ' ' ILE . 5.6 t-20 -81.15 -33.26 33.24 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.262 -0.899 . . . . 0.0 109.524 176.106 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.65 HD23 ' CD2' ' A' ' 13' ' ' HIS . 8.4 mp -83.64 133.81 34.81 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.506 -0.746 . . . . 0.0 110.722 -178.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -79.08 93.04 1.28 Allowed Glycine 0 N--CA 1.5 2.948 0 N-CA-C 107.251 -2.34 . . . . 0.0 107.251 178.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 47.08 38.03 6.01 Favored 'General case' 0 N--CA 1.528 3.428 0 CA-C-O 122.025 0.917 . . . . 0.0 108.607 -175.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.65 ' CD2' HD23 ' A' ' 10' ' ' LEU . 12.2 t-160 68.52 108.64 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.927 0.891 . . . . 0.0 108.967 -175.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.863 HD13 ' HA ' ' A' ' 19' ' ' ARG . 59.3 mt -79.98 -172.72 3.54 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.958 0.885 . . . . 0.0 110.432 179.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -160.86 -83.24 0.04 OUTLIER 'General case' 0 N--CA 1.51 2.569 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.75 179.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.537 ' O ' HG13 ' A' ' 20' ' ' VAL . 16.7 t -128.66 -63.0 1.0 Allowed 'General case' 0 N--CA 1.506 2.356 0 CA-C-N 119.411 1.005 . . . . 0.0 109.414 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.728 ' HA ' HG22 ' A' ' 20' ' ' VAL . 32.9 mmt -92.12 -10.1 40.14 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.482 -0.761 . . . . 0.0 109.77 177.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.685 ' C ' HD22 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -81.26 -50.1 9.95 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 105.335 -2.098 . . . . 0.0 105.335 174.564 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.863 ' HA ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -54.16 -27.66 35.09 Favored 'General case' 0 N--CA 1.514 2.729 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.639 178.013 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.728 HG22 ' HA ' ' A' ' 17' ' ' MET . 33.8 m -86.88 -45.23 16.46 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.142 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.914 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -50.26 -41.18 50.0 Favored 'General case' 0 N--CA 1.52 3.075 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 176.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.653 ' HB2' HD21 ' A' ' 14' ' ' LEU . 28.0 t90 -60.41 -58.33 8.96 Favored 'General case' 0 N--CA 1.508 2.464 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 176.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.698 ' C ' HD13 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -55.46 -31.3 61.84 Favored 'General case' 0 N--CA 1.509 2.498 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.175 178.604 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.577 ' N ' HD13 ' A' ' 23' ' ' LEU . 1.4 ttp85 -80.66 -46.67 15.24 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.764 -0.585 . . . . 0.0 109.931 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.54 -31.09 72.15 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.775 -0.578 . . . . 0.0 110.792 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.441 ' HD3' ' CE3' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -65.17 -41.4 94.68 Favored 'General case' 0 N--CA 1.51 2.55 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 178.661 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.61 -41.96 68.27 Favored 'General case' 0 N--CA 1.504 2.261 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 176.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -21.68 66.75 Favored 'General case' 0 N--CA 1.505 2.293 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 178.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.14 -43.9 97.81 Favored 'General case' 0 N--CA 1.506 2.356 0 CA-C-O 121.045 0.45 . . . . 0.0 110.372 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 38.6 t -75.11 -31.91 25.65 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 178.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 17.3 m80 -57.34 -40.54 78.22 Favored 'General case' 0 N--CA 1.512 2.673 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -71.38 -54.4 10.85 Favored 'General case' 0 N--CA 1.504 2.242 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 71.31 132.73 0.04 OUTLIER 'General case' 0 N--CA 1.508 2.463 0 CA-C-O 121.462 0.649 . . . . 0.0 110.592 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.7 t -100.41 35.25 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.513 2.721 0 O-C-N 121.624 -0.672 . . . . 0.0 109.979 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -165.05 133.98 3.43 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.059 -1.026 . . . . 0.0 109.663 179.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.512 2.629 0 CA-C-O 117.638 -1.173 . . . . 0.0 110.361 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.527 ' HA ' ' HB2' ' A' ' 7' ' ' MET . 47.8 t . . . . . 0 N--CA 1.507 2.409 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 t 79.69 -49.28 0.38 Allowed 'General case' 0 N--CA 1.521 3.084 0 C-N-CA 123.234 0.613 . . . . 0.0 111.692 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 -100.01 43.43 1.06 Allowed 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 24.2 mm 70.5 154.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.519 3.002 0 O-C-N 121.801 -0.562 . . . . 0.0 110.673 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 72.89 148.61 0.09 Allowed 'General case' 0 N--CA 1.513 2.686 0 C-N-CA 123.086 0.555 . . . . 0.0 109.634 -178.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.2 mp 71.75 -73.13 0.1 Allowed 'General case' 0 N--CA 1.523 3.192 0 N-CA-C 104.388 -2.449 . . . . 0.0 104.388 -175.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.527 ' HB2' ' HA ' ' A' ' 1' ' ' VAL . 1.9 ttp -71.87 135.32 46.53 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 103.89 -2.633 . . . . 0.0 103.89 171.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.434 ' CB ' ' O ' ' A' ' 7' ' ' MET . 1.9 t60 89.11 -53.95 0.03 OUTLIER 'General case' 0 N--CA 1.525 3.291 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -177.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -60.41 -41.88 94.83 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 122.022 -0.423 . . . . 0.0 110.221 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.412 ' HB2' ' CD2' ' A' ' 13' ' ' HIS . 1.4 pt? -66.36 136.68 56.12 Favored 'General case' 0 N--CA 1.505 2.305 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 178.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -118.79 -58.65 0.27 Allowed Glycine 0 N--CA 1.507 3.391 0 C-N-CA 120.593 -0.813 . . . . 0.0 113.036 -176.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.44 53.75 2.4 Favored 'General case' 0 N--CA 1.517 2.925 0 CA-C-N 119.036 1.418 . . . . 0.0 110.288 -178.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.412 ' CD2' ' HB2' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -174.74 -60.85 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 -179.767 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.761 HD22 ' HA ' ' A' ' 19' ' ' ARG . 3.8 mt 54.59 -166.2 0.09 Allowed 'General case' 0 N--CA 1.51 2.535 0 C-N-CA 123.288 0.635 . . . . 0.0 112.051 178.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -148.96 -65.15 0.23 Allowed 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.673 -0.642 . . . . 0.0 111.272 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.481 ' O ' HG13 ' A' ' 20' ' ' VAL . 35.3 t -139.45 -97.52 0.16 Allowed 'General case' 0 N--CA 1.512 2.657 0 CA-C-N 119.413 1.006 . . . . 0.0 110.331 -179.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.797 ' HA ' HG22 ' A' ' 20' ' ' VAL . 5.3 ttt -70.74 -13.23 61.98 Favored 'General case' 0 N--CA 1.519 2.986 0 CA-C-N 119.826 1.194 . . . . 0.0 110.358 178.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.644 ' C ' HD22 ' A' ' 14' ' ' LEU . 1.9 mm-40 -76.21 -51.87 11.21 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 103.697 -2.705 . . . . 0.0 103.697 174.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.761 ' HA ' HD22 ' A' ' 14' ' ' LEU . 1.4 tmm_? -51.21 -31.02 19.01 Favored 'General case' 0 N--CA 1.506 2.33 0 CA-C-N 114.262 -1.335 . . . . 0.0 112.53 177.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.797 HG22 ' HA ' ' A' ' 17' ' ' MET . 29.6 m -85.17 -47.41 16.97 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.216 0 C-N-CA 119.601 -0.839 . . . . 0.0 111.596 -177.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -52.57 -39.39 61.47 Favored 'General case' 0 N--CA 1.523 3.224 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 176.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.64 ' CG ' HD11 ' A' ' 14' ' ' LEU . 8.4 t90 -64.84 -59.1 4.59 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 176.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.667 ' C ' HD13 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -50.24 -35.04 25.16 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 124.26 1.024 . . . . 0.0 110.154 178.212 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.568 ' N ' HD13 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -74.43 -49.1 23.78 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.894 -0.504 . . . . 0.0 109.936 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.401 ' HA ' ' HD2' ' A' ' 25' ' ' LYS . 7.4 tptp -64.93 -41.77 95.25 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.927 -0.483 . . . . 0.0 110.807 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.535 ' HD3' ' CD2' ' A' ' 22' ' ' TRP . 0.0 OUTLIER -64.28 -43.29 95.24 Favored 'General case' 0 N--CA 1.511 2.601 0 CA-C-O 120.911 0.386 . . . . 0.0 110.408 179.643 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.34 -40.16 93.29 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 32.9 tp60 -70.08 -28.23 65.26 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 122.078 -0.389 . . . . 0.0 111.137 178.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -68.62 -47.26 67.1 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-O 121.48 0.657 . . . . 0.0 109.386 178.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.9 t -90.18 20.48 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.51 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.361 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -88.78 -48.12 7.73 Favored 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 177.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.56 158.13 25.85 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 178.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 66.59 24.14 10.22 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 122.183 -0.323 . . . . 0.0 111.736 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 5.3 t -135.66 34.87 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.513 2.695 0 O-C-N 121.254 -0.904 . . . . 0.0 108.936 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . 72.57 133.55 0.04 OUTLIER 'General case' 0 N--CA 1.512 2.627 0 CA-C-O 121.564 0.697 . . . . 0.0 109.839 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.505 2.316 0 CA-C-O 117.676 -1.154 . . . . 0.0 110.192 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 10.7 m . . . . . 0 N--CA 1.507 2.425 0 CA-C-O 120.909 0.385 . . . . 0.0 110.182 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.18 163.47 24.03 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.716 -0.615 . . . . 0.0 109.732 179.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -108.87 48.45 0.86 Allowed 'General case' 0 N--CA 1.504 2.239 0 CA-C-O 121.7 0.762 . . . . 0.0 108.969 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.6 mm 62.43 21.77 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.516 2.843 0 O-C-N 121.763 -0.585 . . . . 0.0 110.938 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.56 -37.41 73.99 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 120.835 -1.165 . . . . 0.0 110.127 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.5 mt -68.3 -48.02 66.05 Favored 'General case' 0 N--CA 1.504 2.25 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 23.5 mmt -61.27 -41.07 96.32 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 122.132 -0.355 . . . . 0.0 110.101 178.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 3.6 m80 -62.74 -23.42 67.18 Favored 'General case' 0 N--CA 1.514 2.734 0 CA-C-N 118.174 0.443 . . . . 0.0 111.069 178.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -118.54 40.22 3.28 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.542 -0.724 . . . . 0.0 109.185 179.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.4 -170.51 2.04 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.517 -0.739 . . . . 0.0 110.552 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.67 70.92 2.18 Favored Glycine 0 N--CA 1.505 3.239 0 O-C-N 121.264 -0.897 . . . . 0.0 111.412 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -153.67 23.83 0.52 Allowed 'General case' 0 N--CA 1.513 2.707 0 O-C-N 122.137 -0.625 . . . . 0.0 110.113 178.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -174.79 -52.88 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.996 0 O-C-N 121.224 -0.923 . . . . 0.0 108.54 -178.333 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.869 HD21 ' HB2' ' A' ' 22' ' ' TRP . 87.2 mt 66.9 175.88 0.24 Allowed 'General case' 0 N--CA 1.501 2.125 0 CA-C-O 122.372 1.082 . . . . 0.0 112.648 179.403 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -167.68 -52.54 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.757 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.944 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.486 ' O ' HG13 ' A' ' 20' ' ' VAL . 18.8 p -153.63 -91.1 0.05 OUTLIER 'General case' 0 N--CA 1.511 2.589 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.825 ' HA ' HG22 ' A' ' 20' ' ' VAL . 2.3 mmt -72.41 -14.82 61.79 Favored 'General case' 0 N--CA 1.514 2.775 0 CA-C-N 119.343 0.974 . . . . 0.0 109.068 176.282 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.727 ' C ' HD22 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -72.47 -55.67 6.62 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 103.871 -2.64 . . . . 0.0 103.871 173.375 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.83 ' HA ' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -49.79 -28.62 6.52 Favored 'General case' 0 N--CA 1.508 2.443 0 CA-C-N 114.058 -1.428 . . . . 0.0 112.687 178.499 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.825 HG22 ' HA ' ' A' ' 17' ' ' MET . 32.7 m -87.13 -48.95 15.17 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.152 0 C-N-CA 119.308 -0.957 . . . . 0.0 111.213 -178.316 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.428 ' HA ' ' HD2' ' A' ' 24' ' ' ARG . 0.5 OUTLIER -51.26 -35.74 38.73 Favored 'General case' 0 N--CA 1.514 2.766 0 N-CA-C 107.85 -1.166 . . . . 0.0 107.85 176.171 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.869 ' HB2' HD21 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -67.89 -73.52 0.14 Allowed 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 106.513 -1.662 . . . . 0.0 106.513 175.124 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.706 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.4 OUTLIER -39.7 -30.06 0.07 Allowed 'General case' 0 N--CA 1.511 2.612 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -178.898 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -59.23 -40.66 86.58 Favored 'General case' 0 N--CA 1.512 2.655 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 176.026 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? -85.15 -17.18 38.02 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 123.416 0.686 . . . . 0.0 111.561 177.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.708 ' HG2' ' CE3' ' A' ' 22' ' ' TRP . 0.2 OUTLIER -71.16 -38.12 72.2 Favored 'General case' 0 N--CA 1.525 3.292 0 O-C-N 121.473 -0.767 . . . . 0.0 109.969 179.314 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 tp -71.38 -48.13 51.85 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 177.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -66.81 -15.94 63.94 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 122.309 -0.244 . . . . 0.0 111.289 177.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.537 ' HB3' ' HA ' ' A' ' 35' ' ' ALA . 0.3 OUTLIER -62.98 -46.57 87.06 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.932 -0.48 . . . . 0.0 110.547 179.434 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.441 HG22 ' HB2' ' A' ' 35' ' ' ALA . 17.2 t -81.85 -8.23 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.2 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -89.08 -49.94 6.46 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.338 -0.851 . . . . 0.0 109.448 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -95.63 -41.15 9.05 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 122.022 -0.424 . . . . 0.0 110.683 -179.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -106.96 -151.9 0.47 Allowed 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.428 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 4.0 t -125.04 42.91 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.494 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.537 ' HA ' ' HB3' ' A' ' 29' ' ' ASP . . . 76.18 139.3 0.07 Allowed 'General case' 0 N--CA 1.509 2.515 0 CA-C-O 121.536 0.684 . . . . 0.0 110.477 -179.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.7 tt . . . . . 0 N--CA 1.504 2.275 0 CA-C-O 118.564 -0.731 . . . . 0.0 109.593 -179.719 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 51.8 t . . . . . 0 N--CA 1.503 2.198 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.3 m -131.13 160.99 33.12 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 122.024 -0.423 . . . . 0.0 109.97 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.16 48.17 0.85 Allowed 'General case' 0 N--CA 1.503 2.19 0 CA-C-O 121.836 0.827 . . . . 0.0 109.067 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.3 mt -94.77 150.84 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.384 0 O-C-N 121.526 -0.734 . . . . 0.0 109.278 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 75.09 -62.29 0.46 Allowed 'General case' 0 N--CA 1.521 3.122 0 C-N-CA 123.401 0.681 . . . . 0.0 110.718 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.4 -43.99 92.88 Favored 'General case' 0 N--CA 1.511 2.597 0 CA-C-N 118.639 0.654 . . . . 0.0 110.26 179.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 29.3 ttm -60.69 -47.45 86.19 Favored 'General case' 0 N--CA 1.51 2.555 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 64.9 t60 -64.05 -36.23 83.32 Favored 'General case' 0 N--CA 1.507 2.415 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 178.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.43 ' HB3' ' CE1' ' A' ' 13' ' ' HIS . 0.1 OUTLIER -65.55 -19.05 65.76 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.788 -0.57 . . . . 0.0 111.528 179.667 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.6 tt -55.6 118.68 4.73 Favored 'General case' 0 N--CA 1.51 2.574 0 CA-C-N 119.048 0.84 . . . . 0.0 109.631 179.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 108.18 -30.63 8.72 Favored Glycine 0 N--CA 1.504 3.187 0 N-CA-C 110.258 -1.137 . . . . 0.0 110.258 -178.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.7 mttp -91.68 -42.0 10.41 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-N 118.783 1.292 . . . . 0.0 109.908 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.43 ' CE1' ' HB3' ' A' ' 9' ' ' ASN . 0.8 OUTLIER -85.78 63.66 8.17 Favored 'General case' 0 N--CA 1.512 2.674 0 CA-C-O 121.4 0.619 . . . . 0.0 111.333 -179.211 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.934 HD13 ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -101.15 -152.45 0.43 Allowed 'General case' 0 N--CA 1.511 2.589 0 O-C-N 121.064 -1.022 . . . . 0.0 108.718 178.663 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -148.43 -66.52 0.24 Allowed 'General case' 0 N--CA 1.515 2.783 0 O-C-N 121.241 -0.912 . . . . 0.0 111.311 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.0 t -141.26 -79.2 0.26 Allowed 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.437 -0.789 . . . . 0.0 109.124 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.718 ' O ' HG12 ' A' ' 20' ' ' VAL . 3.6 tmm? -69.1 -26.1 64.75 Favored 'General case' 0 N--CA 1.514 2.75 0 O-C-N 121.365 -0.835 . . . . 0.0 109.329 177.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.646 ' O ' HD22 ' A' ' 14' ' ' LEU . 27.3 mt-10 -76.89 -46.85 22.94 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 174.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.934 ' HA ' HD13 ' A' ' 14' ' ' LEU . 0.1 OUTLIER -53.36 -19.25 3.21 Favored 'General case' 0 N--CA 1.516 2.843 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 179.843 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.718 HG12 ' O ' ' A' ' 17' ' ' MET . 4.0 p -79.14 -33.34 15.72 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.534 0 C-N-CA 119.53 -0.868 . . . . 0.0 109.788 178.007 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.43 ' HA ' ' CZ ' ' A' ' 24' ' ' ARG . 3.6 mt-10 -54.44 -35.12 62.64 Favored 'General case' 0 N--CA 1.516 2.831 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 175.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.632 ' HB2' HD11 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -63.56 -79.95 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 105.534 -2.024 . . . . 0.0 105.534 175.205 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.569 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.2 OUTLIER -40.88 -30.19 0.12 Allowed 'General case' 0 N--CA 1.5 2.04 0 C-N-CA 123.466 0.706 . . . . 0.0 112.674 -179.837 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.43 ' CZ ' ' HA ' ' A' ' 21' ' ' GLU . 34.9 mtm180 -64.57 -46.53 82.33 Favored 'General case' 0 N--CA 1.512 2.655 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 177.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.8 tptp -65.66 -43.0 90.71 Favored 'General case' 0 N--CA 1.501 2.091 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.526 ' HD3' ' CH2' ' A' ' 22' ' ' TRP . 8.0 ttpp -56.89 -43.0 80.87 Favored 'General case' 0 N--CA 1.517 2.897 0 CA-C-O 121.208 0.528 . . . . 0.0 110.327 178.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.505 HD23 HD12 ' A' ' 23' ' ' LEU . 2.0 mm? -71.42 -40.53 70.4 Favored 'General case' 0 N--CA 1.505 2.301 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -67.85 -26.51 66.07 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.936 -0.478 . . . . 0.0 110.604 178.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -65.73 -52.53 50.49 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.1 p -72.21 -20.19 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.454 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.073 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -76.69 -35.16 58.06 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.905 -0.497 . . . . 0.0 110.119 178.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.9 m120 -97.74 112.55 24.4 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.59 -0.694 . . . . 0.0 109.553 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 17.5 p90 -147.08 45.78 1.16 Allowed 'General case' 0 N--CA 1.512 2.63 0 CA-C-O 121.537 0.684 . . . . 0.0 109.687 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.0 m -115.03 97.55 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 O-C-N 121.318 -0.864 . . . . 0.0 109.561 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.28 -27.27 38.58 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.817 -0.552 . . . . 0.0 111.237 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.507 2.375 0 CA-C-O 119.037 -0.506 . . . . 0.0 110.492 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 47.9 t . . . . . 0 N--CA 1.505 2.296 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -81.97 168.56 17.74 Favored 'General case' 0 N--CA 1.507 2.413 0 CA-C-O 121.238 0.542 . . . . 0.0 110.385 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.85 -23.86 66.76 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.944 -0.472 . . . . 0.0 112.01 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.643 HD13 ' N ' ' A' ' 5' ' ' GLN . 0.0 OUTLIER -120.88 140.98 43.33 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.125 0 CA-C-O 121.351 0.596 . . . . 0.0 109.734 179.722 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.643 ' N ' HD13 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -161.57 -70.75 0.06 Allowed 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 179.585 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.441 HD13 ' O ' ' A' ' 9' ' ' ASN . 3.4 mm? -63.71 -27.41 69.19 Favored 'General case' 0 N--CA 1.514 2.752 0 O-C-N 121.787 -0.571 . . . . 0.0 110.997 179.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 12.6 ttt -60.26 -39.46 86.87 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 121.407 -0.808 . . . . 0.0 108.948 178.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 75.9 t60 -76.46 -45.21 32.25 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 108.677 -0.861 . . . . 0.0 108.677 177.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.445 ' HA ' ' HA ' ' A' ' 15' ' ' ASN . 0.2 OUTLIER -108.42 87.25 2.45 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 178.935 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.46 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 0.4 OUTLIER -74.2 143.29 45.25 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.686 -0.634 . . . . 0.0 110.372 -179.856 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 92.65 -13.08 68.31 Favored Glycine 0 CA--C 1.555 2.555 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 -177.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 88.67 25.76 0.03 OUTLIER 'General case' 0 N--CA 1.526 3.341 0 C-N-CA 125.132 1.373 . . . . 0.0 109.861 -177.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.454 ' CD2' ' N ' ' A' ' 13' ' ' HIS . 0.0 OUTLIER -170.74 -76.63 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.49 0 O-C-N 120.931 -1.105 . . . . 0.0 110.405 -179.368 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.885 HD22 ' CB ' ' A' ' 19' ' ' ARG . 0.9 OUTLIER -64.26 159.97 19.67 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.684 -0.635 . . . . 0.0 110.845 179.834 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.445 ' HA ' ' HA ' ' A' ' 9' ' ' ASN . 9.8 p30 -77.88 -43.78 29.12 Favored 'General case' 0 N--CA 1.504 2.231 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 176.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.583 ' HA ' HD12 ' A' ' 14' ' ' LEU . 28.7 t 150.52 -57.62 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.851 0 C-N-CA 125.155 1.382 . . . . 0.0 107.694 177.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.1 mmt -58.52 -30.37 67.01 Favored 'General case' 0 N--CA 1.526 3.334 0 CA-C-N 121.357 1.889 . . . . 0.0 107.972 175.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.478 ' HB3' ' HB2' ' A' ' 14' ' ' LEU . 2.0 tt0 -55.9 -46.74 78.29 Favored 'General case' 0 N--CA 1.503 2.224 0 CA-C-O 122.396 1.093 . . . . 0.0 109.38 174.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.885 ' CB ' HD22 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -142.24 68.11 1.32 Allowed 'General case' 0 C--N 1.305 -1.346 0 CA-C-O 123.353 1.549 . . . . 0.0 109.391 -176.512 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.845 ' HA ' HD12 ' A' ' 23' ' ' LEU . 11.5 p -90.7 -41.84 13.63 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.557 0 N-CA-C 105.874 -1.899 . . . . 0.0 105.874 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.49 -33.45 68.03 Favored 'General case' 0 N--CA 1.511 2.581 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 173.064 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.558 ' HB3' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -53.45 -58.17 8.08 Favored 'General case' 0 N--CA 1.519 3.017 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 174.923 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.845 HD12 ' HA ' ' A' ' 20' ' ' VAL . 11.5 mt -55.97 -44.75 78.83 Favored 'General case' 0 N--CA 1.51 2.568 0 CA-C-N 114.742 -1.117 . . . . 0.0 109.269 178.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.1 ttm105 -63.92 -48.74 75.36 Favored 'General case' 0 N--CA 1.513 2.701 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.205 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -66.83 -39.37 87.65 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.832 -0.542 . . . . 0.0 110.912 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.457 ' HD3' ' CE3' ' A' ' 22' ' ' TRP . 2.5 mptp? -61.93 -33.6 74.55 Favored 'General case' 0 N--CA 1.513 2.68 0 CA-C-O 120.734 0.302 . . . . 0.0 110.563 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.25 -43.36 70.7 Favored 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 176.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 22.3 tp60 -66.32 -25.28 66.75 Favored 'General case' 0 N--CA 1.504 2.248 0 O-C-N 122.087 -0.383 . . . . 0.0 111.271 178.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -62.24 -55.75 25.32 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.891 -0.506 . . . . 0.0 109.872 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 27.6 m -65.06 -26.21 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.979 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.619 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -82.17 -17.48 46.1 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.965 -0.459 . . . . 0.0 110.885 179.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -88.81 -14.11 37.78 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.251 -0.906 . . . . 0.0 112.255 -179.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -110.37 71.56 0.76 Allowed 'General case' 0 N--CA 1.507 2.392 0 CA-C-N 119.524 1.056 . . . . 0.0 110.277 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -149.07 104.97 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.606 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -148.7 -152.21 0.43 Allowed 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.663 -0.648 . . . . 0.0 109.343 -179.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.1 tp . . . . . 0 N--CA 1.503 2.224 0 CA-C-O 117.646 -1.169 . . . . 0.0 109.929 -179.972 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 11.1 m . . . . . 0 N--CA 1.508 2.428 0 CA-C-O 121.126 0.488 . . . . 0.0 110.456 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.5 t -83.44 -176.52 6.35 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.887 -0.508 . . . . 0.0 110.49 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 63.05 49.84 3.3 Favored 'General case' 0 N--CA 1.509 2.505 0 CA-C-O 121.494 0.664 . . . . 0.0 110.635 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.425 ' HB ' ' HB2' ' A' ' 7' ' ' MET . 1.4 pt -81.56 90.8 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.508 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 178.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.673 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 1.4 mp0 -94.59 -67.57 0.85 Allowed 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.761 -0.587 . . . . 0.0 110.075 -178.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.0 pp -53.68 -18.18 2.83 Favored 'General case' 0 N--CA 1.523 3.207 0 CA-C-N 119.353 0.978 . . . . 0.0 110.455 177.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.425 ' HB2' ' HB ' ' A' ' 4' ' ' ILE . 15.2 mmm -59.04 -42.13 89.51 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-N 118.964 0.802 . . . . 0.0 109.808 177.083 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.538 ' HB3' ' HB2' ' A' ' 10' ' ' LEU . 55.2 t60 -109.35 24.25 13.35 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 176.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 44.04 53.3 6.5 Favored 'General case' 0 N--CA 1.525 3.279 0 CA-C-O 124.548 2.118 . . . . 0.0 105.372 -175.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.884 ' HA ' HD12 ' A' ' 14' ' ' LEU . 2.7 tp -109.58 152.37 25.6 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 110.989 -2.823 . . . . 0.0 111.937 -171.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -116.96 27.91 7.58 Favored Glycine 0 N--CA 1.499 2.896 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 178.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 76.82 26.59 0.79 Allowed 'General case' 0 N--CA 1.513 2.709 0 CA-C-N 117.767 0.783 . . . . 0.0 109.109 -177.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 178.17 -106.27 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.653 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.884 HD12 ' HA ' ' A' ' 10' ' ' LEU . 17.1 mt 65.72 -108.37 0.15 Allowed 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 119.558 1.072 . . . . 0.0 112.986 176.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 56.75 110.2 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.977 0 C-N-CA 125.029 1.332 . . . . 0.0 111.718 -176.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.3 t 80.02 -142.84 0.02 OUTLIER 'General case' 0 N--CA 1.525 3.28 0 C-N-CA 123.753 0.821 . . . . 0.0 111.538 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.857 ' HA ' HG22 ' A' ' 20' ' ' VAL . 5.4 mmm -61.92 -11.42 13.02 Favored 'General case' 0 N--CA 1.524 3.266 0 O-C-N 120.904 -1.123 . . . . 0.0 112.928 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.604 ' C ' HD22 ' A' ' 14' ' ' LEU . 8.9 mm-40 -74.18 -55.13 6.43 Favored 'General case' 0 N--CA 1.503 2.185 0 N-CA-C 103.841 -2.651 . . . . 0.0 103.841 174.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.792 ' HA ' HD13 ' A' ' 14' ' ' LEU . 2.0 tmt_? -49.78 -27.79 5.41 Favored 'General case' 0 N--CA 1.507 2.384 0 CA-C-N 114.088 -1.415 . . . . 0.0 112.865 177.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.857 HG22 ' HA ' ' A' ' 17' ' ' MET . 23.3 m -88.82 -47.34 15.28 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.012 0 C-N-CA 119.491 -0.884 . . . . 0.0 111.598 -178.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -51.77 -34.16 38.38 Favored 'General case' 0 N--CA 1.518 2.931 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 176.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.84 ' HB2' HD21 ' A' ' 14' ' ' LEU . 14.9 t90 -61.55 -60.4 3.76 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 176.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.828 HD23 ' HA ' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -55.57 -31.18 61.96 Favored 'General case' 0 N--CA 1.507 2.378 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.545 178.654 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -77.62 -45.19 25.85 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.792 -0.568 . . . . 0.0 109.755 179.22 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.4 tptp -67.09 -34.02 76.73 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 122.047 -0.408 . . . . 0.0 111.078 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -44.62 95.06 Favored 'General case' 0 N--CA 1.513 2.708 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.54 -41.45 75.92 Favored 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 177.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -68.24 -18.94 64.69 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 122.017 -0.427 . . . . 0.0 111.502 178.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -73.64 -45.64 51.56 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.626 -0.671 . . . . 0.0 110.132 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.9 t -93.29 21.03 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.615 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.936 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 45.2 m80 -139.31 -52.66 0.55 Allowed 'General case' 0 N--CA 1.508 2.468 0 O-C-N 120.93 -1.106 . . . . 0.0 109.41 178.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 24.7 m-80 -103.39 88.64 3.16 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 5.8 p90 -132.23 75.16 1.62 Allowed 'General case' 0 N--CA 1.506 2.369 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.5 m 39.89 73.97 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.522 3.139 0 CA-C-O 121.999 0.904 . . . . 0.0 111.886 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -147.69 -149.44 0.29 Allowed 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.505 2.287 0 CA-C-O 117.689 -1.148 . . . . 0.0 110.124 -179.783 . . . . . . . . 1 1 . 1 stop_ save_