data_1m3a_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 1m3a _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.452 -0.329 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . 0.558 ' CE2' ' HB2' ' A' ' 160' ' ' ARG . 80.2 m-85 -152.71 169.23 23.24 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.541 1.15 . . . . 0.0 110.996 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.525 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 26.8 m -145.54 148.41 17.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.487 1.117 . . . . 0.0 109.306 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.464 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 5.6 ttp180 -104.34 111.47 24.12 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.514 1.134 . . . . 0.0 110.314 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.454 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -80.18 107.05 12.66 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.508 1.13 . . . . 0.0 109.34 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.405 ' O ' ' HG2' ' A' ' 155' ' ' LYS . 1.1 mt -88.33 21.8 2.72 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.5 1.125 . . . . 0.0 109.287 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.468 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 72.3 m-85 -141.55 138.86 32.99 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.487 1.117 . . . . 0.0 111.01 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.28 153.46 25.85 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.469 1.105 . . . . 0.0 109.319 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.597 ' HB3' ' CE1' ' A' ' 153' ' ' PHE . 4.7 t80 . . . . . 0 C--N 1.325 -0.49 0 O-C-N 124.505 1.128 . . . . 0.0 110.991 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.515 ' HB3' ' CD1' ' A' ' 182' ' ' ILE . 34.7 tp . . . . . 0 N--CA 1.453 -0.305 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . 0.435 ' CB ' ' O ' ' A' ' 143' ' ' PHE . 18.4 Cg_endo -75.03 170.2 20.93 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.535 1.808 . . . . 0.0 111.029 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.597 ' CE1' ' HB3' ' A' ' 143' ' ' PHE . 0.7 OUTLIER -173.83 -175.59 1.1 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.502 1.126 . . . . 0.0 110.966 -179.996 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . 0.439 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -131.56 135.87 47.36 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.505 1.128 . . . . 0.0 109.313 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' LYS . . . . . 0.439 ' C ' ' O ' ' A' ' 154' ' ' LYS . 0.0 OUTLIER -37.54 110.88 0.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.511 1.132 . . . . 0.0 109.353 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 94.79 42.41 3.86 Favored Glycine 0 CA--C 1.529 0.955 0 O-C-N 124.496 1.122 . . . . 0.0 110.999 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . 0.404 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 17.6 t70 -111.68 165.88 11.65 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.496 0.762 . . . . 0.0 109.339 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.441 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 4.9 mp -119.89 140.16 44.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.504 1.128 . . . . 0.0 109.338 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . 0.492 HD13 ' CG2' ' A' ' 182' ' ' ILE . 0.8 OUTLIER -137.07 134.64 36.72 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.5 1.125 . . . . 0.0 109.297 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.558 ' HB2' ' CE2' ' A' ' 136' ' ' TYR . 10.0 ttm180 -87.1 104.07 15.99 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.507 1.129 . . . . 0.0 110.28 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' ILE . . . . . 0.492 HG23 ' CB ' ' A' ' 172' ' ' ALA . 0.8 OUTLIER -84.62 125.93 40.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.44 1.088 . . . . 0.0 109.286 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 5.9 ptt180 -121.43 -24.94 5.28 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.45 1.094 . . . . 0.0 110.279 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' ASP . . . . . 0.446 ' HB2' ' CB ' ' A' ' 171' ' ' ASN . 79.2 m-20 -126.4 131.82 51.66 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.471 1.107 . . . . 0.0 109.261 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . 0.465 ' HD2' ' CD1' ' A' ' 161' ' ' ILE . 0.0 OUTLIER -133.46 69.62 76.96 Favored Pre-proline 0 C--N 1.325 -0.466 0 O-C-N 124.473 1.108 . . . . 0.0 109.248 179.998 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.02 -52.15 0.11 Allowed 'Trans proline' 0 C--N 1.359 1.12 0 O-C-N 124.512 1.796 . . . . 0.0 111.002 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 166' ' ' GLU . . . . . 0.444 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 4.1 mm-40 -76.73 175.1 9.71 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.478 1.111 . . . . 0.0 110.267 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . 0.522 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 3.3 pt-20 -106.56 31.69 5.05 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.467 1.104 . . . . 0.0 110.321 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.522 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 3.1 mt-30 -172.35 -40.17 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.475 1.11 . . . . 0.0 110.316 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -106.04 104.57 14.3 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 0.0 107.981 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 170' ' ' TRP . . . . . 0.56 ' CE3' HG21 ' A' ' 184' ' ' VAL . 50.1 m0 -109.45 154.6 22.4 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.527 1.142 . . . . 0.0 107.988 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . 0.448 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 1.0 OUTLIER -88.25 111.06 21.24 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.503 1.127 . . . . 0.0 109.355 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . 0.492 ' CB ' HG23 ' A' ' 161' ' ' ILE . . . -127.51 167.34 16.43 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.492 1.12 . . . . 0.0 109.292 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.51 ' CG ' ' O ' ' A' ' 177' ' ' GLY . 6.9 mp0 -101.39 156.28 17.55 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.473 1.108 . . . . 0.0 110.287 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 174' ' ' ASP . . . . . 0.478 ' OD1' ' N ' ' A' ' 178' ' ' LYS . 45.2 p-10 -93.85 -160.19 0.75 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.444 1.09 . . . . 0.0 109.316 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 45.0 t -80.92 11.46 3.97 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.478 1.111 . . . . 0.0 109.996 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -132.22 -2.25 3.56 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.435 1.084 . . . . 0.0 110.337 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . 0.51 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 96.01 -12.28 67.12 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.462 1.102 . . . . 0.0 110.985 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . 0.478 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 2.9 mtpp -52.67 113.25 1.01 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.474 0.749 . . . . 0.0 109.303 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . 0.441 ' HG2' ' CD ' ' A' ' 173' ' ' GLU . 0.5 OUTLIER -87.89 126.26 34.94 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.485 1.116 . . . . 0.0 110.304 -179.99 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . 0.448 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -152.72 -169.3 17.83 Favored Glycine 0 CA--C 1.53 1.002 0 O-C-N 124.522 1.139 . . . . 0.0 110.993 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.4 mmt -86.78 126.03 34.33 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.528 0.781 . . . . 0.0 111.024 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.515 ' CD1' ' HB3' ' A' ' 151' ' ' LEU . 18.1 mm -121.5 134.56 24.58 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.475 1.109 . . . . 0.0 109.313 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 183' ' ' PRO . . . . . 0.681 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.01 121.13 6.38 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.543 1.812 . . . . 0.0 111.025 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.835 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 9.8 t -69.66 -30.28 2.04 Favored Pre-proline 0 C--N 1.325 -0.475 0 O-C-N 124.51 1.131 . . . . 0.0 109.299 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 185' ' ' PRO . . . . . 0.835 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -75.03 -23.96 13.24 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.527 1.804 . . . . 0.0 111.003 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . 0.681 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.5 m-85 -100.32 -5.02 28.02 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.545 1.153 . . . . 0.0 110.989 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 187' ' ' VAL . . . . . 0.476 ' O ' ' O ' ' A' ' 184' ' ' VAL . 3.3 m -128.49 152.63 36.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.539 1.149 . . . . 0.0 109.273 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 188' ' ' GLU . . . . . 0.525 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.0 OUTLIER -107.98 166.08 10.98 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.491 1.119 . . . . 0.0 110.322 179.992 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.501 0 O-C-N 124.491 1.12 . . . . 0.0 109.325 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . 0.554 ' HB3' ' CE2' ' A' ' 136' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . 0.554 ' CE2' ' HB3' ' A' ' 135' ' ' CYS . 68.1 m-85 -151.3 173.9 13.94 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.475 1.109 . . . . 0.0 111.035 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.523 ' HB ' ' CG2' ' A' ' 187' ' ' VAL . 4.2 m -147.67 149.55 15.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 O-C-N 124.492 1.12 . . . . 0.0 109.302 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.516 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 16.4 ttp180 -105.25 107.49 18.5 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.501 1.126 . . . . 0.0 110.316 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.459 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -80.92 103.95 11.1 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.47 1.106 . . . . 0.0 109.371 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.412 ' C ' ' HG2' ' A' ' 155' ' ' LYS . 2.9 mp -88.89 22.99 2.49 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.527 1.142 . . . . 0.0 109.332 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.429 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 36.4 m-85 -144.01 145.2 32.05 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.514 1.134 . . . . 0.0 111.009 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . 0.401 ' N ' ' HB2' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -87.63 152.66 21.99 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.563 1.164 . . . . 0.0 109.328 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.604 ' HB3' ' CZ ' ' A' ' 153' ' ' PHE . 5.8 t80 . . . . . 0 C--N 1.326 -0.449 0 O-C-N 124.469 1.105 . . . . 0.0 111.013 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.495 ' CD2' ' O ' ' A' ' 172' ' ' ALA . 11.6 tp . . . . . 0 N--CA 1.453 -0.287 0 N-CA-C 109.344 -0.614 . . . . 0.0 109.344 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.08 133.62 16.69 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.417 1.746 . . . . 0.0 110.967 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.604 ' CZ ' ' HB3' ' A' ' 143' ' ' PHE . 4.8 p90 -150.8 -179.05 6.95 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 0.0 111.023 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -130.94 147.16 52.54 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.447 1.092 . . . . 0.0 109.238 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' LYS . . . . . 0.412 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -56.34 118.12 4.46 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.538 1.149 . . . . 0.0 109.365 179.941 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 99.72 35.57 4.56 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.472 1.108 . . . . 0.0 110.984 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -120.61 170.29 9.56 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.522 0.778 . . . . 0.0 109.286 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.455 ' C ' ' HG ' ' A' ' 159' ' ' LEU . 5.2 mt -119.46 148.23 22.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 O-C-N 124.553 1.158 . . . . 0.0 109.268 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . 0.526 HD11 ' CG2' ' A' ' 182' ' ' ILE . 0.4 OUTLIER -139.79 136.69 34.33 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.496 1.123 . . . . 0.0 109.28 -179.976 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.455 ' HA ' ' HA ' ' A' ' 136' ' ' TYR . 6.1 ttt-85 -87.69 100.96 13.21 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.554 1.159 . . . . 0.0 110.275 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' ILE . . . . . 0.5 ' HA ' ' CB ' ' A' ' 172' ' ' ALA . 0.0 OUTLIER -86.1 130.55 36.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.566 1.166 . . . . 0.0 109.322 179.946 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -129.19 -24.49 2.85 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.5 1.125 . . . . 0.0 110.32 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' ASP . . . . . 0.427 ' HB2' ' CB ' ' A' ' 171' ' ' ASN . 8.7 m-20 -124.78 147.97 48.39 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.406 1.066 . . . . 0.0 109.305 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . 0.468 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 10.9 mtmm -144.0 71.32 16.71 Favored Pre-proline 0 C--N 1.324 -0.508 0 O-C-N 124.535 1.147 . . . . 0.0 109.272 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -75.01 4.97 4.27 Favored 'Trans proline' 0 C--N 1.36 1.172 0 O-C-N 124.453 1.765 . . . . 0.0 111.05 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 166' ' ' GLU . . . . . 0.468 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 26.3 mm-40 -141.46 172.75 12.25 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.469 1.106 . . . . 0.0 110.316 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -100.07 16.38 24.25 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.521 1.138 . . . . 0.0 110.318 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.428 ' NE2' ' HG3' ' A' ' 185' ' ' PRO . 7.0 mt-30 -157.84 -43.19 0.06 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.53 1.144 . . . . 0.0 110.26 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 169' ' ' TRP . . . . . 0.504 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 90.0 m95 -100.18 101.03 11.96 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 170' ' ' TRP . . . . . 0.47 ' CD2' HG22 ' A' ' 184' ' ' VAL . 28.8 m0 -107.96 154.45 21.61 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.545 1.153 . . . . 0.0 108.026 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . 0.427 ' CB ' ' HB2' ' A' ' 163' ' ' ASP . 0.5 OUTLIER -87.77 111.79 21.73 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.471 1.107 . . . . 0.0 109.264 -179.921 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . 0.5 ' CB ' ' HA ' ' A' ' 161' ' ' ILE . . . -132.81 163.7 28.49 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.556 1.16 . . . . 0.0 109.286 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.488 ' CG ' ' O ' ' A' ' 177' ' ' GLY . 0.6 OUTLIER -95.98 158.88 15.25 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.493 1.12 . . . . 0.0 110.288 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -94.58 -166.18 1.43 Allowed 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.512 1.133 . . . . 0.0 109.261 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.91 5.64 6.2 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.529 1.143 . . . . 0.0 110.042 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -124.64 -5.31 7.59 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.444 1.09 . . . . 0.0 110.264 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . 0.488 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 98.34 -7.48 61.94 Favored Glycine 0 CA--C 1.53 0.979 0 O-C-N 124.429 1.081 . . . . 0.0 110.99 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 5.4 mtmt -56.76 112.77 1.4 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.481 0.753 . . . . 0.0 109.322 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.1 OUTLIER -87.8 123.37 32.52 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.49 1.119 . . . . 0.0 110.322 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . 0.459 ' N ' HD12 ' A' ' 151' ' ' LEU . . . -155.46 -162.93 11.66 Favored Glycine 0 CA--C 1.531 1.072 0 O-C-N 124.514 1.134 . . . . 0.0 110.959 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 181' ' ' MET . . . . . 0.504 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.2 OUTLIER -88.25 130.65 35.04 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.606 0.827 . . . . 0.0 111.005 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.526 ' CG2' HD11 ' A' ' 159' ' ' LEU . 23.0 mm -126.92 131.83 24.05 Favored Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 124.53 1.144 . . . . 0.0 109.255 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 183' ' ' PRO . . . . . 0.685 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.02 123.19 7.69 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.485 1.782 . . . . 0.0 110.944 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.827 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 14.0 t -71.93 -31.08 1.64 Allowed Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.496 1.123 . . . . 0.0 109.331 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 185' ' ' PRO . . . . . 0.827 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.96 -21.01 16.38 Favored 'Trans proline' 0 C--N 1.36 1.145 0 O-C-N 124.508 1.794 . . . . 0.0 111.057 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . 0.685 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.9 m-85 -97.72 -21.47 16.97 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.481 1.113 . . . . 0.0 110.984 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 187' ' ' VAL . . . . . 0.523 ' CG2' ' HB ' ' A' ' 137' ' ' VAL . 1.4 m -116.35 157.93 17.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.474 1.109 . . . . 0.0 109.371 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 188' ' ' GLU . . . . . 0.4 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.2 OUTLIER -102.24 163.61 12.14 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.428 1.08 . . . . 0.0 110.331 179.968 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 189' ' ' LYS . . . . . 0.468 ' NZ ' ' CZ3' ' A' ' 170' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.448 0 O-C-N 124.573 1.17 . . . . 0.0 109.3 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 27.0 p . . . . . 0 N--CA 1.452 -0.343 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . 0.575 ' CE1' ' HB2' ' A' ' 160' ' ' ARG . 12.7 m-85 -130.21 164.64 24.07 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.489 1.118 . . . . 0.0 111.044 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.542 HG21 ' CG2' ' A' ' 187' ' ' VAL . 0.5 OUTLIER -147.69 165.06 6.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.547 1.154 . . . . 0.0 109.274 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.451 ' HG3' ' CD1' ' A' ' 158' ' ' ILE . 2.5 ttm180 -125.49 118.68 26.31 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.498 1.124 . . . . 0.0 110.324 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.519 ' CB ' HG13 ' A' ' 187' ' ' VAL . . . -84.03 113.33 20.94 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.493 1.121 . . . . 0.0 109.287 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.8 mt -87.14 20.28 2.78 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.565 1.165 . . . . 0.0 109.329 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.446 ' CD2' ' CD2' ' A' ' 186' ' ' TYR . 17.8 t80 -142.8 166.78 23.72 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 124.467 1.105 . . . . 0.0 110.958 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -106.78 154.7 20.61 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.484 1.115 . . . . 0.0 109.321 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.466 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 11.0 t80 . . . . . 0 C--N 1.324 -0.505 0 O-C-N 124.495 1.122 . . . . 0.0 111.037 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.504 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 13.0 tp . . . . . 0 N--CA 1.453 -0.295 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . 0.452 ' CB ' ' O ' ' A' ' 143' ' ' PHE . 18.3 Cg_endo -74.92 169.53 22.41 Favored 'Trans proline' 0 C--N 1.36 1.151 0 O-C-N 124.558 1.82 . . . . 0.0 111.039 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.466 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 2.0 p90 -174.86 173.13 2.79 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.522 1.139 . . . . 0.0 110.99 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . 0.495 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -123.39 127.3 48.27 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.529 1.143 . . . . 0.0 109.301 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' LYS . . . . . 0.495 ' C ' ' O ' ' A' ' 154' ' ' LYS . 0.9 OUTLIER -32.58 107.51 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.544 0 O-C-N 124.542 1.151 . . . . 0.0 109.298 -179.975 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 99.79 39.5 3.36 Favored Glycine 0 CA--C 1.53 0.988 0 O-C-N 124.453 1.096 . . . . 0.0 110.975 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . 0.441 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 22.2 t70 -111.9 172.05 7.13 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.454 0.737 . . . . 0.0 109.32 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.46 HD12 ' O ' ' A' ' 137' ' ' VAL . 6.1 mm -123.64 149.31 27.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.502 1.126 . . . . 0.0 109.294 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . 0.454 ' HG ' ' C ' ' A' ' 158' ' ' ILE . 3.1 mt -145.86 140.07 26.78 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.456 1.098 . . . . 0.0 109.311 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.575 ' HB2' ' CE1' ' A' ' 136' ' ' TYR . 1.9 ttt180 -88.64 102.17 14.7 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.514 1.134 . . . . 0.0 110.302 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' ILE . . . . . 0.522 ' CD1' ' HB2' ' A' ' 170' ' ' TRP . 0.1 OUTLIER -83.12 124.13 39.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.535 1.147 . . . . 0.0 109.287 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -118.91 -25.11 6.37 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.545 1.153 . . . . 0.0 110.335 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' ASP . . . . . 0.453 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 1.4 m-20 -131.74 157.77 42.92 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.53 1.144 . . . . 0.0 109.236 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . 0.518 ' HB2' ' CG ' ' A' ' 170' ' ' TRP . 0.7 OUTLIER -165.13 65.29 1.1 Allowed Pre-proline 0 C--N 1.326 -0.432 0 O-C-N 124.497 1.123 . . . . 0.0 109.289 -179.956 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . 0.4 ' HD3' ' N ' ' A' ' 164' ' ' LYS . 18.4 Cg_endo -74.98 6.46 3.37 Favored 'Trans proline' 0 C--N 1.359 1.131 0 O-C-N 124.473 1.775 . . . . 0.0 110.992 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 166' ' ' GLU . . . . . 0.446 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 6.5 mm-40 -131.21 171.04 13.76 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.457 1.098 . . . . 0.0 110.279 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . 0.518 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 2.5 mt-10 -112.56 48.07 1.03 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.448 1.092 . . . . 0.0 110.277 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.518 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 1.3 mt-30 173.64 -32.12 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.487 1.117 . . . . 0.0 110.281 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 169' ' ' TRP . . . . . 0.436 ' O ' ' HB2' ' A' ' 166' ' ' GLU . 76.3 m95 -123.27 103.26 8.41 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.524 1.14 . . . . 0.0 107.994 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 170' ' ' TRP . . . . . 0.522 ' HB2' ' CD1' ' A' ' 161' ' ' ILE . 30.0 m0 -108.68 169.68 8.51 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.48 1.112 . . . . 0.0 108.002 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . 0.487 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -104.96 115.87 31.0 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.5 1.125 . . . . 0.0 109.236 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . 0.503 ' HB1' ' CD1' ' A' ' 161' ' ' ILE . . . -133.88 167.97 19.6 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.485 1.116 . . . . 0.0 109.307 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.54 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 4.0 mp0 -100.44 158.67 15.73 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.533 1.146 . . . . 0.0 110.297 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 174' ' ' ASP . . . . . 0.496 ' OD1' ' N ' ' A' ' 177' ' ' GLY . 44.2 p-10 -94.55 -161.25 0.84 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.574 1.171 . . . . 0.0 109.298 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.73 14.06 2.85 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.528 1.143 . . . . 0.0 109.97 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -133.47 -5.34 2.94 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.474 1.109 . . . . 0.0 110.297 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . 0.51 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 99.85 -12.72 60.91 Favored Glycine 0 CA--C 1.531 1.039 0 O-C-N 124.477 1.111 . . . . 0.0 110.921 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . 0.433 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 2.8 mttm -53.78 112.75 0.99 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.506 0.768 . . . . 0.0 109.298 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -88.51 128.08 35.54 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.402 1.064 . . . . 0.0 110.356 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . 0.487 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -152.73 -167.87 16.03 Favored Glycine 0 CA--C 1.529 0.966 0 O-C-N 124.454 1.096 . . . . 0.0 111.039 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -96.75 118.91 34.22 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.522 0.778 . . . . 0.0 111.06 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.504 ' CG2' ' HB3' ' A' ' 151' ' ' LEU . 4.8 pt -112.77 141.39 25.32 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.505 1.128 . . . . 0.0 109.333 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 183' ' ' PRO . . . . . 0.777 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.1 Cg_endo -75.01 126.74 10.16 Favored 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.48 1.779 . . . . 0.0 111.058 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.828 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 48.8 t -71.98 -30.61 1.52 Allowed Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.498 1.124 . . . . 0.0 109.248 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 185' ' ' PRO . . . . . 0.828 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.94 -26.69 10.81 Favored 'Trans proline' 0 C--N 1.36 1.16 0 O-C-N 124.459 1.768 . . . . 0.0 111.005 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . 0.777 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 7.2 m-85 -98.76 2.46 46.95 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.451 1.094 . . . . 0.0 110.986 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 187' ' ' VAL . . . . . 0.586 HG21 ' HA ' ' A' ' 184' ' ' VAL . 2.0 m -140.02 160.25 26.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 124.453 1.096 . . . . 0.0 109.365 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 188' ' ' GLU . . . . . 0.411 ' O ' ' HB ' ' A' ' 137' ' ' VAL . 0.9 OUTLIER -111.45 149.08 31.79 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.544 1.152 . . . . 0.0 110.249 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.496 0 O-C-N 124.553 1.158 . . . . 0.0 109.274 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . 0.491 ' HB3' ' CE2' ' A' ' 136' ' ' TYR . 1.3 m . . . . . 0 N--CA 1.453 -0.313 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . 0.557 ' CE1' ' HD2' ' A' ' 160' ' ' ARG . 34.6 m-85 -150.58 177.62 9.86 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.514 1.134 . . . . 0.0 111.007 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.52 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 9.9 m -143.85 141.04 25.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.479 1.112 . . . . 0.0 109.302 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.602 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 14.0 ttp180 -99.65 112.28 24.52 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.551 1.157 . . . . 0.0 110.291 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.456 ' HB1' HG12 ' A' ' 187' ' ' VAL . . . -80.07 112.37 17.31 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.579 1.174 . . . . 0.0 109.309 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.497 ' N ' HD12 ' A' ' 140' ' ' LEU . 0.1 OUTLIER -91.15 22.9 3.51 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.586 1.179 . . . . 0.0 109.312 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.486 ' CG ' ' CD2' ' A' ' 186' ' ' TYR . 55.3 m-85 -147.36 156.24 42.72 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.549 1.156 . . . . 0.0 110.926 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.67 128.59 45.0 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.582 1.176 . . . . 0.0 109.27 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.62 ' HB3' ' CZ ' ' A' ' 153' ' ' PHE . 0.8 OUTLIER . . . . . 0 C--N 1.326 -0.447 0 O-C-N 124.468 1.105 . . . . 0.0 111.011 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.64 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 14.6 tp . . . . . 0 N--CA 1.454 -0.262 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 135.11 18.6 Favored 'Trans proline' 0 C--N 1.36 1.171 0 O-C-N 124.508 1.794 . . . . 0.0 111.04 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.62 ' CZ ' ' HB3' ' A' ' 143' ' ' PHE . 4.8 p90 -157.25 -178.59 7.47 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.469 1.105 . . . . 0.0 110.947 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.93 142.7 50.86 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.501 1.126 . . . . 0.0 109.273 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 4.7 ttpt -48.67 118.83 2.73 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.452 1.095 . . . . 0.0 109.29 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 91.82 42.99 4.6 Favored Glycine 0 CA--C 1.529 0.953 0 O-C-N 124.446 1.091 . . . . 0.0 110.981 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . 0.419 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 17.8 t70 -121.91 171.11 9.16 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.468 0.746 . . . . 0.0 109.271 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.416 ' O ' HD21 ' A' ' 159' ' ' LEU . 2.8 mp -119.62 147.97 22.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.523 1.14 . . . . 0.0 109.279 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . 0.476 ' O ' ' N ' ' A' ' 137' ' ' VAL . 3.4 mt -143.5 139.9 30.04 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.443 1.089 . . . . 0.0 109.237 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.557 ' HD2' ' CE1' ' A' ' 136' ' ' TYR . 8.3 ttt180 -84.59 101.37 12.06 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.564 1.165 . . . . 0.0 110.265 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' ILE . . . . . 0.483 ' CD1' ' HB1' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -82.91 122.67 37.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 O-C-N 124.511 1.132 . . . . 0.0 109.244 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.24 -26.73 5.81 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.54 1.15 . . . . 0.0 110.293 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.14 154.17 39.0 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.537 1.148 . . . . 0.0 109.32 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . 0.475 ' HB2' ' CE2' ' A' ' 170' ' ' TRP . 5.6 ptpp? -165.85 71.14 1.26 Allowed Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.544 1.152 . . . . 0.0 109.253 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.09 -38.38 1.57 Allowed 'Trans proline' 0 C--N 1.36 1.164 0 O-C-N 124.463 1.77 . . . . 0.0 110.946 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 166' ' ' GLU . . . . . 0.44 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.3 mt-10 -85.58 -177.65 6.47 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.492 1.12 . . . . 0.0 110.277 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -114.1 17.33 17.82 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.416 1.073 . . . . 0.0 110.233 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.453 ' O ' ' N ' ' A' ' 184' ' ' VAL . 33.5 mt-30 -152.13 -40.05 0.11 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.481 1.113 . . . . 0.0 110.288 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 169' ' ' TRP . . . . . 0.439 ' CE3' ' HG2' ' A' ' 181' ' ' MET . 73.9 m95 -107.54 111.18 23.33 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 170' ' ' TRP . . . . . 0.535 ' CD2' ' CG2' ' A' ' 184' ' ' VAL . 51.3 m0 -114.84 164.17 14.48 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.552 1.158 . . . . 0.0 108.063 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -102.57 121.76 43.02 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.546 1.153 . . . . 0.0 109.304 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . 0.483 ' HB1' ' CD1' ' A' ' 161' ' ' ILE . . . -141.91 162.3 35.83 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.49 1.119 . . . . 0.0 109.312 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.519 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 2.2 mp0 -96.48 154.41 17.29 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.476 1.11 . . . . 0.0 110.246 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 174' ' ' ASP . . . . . 0.409 ' HA ' HD21 ' A' ' 159' ' ' LEU . 0.2 OUTLIER -89.13 -162.01 0.82 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.485 1.116 . . . . 0.0 109.268 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 2.4 m -79.18 5.73 11.43 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.47 1.106 . . . . 0.0 109.973 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -123.8 -5.38 8.04 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.466 1.104 . . . . 0.0 110.327 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . 0.501 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 97.48 -6.41 63.13 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.555 1.159 . . . . 0.0 110.969 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . 0.482 ' O ' ' CD1' ' A' ' 151' ' ' LEU . 0.9 OUTLIER -57.26 111.92 1.22 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.478 0.752 . . . . 0.0 109.292 -179.974 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . 0.434 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -87.02 125.57 34.18 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.46 1.1 . . . . 0.0 110.29 179.983 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . 0.407 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -154.75 -173.97 24.2 Favored Glycine 0 CA--C 1.531 1.035 0 O-C-N 124.46 1.1 . . . . 0.0 110.98 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 181' ' ' MET . . . . . 0.439 ' HG2' ' CE3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -96.67 128.06 43.25 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.526 0.78 . . . . 0.0 111.013 179.962 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.64 ' CG2' ' HB3' ' A' ' 151' ' ' LEU . 4.2 pt -128.38 156.65 76.56 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.448 1.093 . . . . 0.0 109.287 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 183' ' ' PRO . . . . . 0.781 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.1 Cg_endo -75.04 132.79 15.77 Favored 'Trans proline' 0 C--N 1.361 1.197 0 O-C-N 124.488 1.783 . . . . 0.0 111.003 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.825 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 39.2 t -78.38 -31.95 0.81 Allowed Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.525 1.141 . . . . 0.0 109.319 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 185' ' ' PRO . . . . . 0.825 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.99 -26.07 11.29 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.467 1.772 . . . . 0.0 110.983 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . 0.781 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 2.9 m-85 -96.58 7.66 46.02 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.488 1.117 . . . . 0.0 110.958 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 187' ' ' VAL . . . . . 0.602 ' HA ' ' O ' ' A' ' 138' ' ' ARG . 3.5 m -135.98 151.98 29.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 O-C-N 124.417 1.073 . . . . 0.0 109.322 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 188' ' ' GLU . . . . . 0.52 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 39.4 tt0 -101.85 153.25 20.0 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.499 1.124 . . . . 0.0 110.264 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 2.3 ptmm? . . . . . 0 C--N 1.326 -0.439 0 O-C-N 124.524 1.14 . . . . 0.0 109.272 179.995 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 160' ' ' ARG . 3.6 m . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -150.93 163.35 38.9 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.526 1.141 . . . . 0.0 111.044 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.546 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 13.5 m -144.58 136.21 21.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.517 1.136 . . . . 0.0 109.296 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.497 ' CB ' ' HG2' ' A' ' 188' ' ' GLU . 6.6 ttp180 -103.27 110.9 23.05 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.474 1.108 . . . . 0.0 110.299 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.415 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -81.37 104.64 11.96 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.451 1.095 . . . . 0.0 109.334 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.411 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 1.7 mt -89.59 22.93 2.8 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.503 1.127 . . . . 0.0 109.218 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -140.52 149.7 42.79 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.5 1.125 . . . . 0.0 111.014 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.17 128.92 34.97 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.49 1.119 . . . . 0.0 109.312 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.598 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.4 OUTLIER . . . . . 0 C--N 1.325 -0.494 0 O-C-N 124.572 1.17 . . . . 0.0 111.007 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.491 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 6.4 tp . . . . . 0 N--CA 1.452 -0.344 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.99 171.28 18.63 Favored 'Trans proline' 0 C--N 1.36 1.138 0 O-C-N 124.465 1.771 . . . . 0.0 111.04 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.598 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 8.7 p90 -174.08 178.88 2.02 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.433 1.083 . . . . 0.0 111.008 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.62 135.94 54.16 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.53 1.144 . . . . 0.0 109.31 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.3 OUTLIER -42.9 108.07 0.1 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.523 1.139 . . . . 0.0 109.358 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 105.7 34.23 3.35 Favored Glycine 0 CA--C 1.529 0.946 0 O-C-N 124.448 1.093 . . . . 0.0 111.018 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -109.97 176.58 5.01 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.49 0.759 . . . . 0.0 109.308 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.438 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 51.7 mt -131.67 148.25 32.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.483 1.114 . . . . 0.0 109.288 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . 0.49 HD12 ' CG2' ' A' ' 182' ' ' ILE . 2.3 mt -145.01 139.94 27.81 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.512 1.133 . . . . 0.0 109.409 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.494 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 14.0 ttt-85 -86.19 97.12 10.18 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.465 1.103 . . . . 0.0 110.311 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' ILE . . . . . 0.486 ' HA ' ' CB ' ' A' ' 172' ' ' ALA . 0.0 OUTLIER -82.98 120.66 34.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.512 1.133 . . . . 0.0 109.284 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.11 -22.71 7.67 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.442 1.089 . . . . 0.0 110.373 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -122.05 137.4 54.82 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.458 1.098 . . . . 0.0 109.276 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . 0.52 ' HB2' ' CE2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -147.92 66.95 9.92 Favored Pre-proline 0 C--N 1.325 -0.459 0 O-C-N 124.455 1.097 . . . . 0.0 109.292 179.967 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.0 -38.48 1.57 Allowed 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.523 1.801 . . . . 0.0 111.036 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 166' ' ' GLU . . . . . 0.469 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 8.8 mm-40 -88.08 176.21 7.39 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.469 1.106 . . . . 0.0 110.324 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . 0.443 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 6.7 pt-20 -113.99 47.71 1.17 Allowed 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.524 1.14 . . . . 0.0 110.229 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.443 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 0.2 OUTLIER 174.41 -33.84 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.545 1.153 . . . . 0.0 110.351 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 169' ' ' TRP . . . . . 0.471 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 74.5 m95 -117.07 105.32 12.15 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 170' ' ' TRP . . . . . 0.552 ' CE2' HG21 ' A' ' 184' ' ' VAL . 52.8 m0 -110.27 163.52 13.56 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.481 1.113 . . . . 0.0 107.997 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . 0.553 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -101.78 119.32 38.6 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.394 1.059 . . . . 0.0 109.287 179.985 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . 0.494 ' HA ' ' O ' ' A' ' 160' ' ' ARG . . . -136.78 167.52 21.29 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.53 1.144 . . . . 0.0 109.292 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.722 ' HG3' ' HA2' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -98.32 159.4 14.97 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.475 1.109 . . . . 0.0 110.301 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 174' ' ' ASP . . . . . 0.678 ' N ' ' HG2' ' A' ' 173' ' ' GLU . 42.8 p-10 -95.85 -157.03 0.55 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.581 1.176 . . . . 0.0 109.309 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 38.3 t -85.66 14.38 5.83 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.567 1.167 . . . . 0.0 110.09 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -136.78 -1.96 2.18 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.546 1.154 . . . . 0.0 110.334 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . 0.722 ' HA2' ' HG3' ' A' ' 173' ' ' GLU . . . 100.03 -17.53 57.03 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 124.531 1.145 . . . . 0.0 111.113 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . 0.452 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 5.3 mttm -49.62 108.28 0.19 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.584 0.814 . . . . 0.0 109.299 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . 0.438 ' HA ' ' HA ' ' A' ' 173' ' ' GLU . 33.4 mtm180 -90.75 127.04 36.19 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.457 1.098 . . . . 0.0 110.305 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . 0.553 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -149.92 -164.13 11.57 Favored Glycine 0 CA--C 1.53 1.012 0 O-C-N 124.488 1.117 . . . . 0.0 110.978 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 181' ' ' MET . . . . . 0.471 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -100.69 126.81 47.24 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.533 0.784 . . . . 0.0 111.021 -179.979 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.491 ' CG2' ' HB3' ' A' ' 151' ' ' LEU . 0.2 OUTLIER -126.43 150.87 71.64 Favored Pre-proline 0 C--N 1.324 -0.506 0 O-C-N 124.554 1.159 . . . . 0.0 109.324 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 183' ' ' PRO . . . . . 0.756 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.1 Cg_endo -75.1 131.34 14.07 Favored 'Trans proline' 0 C--N 1.361 1.194 0 O-C-N 124.496 1.787 . . . . 0.0 111.006 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.839 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 55.3 t -76.18 -31.21 0.96 Allowed Pre-proline 0 C--N 1.325 -0.482 0 O-C-N 124.418 1.074 . . . . 0.0 109.287 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 185' ' ' PRO . . . . . 0.839 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.95 -24.13 13.23 Favored 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.553 1.817 . . . . 0.0 111.005 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . 0.756 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.6 m-85 -96.27 -5.02 41.2 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.463 1.102 . . . . 0.0 110.989 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 187' ' ' VAL . . . . . 0.613 HG23 ' HA ' ' A' ' 184' ' ' VAL . 2.9 m -127.73 153.72 37.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.484 1.115 . . . . 0.0 109.259 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 188' ' ' GLU . . . . . 0.546 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 4.6 pt-20 -105.78 155.59 19.14 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.509 1.13 . . . . 0.0 110.287 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.468 0 O-C-N 124.483 1.114 . . . . 0.0 109.332 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . 0.652 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 1.5 p . . . . . 0 N--CA 1.452 -0.335 0 N-CA-C 108.361 -0.978 . . . . 0.0 108.361 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . 0.652 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 0.0 OUTLIER -151.12 177.4 10.23 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.469 1.106 . . . . 0.0 110.999 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.558 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 28.5 m -142.48 155.24 18.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 O-C-N 124.586 1.179 . . . . 0.0 109.289 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.449 ' HA ' ' O ' ' A' ' 157' ' ' ASP . 0.2 OUTLIER -107.84 114.35 28.23 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.466 1.104 . . . . 0.0 110.248 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.523 ' O ' ' N ' ' A' ' 156' ' ' GLY . . . -80.63 110.23 15.91 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.422 1.076 . . . . 0.0 109.263 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.412 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 4.3 mt -88.5 23.79 2.13 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.547 1.154 . . . . 0.0 109.236 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.404 ' O ' ' N ' ' A' ' 155' ' ' LYS . 23.8 t80 -140.58 168.83 18.87 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 124.485 1.116 . . . . 0.0 110.994 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -109.14 122.79 48.06 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.54 1.15 . . . . 0.0 109.325 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.474 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 4.4 t80 . . . . . 0 C--N 1.326 -0.445 0 O-C-N 124.508 1.13 . . . . 0.0 111.004 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.517 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 13.7 tp . . . . . 0 N--CA 1.452 -0.329 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . 0.5 ' O ' ' OD2' ' A' ' 174' ' ' ASP . 18.3 Cg_endo -74.96 142.14 27.61 Favored 'Trans proline' 0 C--N 1.359 1.13 0 O-C-N 124.531 1.806 . . . . 0.0 111.048 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.474 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 7.5 p90 -164.92 -180.0 6.12 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.505 1.128 . . . . 0.0 111.036 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . 0.423 ' O ' ' C ' ' A' ' 155' ' ' LYS . 1.8 ttmt -135.76 144.17 45.67 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.489 1.118 . . . . 0.0 109.277 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' LYS . . . . . 0.423 ' C ' ' O ' ' A' ' 154' ' ' LYS . 2.8 tmpt? -38.32 135.49 0.74 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.473 1.108 . . . . 0.0 109.331 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 76.63 31.69 53.17 Favored Glycine 0 CA--C 1.529 0.912 0 O-C-N 124.433 1.083 . . . . 0.0 111.029 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . 0.449 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 6.6 t70 -105.47 165.99 10.75 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.48 0.753 . . . . 0.0 109.293 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.486 ' C ' ' HG ' ' A' ' 159' ' ' LEU . 18.7 mm -121.32 147.6 25.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.51 1.131 . . . . 0.0 109.328 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . 0.525 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 0.6 OUTLIER -145.48 133.85 21.84 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.469 1.105 . . . . 0.0 109.33 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.479 ' HB3' ' HB2' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -87.62 105.08 17.1 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.575 1.172 . . . . 0.0 110.328 -179.983 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' ILE . . . . . 0.464 ' HA ' ' CB ' ' A' ' 172' ' ' ALA . 0.0 OUTLIER -83.47 129.23 37.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.567 1.167 . . . . 0.0 109.289 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . 0.43 ' HB3' ' OD1' ' A' ' 163' ' ' ASP . 4.7 ttt-85 -124.05 -22.11 4.9 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.513 1.133 . . . . 0.0 110.257 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' ASP . . . . . 0.59 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -138.26 158.3 44.56 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.489 1.118 . . . . 0.0 109.245 -179.952 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . 0.553 ' HB2' ' CG ' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -155.19 76.14 5.2 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.466 1.103 . . . . 0.0 109.303 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.03 -1.17 10.88 Favored 'Trans proline' 0 C--N 1.361 1.213 0 O-C-N 124.534 1.808 . . . . 0.0 110.999 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 166' ' ' GLU . . . . . 0.481 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.1 mt-10 -128.03 171.9 11.44 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.492 1.12 . . . . 0.0 110.301 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -100.24 14.99 29.06 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.53 1.144 . . . . 0.0 110.261 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.444 ' O ' ' N ' ' A' ' 184' ' ' VAL . 8.6 mt-30 -155.31 -45.73 0.08 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.449 1.093 . . . . 0.0 110.291 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 169' ' ' TRP . . . . . 0.432 ' O ' ' CE ' ' A' ' 181' ' ' MET . 91.1 m95 -98.32 103.17 15.09 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 170' ' ' TRP . . . . . 0.577 ' CD2' HG21 ' A' ' 184' ' ' VAL . 36.0 m0 -107.91 154.7 21.22 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.977 -1.119 . . . . 0.0 107.977 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . 0.445 ' HB3' ' OD2' ' A' ' 163' ' ' ASP . 1.2 t-20 -88.05 116.17 26.04 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.514 1.134 . . . . 0.0 109.294 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . 0.464 ' CB ' ' HA ' ' A' ' 161' ' ' ILE . . . -137.37 160.24 39.64 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.511 1.132 . . . . 0.0 109.216 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.557 ' CD ' ' CG ' ' A' ' 179' ' ' ARG . 2.6 mp0 -89.17 156.31 18.87 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.496 1.123 . . . . 0.0 110.279 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 174' ' ' ASP . . . . . 0.5 ' OD2' ' O ' ' A' ' 152' ' ' PRO . 0.4 OUTLIER -90.73 -162.07 0.87 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.478 1.111 . . . . 0.0 109.343 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 4.1 m -80.74 9.54 6.12 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.549 1.156 . . . . 0.0 109.996 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -132.04 -5.97 3.5 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.523 1.14 . . . . 0.0 110.338 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . 0.502 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 103.69 -10.4 52.88 Favored Glycine 0 CA--C 1.53 0.979 0 O-C-N 124.557 1.161 . . . . 0.0 111.011 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . 0.435 ' O ' ' CD1' ' A' ' 151' ' ' LEU . 1.2 mttt -53.89 114.19 1.49 Allowed 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.478 0.752 . . . . 0.0 109.319 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . 0.557 ' CG ' ' CD ' ' A' ' 173' ' ' GLU . 5.6 mtm105 -88.07 126.58 35.18 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.48 1.113 . . . . 0.0 110.281 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . 0.442 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -155.53 -172.42 23.09 Favored Glycine 0 CA--C 1.53 0.999 0 O-C-N 124.53 1.144 . . . . 0.0 111.043 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 181' ' ' MET . . . . . 0.432 ' CE ' ' O ' ' A' ' 169' ' ' TRP . 84.5 mmm -99.94 117.87 35.16 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.506 0.768 . . . . 0.0 111.009 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.517 ' CG2' ' HB3' ' A' ' 151' ' ' LEU . 1.1 pt -117.96 151.28 48.68 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.494 1.121 . . . . 0.0 109.337 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 183' ' ' PRO . . . . . 0.778 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -74.9 131.02 13.94 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.58 1.832 . . . . 0.0 110.987 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.84 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 4.0 t -76.76 -30.72 0.85 Allowed Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.522 1.139 . . . . 0.0 109.251 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 185' ' ' PRO . . . . . 0.84 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -75.03 -22.42 14.78 Favored 'Trans proline' 0 C--N 1.36 1.137 0 O-C-N 124.503 1.791 . . . . 0.0 111.013 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . 0.778 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 11.6 m-85 -97.67 -4.89 36.47 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.443 1.089 . . . . 0.0 111.007 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 187' ' ' VAL . . . . . 0.469 HG12 ' CB ' ' A' ' 139' ' ' ALA . 4.0 m -127.3 151.31 33.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.556 1.16 . . . . 0.0 109.343 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 188' ' ' GLU . . . . . 0.558 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 2.4 mt-10 -101.84 144.42 30.52 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.468 1.105 . . . . 0.0 110.278 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.471 0 O-C-N 124.541 1.151 . . . . 0.0 109.27 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . 0.424 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 7.5 p . . . . . 0 N--CA 1.452 -0.35 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . 0.424 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 10.5 m-85 -150.88 167.17 28.34 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.463 1.102 . . . . 0.0 111.017 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.543 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 6.2 m -142.38 133.29 24.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.522 1.139 . . . . 0.0 109.306 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.493 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 23.6 ttp85 -101.57 110.18 22.12 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.509 1.131 . . . . 0.0 110.329 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.498 ' CB ' HG12 ' A' ' 187' ' ' VAL . . . -81.46 109.27 15.77 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.465 1.103 . . . . 0.0 109.317 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.431 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 5.2 mp -89.44 23.3 2.61 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.526 1.141 . . . . 0.0 109.347 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.421 ' O ' ' HA ' ' A' ' 155' ' ' LYS . 21.1 t80 -140.95 165.32 27.85 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.457 1.098 . . . . 0.0 110.972 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.81 127.52 53.15 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.518 1.136 . . . . 0.0 109.286 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.644 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 64.2 t80 . . . . . 0 C--N 1.325 -0.464 0 O-C-N 124.479 1.112 . . . . 0.0 110.968 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.518 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 13.8 tp . . . . . 0 N--CA 1.453 -0.313 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.04 154.62 42.43 Favored 'Trans proline' 0 C--N 1.359 1.125 0 O-C-N 124.506 1.793 . . . . 0.0 111.062 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.644 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 4.8 p90 -164.69 -177.55 4.83 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.555 1.16 . . . . 0.0 111.043 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.43 138.44 51.46 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.538 1.149 . . . . 0.0 109.253 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -45.97 117.67 1.6 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.474 1.109 . . . . 0.0 109.283 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 96.48 35.42 5.45 Favored Glycine 0 CA--C 1.529 0.939 0 O-C-N 124.517 1.135 . . . . 0.0 110.985 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -113.86 173.23 6.53 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.508 0.769 . . . . 0.0 109.298 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.45 ' C ' ' HG ' ' A' ' 159' ' ' LEU . 24.1 mt -127.62 149.85 32.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.43 1.081 . . . . 0.0 109.328 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . 0.564 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 0.2 OUTLIER -143.33 139.46 30.1 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.563 1.164 . . . . 0.0 109.283 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.442 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 8.4 ttp180 -87.51 107.06 18.4 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.504 1.127 . . . . 0.0 110.324 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' ILE . . . . . 0.532 HD13 ' CB ' ' A' ' 172' ' ' ALA . 10.6 tp -84.45 128.17 39.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.445 1.091 . . . . 0.0 109.325 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.9 ttt180 -128.32 -24.29 3.12 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.506 1.129 . . . . 0.0 110.313 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' ASP . . . . . 0.413 ' O ' HD12 ' A' ' 161' ' ' ILE . 1.2 m-20 -127.07 151.93 47.96 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.515 1.134 . . . . 0.0 109.244 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . 0.549 ' HG3' ' CE2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -147.67 80.25 9.07 Favored Pre-proline 0 C--N 1.326 -0.455 0 O-C-N 124.48 1.112 . . . . 0.0 109.289 179.998 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 -45.91 0.26 Allowed 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.499 1.789 . . . . 0.0 110.99 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 166' ' ' GLU . . . . . . . . . . . . . 62.6 mm-40 -93.11 -173.2 3.19 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.484 1.115 . . . . 0.0 110.305 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -108.16 -11.39 15.27 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.471 1.107 . . . . 0.0 110.261 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -123.64 -32.52 3.33 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.533 1.146 . . . . 0.0 110.306 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -110.51 112.93 25.17 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.562 1.164 . . . . 0.0 107.977 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 170' ' ' TRP . . . . . 0.644 ' CD2' ' CG2' ' A' ' 184' ' ' VAL . 45.9 m0 -112.69 159.35 19.0 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.527 1.142 . . . . 0.0 107.992 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . 0.475 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 1.5 t30 -94.65 115.16 27.21 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.507 1.129 . . . . 0.0 109.3 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . 0.532 ' CB ' HD13 ' A' ' 161' ' ' ILE . . . -136.58 164.86 27.21 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.521 1.138 . . . . 0.0 109.292 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.564 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 6.5 mp0 -97.77 153.85 18.0 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.518 1.136 . . . . 0.0 110.295 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.97 -161.5 0.64 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.541 1.15 . . . . 0.0 109.305 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 1.5 t -81.27 11.93 3.94 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.505 1.128 . . . . 0.0 110.057 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -133.56 -4.53 2.93 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.505 1.128 . . . . 0.0 110.226 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . 0.537 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 103.63 -15.3 53.11 Favored Glycine 0 CA--C 1.531 1.07 0 O-C-N 124.504 1.128 . . . . 0.0 110.994 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 2.2 mtpt -46.74 109.04 0.16 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.595 0.82 . . . . 0.0 109.358 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -89.21 123.5 33.5 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.533 1.146 . . . . 0.0 110.281 -179.946 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . 0.492 ' HA3' ' HB2' ' A' ' 151' ' ' LEU . . . -154.57 -164.08 12.57 Favored Glycine 0 CA--C 1.53 0.982 0 O-C-N 124.5 1.125 . . . . 0.0 111.0 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -103.18 123.83 47.45 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.521 0.777 . . . . 0.0 111.002 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.571 ' N ' HD12 ' A' ' 182' ' ' ILE . 0.1 OUTLIER -122.7 152.19 61.66 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.506 1.129 . . . . 0.0 109.315 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 183' ' ' PRO . . . . . 0.742 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.01 129.82 12.69 Favored 'Trans proline' 0 C--N 1.358 1.065 0 O-C-N 124.571 1.827 . . . . 0.0 110.95 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.822 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 3.6 t -76.29 -32.24 1.07 Allowed Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.407 1.067 . . . . 0.0 109.203 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 185' ' ' PRO . . . . . 0.822 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -75.1 -24.19 12.9 Favored 'Trans proline' 0 C--N 1.359 1.095 0 O-C-N 124.519 1.8 . . . . 0.0 111.012 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . 0.742 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 9.1 m-85 -96.54 -1.41 47.16 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.53 1.144 . . . . 0.0 111.057 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 187' ' ' VAL . . . . . 0.508 HG21 ' HA ' ' A' ' 184' ' ' VAL . 9.4 m -128.57 152.36 36.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 O-C-N 124.575 1.172 . . . . 0.0 109.313 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 188' ' ' GLU . . . . . 0.543 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 2.2 tt0 -97.8 151.76 19.86 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.421 1.076 . . . . 0.0 110.404 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.514 0 O-C-N 124.552 1.157 . . . . 0.0 109.305 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . 0.437 ' O ' ' HG2' ' A' ' 160' ' ' ARG . 67.7 m . . . . . 0 N--CA 1.453 -0.318 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -156.35 167.0 31.78 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.509 1.131 . . . . 0.0 110.937 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.485 ' CG2' HG22 ' A' ' 187' ' ' VAL . 0.5 OUTLIER -148.67 167.17 3.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.511 1.132 . . . . 0.0 109.282 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.465 ' N ' ' CG2' ' A' ' 137' ' ' VAL . 0.1 OUTLIER -128.41 117.03 20.67 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.47 1.106 . . . . 0.0 110.282 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.462 ' CB ' HG11 ' A' ' 187' ' ' VAL . . . -84.78 109.78 18.32 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.443 1.089 . . . . 0.0 109.304 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.402 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 1.4 mt -89.47 26.12 1.78 Allowed 'General case' 0 C--N 1.323 -0.55 0 O-C-N 124.544 1.153 . . . . 0.0 109.284 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.503 ' CD2' ' CD2' ' A' ' 186' ' ' TYR . 41.1 m-85 -144.3 150.43 37.86 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.489 1.118 . . . . 0.0 111.007 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -94.14 127.02 39.71 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.483 1.114 . . . . 0.0 109.286 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.592 ' CB ' ' CE1' ' A' ' 153' ' ' PHE . 5.0 t80 . . . . . 0 C--N 1.326 -0.448 0 O-C-N 124.41 1.069 . . . . 0.0 110.962 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.437 ' HB2' ' HA3' ' A' ' 180' ' ' GLY . 14.8 tp . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.29 -0.634 . . . . 0.0 109.29 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.11 162.63 36.55 Favored 'Trans proline' 0 C--N 1.36 1.138 0 O-C-N 124.54 1.81 . . . . 0.0 110.98 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.592 ' CE1' ' CB ' ' A' ' 143' ' ' PHE . 8.2 p90 -175.48 178.89 1.55 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.513 1.133 . . . . 0.0 111.003 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . 0.426 ' HD3' ' N ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -123.29 143.71 49.89 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.602 1.189 . . . . 0.0 109.242 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' LYS . . . . . 0.426 ' N ' ' HD3' ' A' ' 154' ' ' LYS . 2.6 ttpt -53.72 114.23 1.48 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.44 1.088 . . . . 0.0 109.256 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 99.35 30.01 6.81 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.488 1.117 . . . . 0.0 111.035 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -107.3 174.41 5.9 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.451 0.736 . . . . 0.0 109.365 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.48 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 32.7 mt -121.32 155.95 25.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 O-C-N 124.482 1.114 . . . . 0.0 109.308 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . 0.484 HD11 ' CG2' ' A' ' 182' ' ' ILE . 3.2 mt -144.76 148.35 34.01 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.475 1.11 . . . . 0.0 109.289 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.504 ' C ' ' HB1' ' A' ' 172' ' ' ALA . 0.3 OUTLIER -99.63 107.86 20.1 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.482 1.114 . . . . 0.0 110.291 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' ILE . . . . . 0.497 HG12 ' CB ' ' A' ' 172' ' ' ALA . 1.6 mm -79.83 130.5 35.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.468 1.105 . . . . 0.0 109.292 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.6 ttt-85 -128.23 -25.5 2.97 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.494 1.121 . . . . 0.0 110.309 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -141.73 158.15 44.17 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.504 1.128 . . . . 0.0 109.285 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . 0.56 ' HB3' ' CD1' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -142.4 77.58 17.34 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.554 1.158 . . . . 0.0 109.277 179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 -2.71 12.89 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.454 1.765 . . . . 0.0 110.981 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 166' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 169' ' ' TRP . 11.9 mt-10 -144.6 -171.76 3.67 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.503 1.127 . . . . 0.0 110.359 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -113.38 -16.84 12.4 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.466 1.104 . . . . 0.0 110.275 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.408 ' CD ' ' N ' ' A' ' 168' ' ' GLN . 4.0 mp0 -116.88 -24.59 7.58 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.491 1.12 . . . . 0.0 110.247 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 169' ' ' TRP . . . . . 0.418 ' O ' ' HB2' ' A' ' 166' ' ' GLU . 85.9 m95 -125.37 105.58 9.2 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.551 1.157 . . . . 0.0 107.959 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 170' ' ' TRP . . . . . 0.579 ' CE3' HG23 ' A' ' 184' ' ' VAL . 34.4 m0 -103.19 164.36 11.68 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.503 1.127 . . . . 0.0 107.997 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . 0.413 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.8 OUTLIER -99.39 97.48 8.52 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.448 1.092 . . . . 0.0 109.26 -179.949 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . 0.504 ' HB1' ' C ' ' A' ' 160' ' ' ARG . . . -124.39 166.87 15.21 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.468 1.105 . . . . 0.0 109.302 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.528 ' CG ' ' O ' ' A' ' 177' ' ' GLY . 0.8 OUTLIER -96.07 159.17 15.1 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.468 1.105 . . . . 0.0 110.298 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 174' ' ' ASP . . . . . 0.464 ' HA ' ' CD2' ' A' ' 159' ' ' LEU . 0.4 OUTLIER -90.28 -160.39 0.69 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.464 1.102 . . . . 0.0 109.249 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 2.5 m -81.24 8.35 9.19 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.505 1.128 . . . . 0.0 109.985 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -128.08 -5.61 5.54 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.491 1.119 . . . . 0.0 110.341 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . 0.528 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 101.06 -9.47 58.02 Favored Glycine 0 CA--C 1.53 0.994 0 O-C-N 124.472 1.108 . . . . 0.0 111.023 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . 0.419 ' O ' ' HA ' ' A' ' 173' ' ' GLU . 4.7 mtmt -53.74 111.8 0.8 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.469 0.746 . . . . 0.0 109.3 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . 0.444 ' CG ' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.61 122.31 30.35 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.476 1.11 . . . . 0.0 110.238 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . 0.437 ' HA3' ' HB2' ' A' ' 151' ' ' LEU . . . -155.33 -164.98 13.63 Favored Glycine 0 CA--C 1.529 0.93 0 O-C-N 124.478 1.111 . . . . 0.0 111.023 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.1 mmt -94.55 122.87 37.58 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.488 0.758 . . . . 0.0 110.983 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.484 ' CG2' HD11 ' A' ' 159' ' ' LEU . 18.0 pt -116.29 141.96 28.65 Favored Pre-proline 0 C--N 1.326 -0.454 0 O-C-N 124.495 1.122 . . . . 0.0 109.294 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 183' ' ' PRO . . . . . 0.643 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -74.99 126.64 10.1 Favored 'Trans proline' 0 C--N 1.36 1.132 0 O-C-N 124.472 1.775 . . . . 0.0 111.044 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.819 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 90.6 t -74.08 -31.21 1.24 Allowed Pre-proline 0 C--N 1.325 -0.491 0 O-C-N 124.541 1.151 . . . . 0.0 109.276 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 185' ' ' PRO . . . . . 0.819 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -75.01 -28.17 9.38 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.493 1.786 . . . . 0.0 111.023 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . 0.643 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.9 m-85 -98.07 2.86 49.18 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.532 1.145 . . . . 0.0 110.938 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 187' ' ' VAL . . . . . 0.593 ' CG1' ' O ' ' A' ' 183' ' ' PRO . 2.4 m -136.12 162.46 36.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.548 1.155 . . . . 0.0 109.29 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 188' ' ' GLU . . . . . 0.407 ' N ' ' O ' ' A' ' 138' ' ' ARG . 0.1 OUTLIER -116.35 155.3 28.7 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.505 1.128 . . . . 0.0 110.254 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.481 0 O-C-N 124.554 1.159 . . . . 0.0 109.316 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . 0.577 ' HB3' ' CD2' ' A' ' 136' ' ' TYR . 0.5 OUTLIER . . . . . 0 N--CA 1.452 -0.333 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . 0.577 ' CD2' ' HB3' ' A' ' 135' ' ' CYS . 0.4 OUTLIER -143.82 169.52 17.63 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.549 1.156 . . . . 0.0 110.971 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.46 ' O ' ' HA ' ' A' ' 158' ' ' ILE . 33.3 m -140.3 161.83 24.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.475 1.109 . . . . 0.0 109.269 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.411 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 30.5 ttm180 -118.35 113.69 21.8 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.563 1.165 . . . . 0.0 110.247 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.539 ' O ' ' N ' ' A' ' 156' ' ' GLY . . . -82.52 112.31 19.32 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.498 1.123 . . . . 0.0 109.282 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.442 ' C ' HD23 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -87.68 21.05 2.71 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.531 1.144 . . . . 0.0 109.229 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.411 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -147.47 164.05 34.59 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.464 1.103 . . . . 0.0 110.996 179.96 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -102.78 156.79 17.4 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.542 1.151 . . . . 0.0 109.309 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.651 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 20.6 t80 . . . . . 0 C--N 1.325 -0.476 0 O-C-N 124.535 1.147 . . . . 0.0 110.969 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.508 ' CD2' ' O ' ' A' ' 172' ' ' ALA . 14.5 tp . . . . . 0 N--CA 1.453 -0.324 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.03 145.5 31.4 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.481 1.779 . . . . 0.0 110.975 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.651 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 5.9 p90 -157.5 -177.67 6.76 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.526 1.141 . . . . 0.0 110.999 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.29 140.06 43.11 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.525 1.141 . . . . 0.0 109.285 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 1.0 OUTLIER -43.61 131.13 5.25 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.493 1.12 . . . . 0.0 109.352 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.539 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 78.84 39.72 19.74 Favored Glycine 0 CA--C 1.53 0.997 0 O-C-N 124.548 1.155 . . . . 0.0 111.036 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -116.98 165.66 13.09 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.487 0.757 . . . . 0.0 109.292 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.46 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 11.2 mm -116.9 147.81 20.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.553 1.158 . . . . 0.0 109.327 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . 0.506 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 0.9 OUTLIER -141.84 138.1 31.92 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.434 1.084 . . . . 0.0 109.34 179.972 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.0 OUTLIER -87.45 102.25 14.37 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.477 1.11 . . . . 0.0 110.352 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' ILE . . . . . 0.493 ' CA ' ' HB2' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -84.86 123.28 39.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.494 1.121 . . . . 0.0 109.279 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -122.77 -22.89 5.2 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.501 1.125 . . . . 0.0 110.273 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -131.31 152.55 50.46 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.491 1.12 . . . . 0.0 109.265 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . 0.575 ' CB ' ' CG ' ' A' ' 170' ' ' TRP . 3.4 pttp -160.15 66.63 2.62 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 124.519 1.137 . . . . 0.0 109.276 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -75.05 4.26 4.92 Favored 'Trans proline' 0 C--N 1.361 1.191 0 O-C-N 124.445 1.761 . . . . 0.0 110.935 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 166' ' ' GLU . . . . . 0.474 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 9.2 mt-10 -127.65 177.92 6.47 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.567 1.167 . . . . 0.0 110.272 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . 0.505 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 7.3 pt-20 -112.61 33.53 4.9 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.459 1.099 . . . . 0.0 110.302 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.505 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 3.4 mt-30 -175.66 -37.99 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.523 1.14 . . . . 0.0 110.309 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -108.43 100.22 9.53 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.554 1.159 . . . . 0.0 107.983 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 170' ' ' TRP . . . . . 0.575 ' CG ' ' CB ' ' A' ' 164' ' ' LYS . 37.3 m0 -108.15 153.75 22.71 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.518 1.136 . . . . 0.0 108.013 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . 0.427 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 2.8 t30 -88.04 110.23 20.45 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.475 1.11 . . . . 0.0 109.27 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . 0.508 ' O ' ' CD2' ' A' ' 151' ' ' LEU . . . -130.37 159.58 36.56 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.529 1.143 . . . . 0.0 109.385 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.521 ' CG ' ' O ' ' A' ' 177' ' ' GLY . 0.8 OUTLIER -92.26 156.79 17.04 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.458 1.099 . . . . 0.0 110.292 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 174' ' ' ASP . . . . . 0.461 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.5 OUTLIER -91.08 -160.32 0.71 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.498 1.124 . . . . 0.0 109.335 179.968 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.94 8.45 8.35 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.525 1.141 . . . . 0.0 110.004 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -128.66 -5.07 5.23 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.466 1.104 . . . . 0.0 110.287 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . 0.521 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 100.16 -11.01 60.23 Favored Glycine 0 CA--C 1.53 0.999 0 O-C-N 124.449 1.093 . . . . 0.0 111.05 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . 0.41 ' O ' HD21 ' A' ' 151' ' ' LEU . 10.7 mttp -52.6 111.75 0.7 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.583 0.813 . . . . 0.0 109.293 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -87.19 124.28 33.12 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.523 1.14 . . . . 0.0 110.282 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . 0.427 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -155.13 -168.05 17.73 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.51 1.131 . . . . 0.0 110.906 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -89.19 122.13 32.17 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.441 0.73 . . . . 0.0 111.095 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.522 ' CG2' HG13 ' A' ' 187' ' ' VAL . 62.0 mt -121.29 143.07 36.56 Favored Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.476 1.11 . . . . 0.0 109.265 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 183' ' ' PRO . . . . . 0.607 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.0 Cg_endo -75.1 133.12 16.06 Favored 'Trans proline' 0 C--N 1.361 1.193 0 O-C-N 124.466 1.772 . . . . 0.0 110.928 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.828 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 42.2 t -80.09 -31.82 0.67 Allowed Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.508 1.13 . . . . 0.0 109.295 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 185' ' ' PRO . . . . . 0.828 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -75.03 -28.14 9.36 Favored 'Trans proline' 0 C--N 1.361 1.208 0 O-C-N 124.443 1.759 . . . . 0.0 110.989 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . 0.607 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 9.7 m-85 -96.9 12.29 32.83 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.418 1.074 . . . . 0.0 111.067 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 187' ' ' VAL . . . . . 0.529 HG11 ' CB ' ' A' ' 139' ' ' ALA . 1.7 m -149.55 149.97 14.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.55 1.156 . . . . 0.0 109.257 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 188' ' ' GLU . . . . . 0.455 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.6 OUTLIER -98.36 138.22 35.92 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.48 1.113 . . . . 0.0 110.318 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.324 -0.531 0 O-C-N 124.513 1.133 . . . . 0.0 109.283 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . 0.401 ' O ' ' HG2' ' A' ' 160' ' ' ARG . 26.3 p . . . . . 0 N--CA 1.453 -0.312 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . 0.491 ' CE1' ' HB2' ' A' ' 160' ' ' ARG . 5.6 m-85 -155.48 171.69 19.5 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.608 1.193 . . . . 0.0 110.995 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.532 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 3.3 m -145.27 144.4 21.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.501 1.126 . . . . 0.0 109.327 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.497 ' O ' ' CD1' ' A' ' 140' ' ' LEU . 0.4 OUTLIER -106.31 112.91 26.13 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.543 1.152 . . . . 0.0 110.332 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.454 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -83.27 105.45 14.24 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.474 1.108 . . . . 0.0 109.276 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.527 ' C ' ' HG2' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -88.3 26.98 1.31 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.513 1.133 . . . . 0.0 109.236 179.974 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.401 ' CA ' ' HG2' ' A' ' 155' ' ' LYS . 6.4 m-85 -144.58 157.2 44.32 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.511 1.132 . . . . 0.0 110.993 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -93.28 130.89 38.84 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.513 1.133 . . . . 0.0 109.282 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.613 ' HB2' ' CZ ' ' A' ' 153' ' ' PHE . 35.5 t80 . . . . . 0 C--N 1.325 -0.489 0 O-C-N 124.518 1.136 . . . . 0.0 110.981 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.596 ' CD2' ' CG2' ' A' ' 182' ' ' ILE . 12.2 tp . . . . . 0 N--CA 1.453 -0.294 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.03 150.24 37.72 Favored 'Trans proline' 0 C--N 1.361 1.191 0 O-C-N 124.503 1.791 . . . . 0.0 110.98 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.613 ' CZ ' ' HB2' ' A' ' 143' ' ' PHE . 21.1 p90 -160.45 178.45 9.55 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.51 1.131 . . . . 0.0 110.937 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . 0.415 ' O ' ' C ' ' A' ' 155' ' ' LYS . 1.1 ttpp -126.28 143.5 51.13 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.545 1.153 . . . . 0.0 109.319 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' LYS . . . . . 0.527 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.1 OUTLIER -39.27 128.21 1.77 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.429 1.08 . . . . 0.0 109.267 -180.0 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.475 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 79.6 40.8 14.27 Favored Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.578 1.174 . . . . 0.0 111.033 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . 0.5 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 5.0 t70 -111.48 162.41 15.13 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.6 0.824 . . . . 0.0 109.277 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.452 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 75.7 mt -120.39 146.69 24.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.454 1.096 . . . . 0.0 109.271 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . 0.556 ' HB3' ' O ' ' A' ' 173' ' ' GLU . 0.9 OUTLIER -141.53 141.85 33.56 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.538 1.149 . . . . 0.0 109.342 179.978 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.491 ' HB2' ' CE1' ' A' ' 136' ' ' TYR . 9.8 ttm-85 -93.48 102.14 14.35 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.553 1.158 . . . . 0.0 110.319 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' ILE . . . . . 0.54 ' HA ' ' CB ' ' A' ' 172' ' ' ALA . 0.7 OUTLIER -82.13 125.53 39.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 O-C-N 124.599 1.187 . . . . 0.0 109.278 -179.982 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -121.11 -22.25 6.17 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 124.446 1.091 . . . . 0.0 110.254 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -134.0 144.53 48.78 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.597 1.186 . . . . 0.0 109.268 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . 0.551 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -141.09 80.73 16.66 Favored Pre-proline 0 C--N 1.325 -0.483 0 O-C-N 124.503 1.127 . . . . 0.0 109.317 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.06 -50.35 0.13 Allowed 'Trans proline' 0 C--N 1.359 1.104 0 O-C-N 124.514 1.797 . . . . 0.0 110.929 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 166' ' ' GLU . . . . . 0.425 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 2.0 mt-10 -82.23 179.62 7.74 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 0.0 110.299 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -104.84 9.37 34.82 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.542 1.152 . . . . 0.0 110.284 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -146.55 -42.59 0.19 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.507 1.129 . . . . 0.0 110.279 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 169' ' ' TRP . . . . . 0.411 ' HH2' ' CZ ' ' A' ' 143' ' ' PHE . 68.2 m95 -103.61 111.39 23.85 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.487 1.117 . . . . 0.0 108.002 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 170' ' ' TRP . . . . . 0.571 ' CD2' HG23 ' A' ' 184' ' ' VAL . 50.2 m0 -113.71 164.66 13.42 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.54 1.15 . . . . 0.0 107.937 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . 0.453 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -96.75 117.06 30.22 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.457 1.098 . . . . 0.0 109.265 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . 0.54 ' CB ' ' HA ' ' A' ' 161' ' ' ILE . . . -139.59 163.45 32.53 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.586 1.179 . . . . 0.0 109.284 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.556 ' O ' ' HB3' ' A' ' 159' ' ' LEU . 2.7 mp0 -90.79 157.52 17.34 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.575 1.172 . . . . 0.0 110.31 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 174' ' ' ASP . . . . . 0.53 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 2.0 t0 -92.5 -160.67 0.76 Allowed 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.484 1.115 . . . . 0.0 109.364 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 43.1 t -81.13 6.68 13.05 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.484 1.115 . . . . 0.0 109.971 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -127.03 -3.64 6.37 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.523 1.139 . . . . 0.0 110.37 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . 0.512 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 98.88 -11.34 62.47 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.435 1.084 . . . . 0.0 111.011 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . 0.433 ' O ' HD13 ' A' ' 151' ' ' LEU . 21.4 mttt -51.91 115.79 1.85 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.521 0.777 . . . . 0.0 109.302 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . 0.497 ' HG2' ' CG ' ' A' ' 173' ' ' GLU . 0.5 OUTLIER -86.69 122.05 30.05 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.527 1.142 . . . . 0.0 110.353 179.97 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . 0.453 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.82 -166.82 15.71 Favored Glycine 0 CA--C 1.53 1.03 0 O-C-N 124.518 1.136 . . . . 0.0 110.975 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 5.3 ttm -100.4 131.84 46.11 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.533 0.784 . . . . 0.0 110.975 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.596 ' CG2' ' CD2' ' A' ' 151' ' ' LEU . 0.2 OUTLIER -126.14 145.79 53.61 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.545 1.153 . . . . 0.0 109.306 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 183' ' ' PRO . . . . . 0.768 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -74.97 123.59 8.01 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.505 1.792 . . . . 0.0 111.021 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.835 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 5.1 t -69.49 -29.87 1.95 Allowed Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.553 1.158 . . . . 0.0 109.303 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 185' ' ' PRO . . . . . 0.835 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.97 -25.23 12.11 Favored 'Trans proline' 0 C--N 1.361 1.209 0 O-C-N 124.491 1.785 . . . . 0.0 111.05 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . 0.768 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.7 m-85 -99.92 0.12 40.59 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.461 1.101 . . . . 0.0 111.013 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 187' ' ' VAL . . . . . 0.484 HG13 ' O ' ' A' ' 183' ' ' PRO . 4.1 m -130.53 152.74 37.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.511 1.132 . . . . 0.0 109.329 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 188' ' ' GLU . . . . . 0.532 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.1 OUTLIER -105.01 166.7 10.2 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.581 1.175 . . . . 0.0 110.291 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.516 0 O-C-N 124.541 1.15 . . . . 0.0 109.295 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . 0.4 ' C ' ' CD1' ' A' ' 136' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.357 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . 0.528 ' N ' ' CD1' ' A' ' 136' ' ' TYR . 0.1 OUTLIER -149.72 167.13 27.32 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.437 1.086 . . . . 0.0 110.999 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.526 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 18.6 m -142.88 150.87 17.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.52 1.138 . . . . 0.0 109.299 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.512 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 17.2 ttt-85 -105.45 117.33 33.75 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.539 1.149 . . . . 0.0 110.305 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.438 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -82.08 110.59 17.45 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.535 1.147 . . . . 0.0 109.268 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.564 HD11 ' N ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -89.09 19.13 4.4 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.532 1.145 . . . . 0.0 109.302 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.458 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 9.6 m-85 -143.62 164.39 30.53 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.511 1.132 . . . . 0.0 110.926 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.53 155.79 17.1 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.433 1.083 . . . . 0.0 109.285 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.507 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 8.0 t80 . . . . . 0 C--N 1.325 -0.467 0 O-C-N 124.578 1.174 . . . . 0.0 110.978 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.506 ' CD1' ' O ' ' A' ' 178' ' ' LYS . 13.1 tp . . . . . 0 N--CA 1.453 -0.313 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . 0.425 ' HA ' ' O ' ' A' ' 143' ' ' PHE . 18.0 Cg_endo -75.07 159.02 41.59 Favored 'Trans proline' 0 C--N 1.359 1.118 0 O-C-N 124.557 1.82 . . . . 0.0 110.98 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.507 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 0.8 OUTLIER -167.69 -170.78 1.47 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.439 1.087 . . . . 0.0 110.979 -179.921 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -129.2 139.2 51.97 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.491 1.12 . . . . 0.0 109.296 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -46.5 116.93 1.43 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.563 1.165 . . . . 0.0 109.304 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 97.2 39.9 3.88 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.573 1.171 . . . . 0.0 111.041 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -118.46 178.5 4.43 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.457 0.739 . . . . 0.0 109.316 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.464 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 10.5 mt -130.1 145.83 35.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.55 1.156 . . . . 0.0 109.338 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . 0.51 ' CD2' ' OD1' ' A' ' 174' ' ' ASP . 0.3 OUTLIER -140.21 140.81 35.93 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.513 1.133 . . . . 0.0 109.251 179.972 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.544 ' HB3' ' HB2' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.94 101.07 13.06 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.533 1.145 . . . . 0.0 110.333 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 161' ' ' ILE . . . . . 0.51 ' CA ' ' HB2' ' A' ' 172' ' ' ALA . 0.3 OUTLIER -83.03 127.6 39.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.422 1.076 . . . . 0.0 109.325 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 24.3 ptt85 -127.69 -22.91 3.51 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.443 1.089 . . . . 0.0 110.302 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 163' ' ' ASP . . . . . 0.41 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 0.9 OUTLIER -121.51 144.08 48.91 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.552 1.157 . . . . 0.0 109.279 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . 0.577 ' HD3' ' CZ3' ' A' ' 170' ' ' TRP . 57.3 mttt -148.64 69.42 10.24 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.501 1.125 . . . . 0.0 109.299 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.96 -52.06 0.11 Allowed 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.486 1.782 . . . . 0.0 111.057 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 166' ' ' GLU . . . . . 0.462 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.3 mm-40 -80.95 178.23 8.55 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.489 1.118 . . . . 0.0 110.321 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . 0.504 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 8.9 mm-40 -108.25 29.77 7.03 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.488 1.118 . . . . 0.0 110.259 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.504 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 2.1 mt-30 -167.93 -39.71 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.439 1.087 . . . . 0.0 110.311 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -105.25 106.3 16.74 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 170' ' ' TRP . . . . . 0.577 ' CZ3' ' HD3' ' A' ' 164' ' ' LYS . 51.0 m0 -112.22 162.8 15.08 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.478 1.111 . . . . 0.0 108.006 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . 0.477 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 1.1 t-20 -98.11 115.4 28.18 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.511 1.132 . . . . 0.0 109.326 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . 0.51 ' HB2' ' CA ' ' A' ' 161' ' ' ILE . . . -134.4 158.11 44.71 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.555 1.159 . . . . 0.0 109.291 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.544 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 1.3 mp0 -94.7 156.57 16.34 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.474 1.109 . . . . 0.0 110.272 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 174' ' ' ASP . . . . . 0.51 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.5 OUTLIER -90.43 -162.17 0.87 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.522 1.139 . . . . 0.0 109.317 179.992 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.81 10.0 5.57 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.533 1.145 . . . . 0.0 109.992 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -128.08 -5.73 5.54 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.595 1.184 . . . . 0.0 110.274 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . 0.512 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 99.97 -11.15 60.58 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.505 1.128 . . . . 0.0 110.997 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . 0.506 ' O ' ' CD1' ' A' ' 151' ' ' LEU . 8.5 mttt -53.23 111.79 0.76 Allowed 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.536 0.786 . . . . 0.0 109.327 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . 0.503 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.1 OUTLIER -89.75 127.36 35.94 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.479 1.112 . . . . 0.0 110.314 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . 0.477 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.61 -168.56 18.15 Favored Glycine 0 CA--C 1.529 0.953 0 O-C-N 124.44 1.088 . . . . 0.0 110.967 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -103.46 126.27 50.51 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.446 0.733 . . . . 0.0 111.02 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.506 ' CG2' ' HB3' ' A' ' 151' ' ' LEU . 2.7 pp -130.42 155.68 80.67 Favored Pre-proline 0 C--N 1.324 -0.51 0 O-C-N 124.496 1.122 . . . . 0.0 109.288 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 183' ' ' PRO . . . . . 0.805 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.0 132.68 15.69 Favored 'Trans proline' 0 C--N 1.361 1.186 0 O-C-N 124.428 1.751 . . . . 0.0 110.993 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.855 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 19.6 t -75.26 -29.63 0.89 Allowed Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 124.501 1.126 . . . . 0.0 109.346 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 185' ' ' PRO . . . . . 0.855 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.0 Cg_endo -75.05 -20.09 17.1 Favored 'Trans proline' 0 C--N 1.361 1.19 0 O-C-N 124.469 1.773 . . . . 0.0 110.94 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . 0.805 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 6.7 m-85 -97.94 2.81 49.46 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.487 1.117 . . . . 0.0 110.993 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 187' ' ' VAL . . . . . 0.512 ' HA ' ' O ' ' A' ' 138' ' ' ARG . 6.3 m -137.89 155.1 29.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.479 1.112 . . . . 0.0 109.319 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 188' ' ' GLU . . . . . 0.526 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.8 OUTLIER -105.75 144.88 31.87 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.524 1.14 . . . . 0.0 110.275 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.487 0 O-C-N 124.517 1.136 . . . . 0.0 109.286 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . 0.408 ' O ' ' HG3' ' A' ' 160' ' ' ARG . 20.1 p . . . . . 0 N--CA 1.452 -0.343 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . 0.457 ' CE1' ' HB2' ' A' ' 160' ' ' ARG . 2.1 m-85 -151.22 161.43 42.73 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.503 1.127 . . . . 0.0 110.967 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.49 ' CG1' HG21 ' A' ' 161' ' ' ILE . 31.0 m -143.85 146.33 21.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.579 1.174 . . . . 0.0 109.331 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.447 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 5.4 ttp180 -108.64 112.34 24.63 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.492 1.12 . . . . 0.0 110.308 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.441 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -80.86 109.14 15.14 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.578 1.174 . . . . 0.0 109.348 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.429 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 3.1 mp -88.49 25.02 1.79 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.474 1.109 . . . . 0.0 109.262 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.405 ' O ' ' N ' ' A' ' 155' ' ' LYS . 20.2 t80 -139.18 168.25 20.26 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.445 1.09 . . . . 0.0 111.046 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -113.59 125.63 54.38 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.488 1.118 . . . . 0.0 109.325 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.66 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 1.9 t80 . . . . . 0 C--N 1.325 -0.486 0 O-C-N 124.562 1.164 . . . . 0.0 111.027 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.486 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 31.5 tp . . . . . 0 N--CA 1.453 -0.289 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.05 143.09 28.49 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.467 1.772 . . . . 0.0 110.966 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.66 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 16.7 p90 -157.03 173.16 17.44 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.507 1.129 . . . . 0.0 111.008 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -130.68 137.27 49.48 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.522 1.139 . . . . 0.0 109.33 179.912 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' LYS . . . . . 0.429 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.8 OUTLIER -39.82 108.29 0.08 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.457 1.098 . . . . 0.0 109.298 179.959 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 103.07 33.72 4.21 Favored Glycine 0 CA--C 1.53 1.01 0 O-C-N 124.478 1.111 . . . . 0.0 111.002 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -109.55 168.81 9.12 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.448 0.734 . . . . 0.0 109.296 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.485 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 9.1 mt -126.13 147.06 30.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.525 1.141 . . . . 0.0 109.296 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . 0.428 ' CD1' HG22 ' A' ' 182' ' ' ILE . 4.2 mt -143.5 139.36 29.78 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.556 1.16 . . . . 0.0 109.326 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.469 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -88.44 105.47 17.63 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.475 1.109 . . . . 0.0 110.322 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 161' ' ' ILE . . . . . 0.49 HG21 ' CG1' ' A' ' 137' ' ' VAL . 1.1 pp -81.9 125.89 39.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.506 1.129 . . . . 0.0 109.252 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -121.67 -21.23 6.23 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.552 1.157 . . . . 0.0 110.273 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -131.84 137.69 48.18 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.528 1.142 . . . . 0.0 109.364 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . 0.48 ' CG ' HD11 ' A' ' 161' ' ' ILE . 0.0 OUTLIER -140.15 72.44 33.08 Favored Pre-proline 0 C--N 1.324 -0.511 0 O-C-N 124.496 1.123 . . . . 0.0 109.251 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.04 -49.33 0.15 Allowed 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.465 1.771 . . . . 0.0 111.045 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 166' ' ' GLU . . . . . 0.469 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 5.9 mm-40 -79.38 174.4 11.61 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.469 1.105 . . . . 0.0 110.35 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . 0.534 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 0.0 OUTLIER -105.57 32.17 4.48 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.491 1.119 . . . . 0.0 110.319 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.534 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 3.7 mt-30 -172.57 -37.47 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.444 1.09 . . . . 0.0 110.284 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 169' ' ' TRP . . . . . 0.46 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 83.1 m95 -107.38 107.52 18.46 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.451 1.094 . . . . 0.0 108.057 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 170' ' ' TRP . . . . . 0.535 ' CD2' HG21 ' A' ' 184' ' ' VAL . 51.3 m0 -113.29 158.98 19.85 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.548 1.155 . . . . 0.0 107.994 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . 0.586 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -94.76 118.43 31.74 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.469 1.106 . . . . 0.0 109.336 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . 0.482 ' CB ' HG22 ' A' ' 161' ' ' ILE . . . -132.53 166.16 22.7 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.533 1.145 . . . . 0.0 109.287 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.697 ' HG2' ' N ' ' A' ' 174' ' ' ASP . 0.0 OUTLIER -98.13 160.04 14.55 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.581 1.176 . . . . 0.0 110.302 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 174' ' ' ASP . . . . . 0.697 ' N ' ' HG2' ' A' ' 173' ' ' GLU . 38.9 p-10 -97.44 -156.26 0.53 Allowed 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.506 1.129 . . . . 0.0 109.26 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.06 13.78 7.22 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.492 1.12 . . . . 0.0 110.054 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -136.52 -0.81 2.36 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.505 1.128 . . . . 0.0 110.251 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . 0.661 ' HA2' ' HG3' ' A' ' 173' ' ' GLU . . . 99.27 -19.17 55.06 Favored Glycine 0 CA--C 1.529 0.948 0 O-C-N 124.448 1.092 . . . . 0.0 111.015 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . 0.438 ' HB2' ' CG ' ' A' ' 174' ' ' ASP . 0.1 OUTLIER -47.26 111.1 0.36 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.498 0.764 . . . . 0.0 109.313 179.986 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -93.08 126.81 38.36 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.544 1.152 . . . . 0.0 110.368 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . 0.586 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -149.48 -164.6 11.78 Favored Glycine 0 CA--C 1.531 1.089 0 O-C-N 124.514 1.134 . . . . 0.0 110.979 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 181' ' ' MET . . . . . 0.46 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 16.7 tpp -97.4 128.52 44.27 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.562 0.801 . . . . 0.0 111.001 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.494 ' C ' ' CD1' ' A' ' 182' ' ' ILE . 1.4 pp -127.51 144.54 51.3 Favored Pre-proline 0 C--N 1.325 -0.483 0 O-C-N 124.452 1.095 . . . . 0.0 109.317 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 183' ' ' PRO . . . . . 0.743 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.05 124.29 8.48 Favored 'Trans proline' 0 C--N 1.36 1.16 0 O-C-N 124.627 1.856 . . . . 0.0 110.933 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.831 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 37.5 t -71.16 -31.31 1.91 Allowed Pre-proline 0 C--N 1.324 -0.5 0 O-C-N 124.54 1.15 . . . . 0.0 109.322 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 185' ' ' PRO . . . . . 0.831 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -75.06 -23.66 13.48 Favored 'Trans proline' 0 C--N 1.36 1.133 0 O-C-N 124.475 1.776 . . . . 0.0 111.0 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . 0.743 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.9 m-85 -98.23 -2.5 39.55 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.517 1.136 . . . . 0.0 111.005 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 187' ' ' VAL . . . . . 0.475 HG23 ' CD1' ' A' ' 182' ' ' ILE . 7.2 m -127.54 153.6 36.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 O-C-N 124.482 1.114 . . . . 0.0 109.315 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 188' ' ' GLU . . . . . 0.467 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 6.0 mm-40 -101.11 160.64 14.22 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.604 1.19 . . . . 0.0 110.295 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.486 0 O-C-N 124.516 1.135 . . . . 0.0 109.296 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . 0.657 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 13.4 p . . . . . 0 N--CA 1.452 -0.346 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . 0.657 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 0.1 OUTLIER -136.4 174.75 10.27 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.422 1.077 . . . . 0.0 110.999 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.515 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 21.1 m -138.49 156.91 30.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 O-C-N 124.588 1.18 . . . . 0.0 109.297 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.526 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 13.1 ttp180 -108.35 121.71 45.48 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.476 1.11 . . . . 0.0 110.318 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.413 ' O ' ' N ' ' A' ' 156' ' ' GLY . . . -82.51 116.79 22.1 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.427 1.08 . . . . 0.0 109.315 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.52 HD11 ' N ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -93.33 25.8 3.22 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.477 1.111 . . . . 0.0 109.281 -179.973 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.4 ' HA ' ' HG2' ' A' ' 155' ' ' LYS . 11.7 t80 -150.65 163.54 38.26 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.511 1.132 . . . . 0.0 111.015 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.47 128.73 54.76 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.451 1.094 . . . . 0.0 109.332 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.578 ' HB2' ' CZ ' ' A' ' 153' ' ' PHE . 35.9 t80 . . . . . 0 C--N 1.325 -0.458 0 O-C-N 124.452 1.095 . . . . 0.0 110.947 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.479 ' CD2' ' O ' ' A' ' 172' ' ' ALA . 12.4 tp . . . . . 0 N--CA 1.453 -0.283 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . 0.412 ' O ' ' OD1' ' A' ' 174' ' ' ASP . 18.3 Cg_endo -74.96 165.17 31.91 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.497 1.788 . . . . 0.0 110.949 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.578 ' CZ ' ' HB2' ' A' ' 143' ' ' PHE . 7.7 p90 -170.52 -174.82 1.73 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.493 1.121 . . . . 0.0 110.93 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 157' ' ' ASP . 0.0 OUTLIER -133.67 147.29 51.4 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.493 1.121 . . . . 0.0 109.259 -179.937 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' LYS . . . . . 0.485 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -51.82 120.01 4.84 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.582 1.176 . . . . 0.0 109.253 179.966 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.476 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 86.08 41.07 7.23 Favored Glycine 0 CA--C 1.53 1.019 0 O-C-N 124.512 1.133 . . . . 0.0 110.979 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . 0.451 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 15.1 t70 -114.06 174.3 6.01 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.512 0.772 . . . . 0.0 109.31 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.477 ' O ' HD23 ' A' ' 159' ' ' LEU . 7.3 mm -121.82 154.85 26.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 O-C-N 124.47 1.106 . . . . 0.0 109.337 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . 0.503 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 6.2 mt -146.96 137.73 23.79 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.508 1.13 . . . . 0.0 109.302 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.532 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 5.0 ttm180 -87.06 109.02 19.13 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.56 1.162 . . . . 0.0 110.324 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 161' ' ' ILE . . . . . 0.494 ' CD1' ' HB3' ' A' ' 172' ' ' ALA . 0.5 OUTLIER -79.99 125.38 38.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.563 1.165 . . . . 0.0 109.261 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -118.86 -25.03 6.41 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.516 1.135 . . . . 0.0 110.345 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -147.59 153.68 39.72 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.421 1.076 . . . . 0.0 109.227 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . 0.561 ' HB2' ' CD2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -155.49 68.96 5.29 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.509 1.13 . . . . 0.0 109.268 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.95 -42.08 0.58 Allowed 'Trans proline' 0 C--N 1.359 1.103 0 O-C-N 124.535 1.808 . . . . 0.0 111.02 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 166' ' ' GLU . . . . . 0.491 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 10.7 mp0 -82.3 176.36 9.52 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.489 1.118 . . . . 0.0 110.321 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -114.94 48.98 1.08 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.478 1.112 . . . . 0.0 110.324 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.426 ' NE2' ' HG3' ' A' ' 185' ' ' PRO . 0.0 OUTLIER 171.96 -35.15 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.552 1.158 . . . . 0.0 110.255 -179.919 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 169' ' ' TRP . . . . . 0.514 ' CE3' ' HG2' ' A' ' 181' ' ' MET . 61.2 m95 -116.71 99.7 7.31 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.468 1.105 . . . . 0.0 108.028 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 170' ' ' TRP . . . . . 0.567 ' CD2' HG22 ' A' ' 184' ' ' VAL . 51.0 m0 -105.34 166.42 10.43 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . 0.404 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.6 OUTLIER -103.51 108.85 20.29 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.48 1.112 . . . . 0.0 109.308 179.994 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . 0.532 ' HA ' ' O ' ' A' ' 160' ' ' ARG . . . -134.82 166.24 23.42 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.488 1.118 . . . . 0.0 109.295 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.53 ' CG ' ' O ' ' A' ' 177' ' ' GLY . 0.8 OUTLIER -90.48 155.94 18.55 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.479 1.112 . . . . 0.0 110.32 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 174' ' ' ASP . . . . . 0.486 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.2 OUTLIER -88.71 -161.88 0.8 Allowed 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.478 1.111 . . . . 0.0 109.293 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 40.7 t -79.68 8.01 7.4 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.536 1.148 . . . . 0.0 110.023 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -129.37 -4.52 4.86 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.489 1.118 . . . . 0.0 110.346 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . 0.53 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 101.49 -11.64 58.14 Favored Glycine 0 CA--C 1.53 1.019 0 O-C-N 124.508 1.13 . . . . 0.0 111.014 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 4.3 mttm -52.58 113.43 1.06 Allowed 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.458 0.74 . . . . 0.0 109.28 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . 0.463 ' CG ' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.72 121.26 28.98 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.509 1.131 . . . . 0.0 110.316 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . 0.424 ' N ' HD11 ' A' ' 151' ' ' LEU . . . -155.15 -164.23 12.85 Favored Glycine 0 CA--C 1.531 1.032 0 O-C-N 124.475 1.11 . . . . 0.0 111.009 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 181' ' ' MET . . . . . 0.514 ' HG2' ' CE3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -96.45 124.32 40.4 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.535 0.785 . . . . 0.0 110.996 -179.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.474 HD12 ' CB ' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -122.09 148.7 52.43 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.56 1.162 . . . . 0.0 109.32 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 183' ' ' PRO . . . . . 0.778 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.04 129.38 12.25 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.503 1.791 . . . . 0.0 110.979 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.829 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 79.9 t -75.43 -31.91 1.14 Allowed Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.477 1.11 . . . . 0.0 109.243 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 185' ' ' PRO . . . . . 0.829 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.2 Cg_endo -75.06 -24.77 12.41 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.508 1.794 . . . . 0.0 110.964 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . 0.778 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 5.4 m-85 -98.52 1.67 46.81 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.55 1.156 . . . . 0.0 110.992 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 187' ' ' VAL . . . . . 0.536 ' CG1' ' O ' ' A' ' 183' ' ' PRO . 2.5 m -135.06 145.82 31.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.438 1.086 . . . . 0.0 109.32 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 188' ' ' GLU . . . . . 0.515 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.5 OUTLIER -104.1 140.63 37.52 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.481 1.113 . . . . 0.0 110.256 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 189' ' ' LYS . . . . . 0.463 ' HA ' ' CG1' ' A' ' 137' ' ' VAL . 1.3 tmtm? . . . . . 0 C--N 1.326 -0.443 0 O-C-N 124.505 1.128 . . . . 0.0 109.308 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . 0.416 ' O ' ' HG3' ' A' ' 160' ' ' ARG . 99.3 m . . . . . 0 N--CA 1.453 -0.316 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . 0.494 ' CE1' ' HD2' ' A' ' 160' ' ' ARG . 6.2 m-85 -152.9 167.55 28.73 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.509 1.131 . . . . 0.0 111.021 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.551 ' CG2' ' HB2' ' A' ' 159' ' ' LEU . 16.6 m -142.93 137.26 26.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 O-C-N 124.496 1.122 . . . . 0.0 109.348 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.645 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 9.5 ttm180 -100.78 106.78 18.22 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.523 1.139 . . . . 0.0 110.269 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.473 ' HA ' ' CG1' ' A' ' 187' ' ' VAL . . . -80.36 104.47 10.93 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.486 1.116 . . . . 0.0 109.324 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.522 ' C ' ' HG2' ' A' ' 155' ' ' LYS . 6.5 mp -90.02 28.86 1.3 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.487 1.117 . . . . 0.0 109.36 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.475 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 34.0 m-85 -144.22 145.21 31.92 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.436 1.085 . . . . 0.0 111.011 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.09 131.62 35.86 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.452 1.095 . . . . 0.0 109.322 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.486 ' O ' ' CB ' ' A' ' 152' ' ' PRO . 2.5 t80 . . . . . 0 C--N 1.326 -0.456 0 O-C-N 124.521 1.138 . . . . 0.0 111.005 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.518 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 8.0 tp . . . . . 0 N--CA 1.453 -0.301 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . 0.486 ' CB ' ' O ' ' A' ' 143' ' ' PHE . 18.0 Cg_endo -75.06 169.23 23.05 Favored 'Trans proline' 0 C--N 1.36 1.146 0 O-C-N 124.507 1.793 . . . . 0.0 110.915 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.475 ' CE1' ' O ' ' A' ' 141' ' ' PHE . 0.8 OUTLIER -172.87 -170.82 0.7 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.488 1.118 . . . . 0.0 110.949 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . 0.463 ' O ' ' HG3' ' A' ' 154' ' ' LYS . 0.0 OUTLIER -125.78 140.07 52.99 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.454 1.096 . . . . 0.0 109.296 179.972 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' LYS . . . . . 0.522 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 1.3 tmmm? -45.85 117.02 1.35 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.507 1.129 . . . . 0.0 109.287 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.454 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 93.33 29.72 9.94 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.523 1.139 . . . . 0.0 110.99 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -100.55 169.36 9.12 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.519 0.776 . . . . 0.0 109.311 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.465 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 9.1 mt -122.24 147.06 26.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.556 1.16 . . . . 0.0 109.31 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . 0.643 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 0.2 OUTLIER -141.02 136.89 32.54 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.547 1.154 . . . . 0.0 109.316 179.978 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.494 ' HD2' ' CE1' ' A' ' 136' ' ' TYR . 0.2 OUTLIER -88.12 111.02 21.12 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.601 1.188 . . . . 0.0 110.309 179.96 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 161' ' ' ILE . . . . . 0.485 ' CD1' ' HB3' ' A' ' 172' ' ' ALA . 0.5 OUTLIER -80.48 125.21 39.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.551 1.157 . . . . 0.0 109.36 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -116.74 -26.51 6.95 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.532 1.145 . . . . 0.0 110.3 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 163' ' ' ASP . . . . . 0.465 ' OD2' ' CB ' ' A' ' 171' ' ' ASN . 0.0 OUTLIER -149.11 157.3 43.27 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.461 1.101 . . . . 0.0 109.353 -179.978 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . 0.541 ' HG3' ' CE2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -145.88 92.15 5.46 Favored Pre-proline 0 C--N 1.325 -0.46 0 O-C-N 124.464 1.102 . . . . 0.0 109.278 179.994 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.03 -49.71 0.14 Allowed 'Trans proline' 0 C--N 1.361 1.201 0 O-C-N 124.478 1.778 . . . . 0.0 111.061 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 166' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' A' ' 169' ' ' TRP . 12.5 mt-10 -88.92 -177.53 5.5 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.596 1.185 . . . . 0.0 110.306 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -106.52 -9.78 16.49 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.507 1.13 . . . . 0.0 110.315 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -120.29 -27.66 5.19 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.539 1.15 . . . . 0.0 110.29 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 169' ' ' TRP . . . . . 0.473 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 59.7 m95 -121.65 117.75 27.46 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.543 1.152 . . . . 0.0 107.95 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 170' ' ' TRP . . . . . 0.554 ' CD2' HG22 ' A' ' 184' ' ' VAL . 33.9 m0 -114.2 165.08 13.04 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.519 1.137 . . . . 0.0 107.947 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . 0.465 ' CB ' ' OD2' ' A' ' 163' ' ' ASP . 0.4 OUTLIER -100.37 115.2 29.45 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.493 1.121 . . . . 0.0 109.295 -179.98 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . 0.485 ' HB3' ' CD1' ' A' ' 161' ' ' ILE . . . -136.79 168.44 19.53 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.521 1.138 . . . . 0.0 109.238 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.643 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.8 OUTLIER -97.38 154.57 17.37 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.483 1.114 . . . . 0.0 110.305 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 174' ' ' ASP . . . . . 0.546 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.1 OUTLIER -88.29 -163.97 1.05 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.551 1.157 . . . . 0.0 109.325 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 23.2 t -77.9 9.46 3.56 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.482 1.114 . . . . 0.0 109.982 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -128.66 -5.66 5.19 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.495 1.122 . . . . 0.0 110.276 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . 0.539 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 99.9 -11.31 60.7 Favored Glycine 0 CA--C 1.53 1.028 0 O-C-N 124.445 1.091 . . . . 0.0 110.94 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . 0.446 ' O ' HD22 ' A' ' 151' ' ' LEU . 0.8 OUTLIER -53.39 112.47 0.9 Allowed 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.505 0.768 . . . . 0.0 109.306 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . 0.451 ' CG ' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.59 124.61 33.07 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.499 1.124 . . . . 0.0 110.322 -179.988 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . 0.434 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -155.73 -165.44 14.39 Favored Glycine 0 CA--C 1.53 0.971 0 O-C-N 124.473 1.108 . . . . 0.0 111.019 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 181' ' ' MET . . . . . 0.473 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -99.64 131.29 45.73 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.479 0.753 . . . . 0.0 111.003 179.99 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.518 ' CG2' ' HB3' ' A' ' 151' ' ' LEU . 2.2 pp -132.62 148.88 71.35 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.466 1.104 . . . . 0.0 109.312 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 183' ' ' PRO . . . . . 0.741 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.0 129.71 12.59 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.488 1.783 . . . . 0.0 111.045 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.834 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 54.6 t -74.5 -31.53 1.23 Allowed Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.49 1.119 . . . . 0.0 109.319 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 185' ' ' PRO . . . . . 0.834 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.93 -17.43 19.75 Favored 'Trans proline' 0 C--N 1.36 1.172 0 O-C-N 124.509 1.794 . . . . 0.0 111.06 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . 0.741 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 5.2 m-85 -98.33 -12.61 21.33 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.46 1.1 . . . . 0.0 111.019 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 187' ' ' VAL . . . . . 0.645 ' HA ' ' O ' ' A' ' 138' ' ' ARG . 2.3 m -126.97 157.01 38.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.503 1.127 . . . . 0.0 109.385 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 188' ' ' GLU . . . . . 0.435 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 3.4 pt-20 -98.13 161.8 13.53 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.44 1.087 . . . . 0.0 110.297 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.471 0 O-C-N 124.51 1.131 . . . . 0.0 109.249 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 85.6 m . . . . . 0 N--CA 1.453 -0.317 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -129.81 177.31 7.35 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.509 1.131 . . . . 0.0 110.963 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.485 ' CG2' HG22 ' A' ' 187' ' ' VAL . 1.4 m -149.79 166.77 2.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.402 1.064 . . . . 0.0 109.284 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.418 ' HA ' ' O ' ' A' ' 157' ' ' ASP . 2.3 ttt-85 -128.15 116.27 19.68 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.463 1.102 . . . . 0.0 110.235 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.534 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -83.87 107.25 16.15 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.528 1.142 . . . . 0.0 109.283 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.515 ' C ' ' HG2' ' A' ' 155' ' ' LYS . 1.1 mp -88.54 26.52 1.45 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.59 1.181 . . . . 0.0 109.356 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.568 ' CD1' ' HA ' ' A' ' 186' ' ' TYR . 84.2 m-85 -153.4 146.61 24.7 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.444 1.09 . . . . 0.0 110.993 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.89 153.79 34.38 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.54 1.15 . . . . 0.0 109.304 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.639 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.512 0 O-C-N 124.527 1.142 . . . . 0.0 111.044 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.522 ' O ' ' CE2' ' A' ' 153' ' ' PHE . 15.5 tp . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.0 167.26 27.45 Favored 'Trans proline' 0 C--N 1.361 1.189 0 O-C-N 124.529 1.805 . . . . 0.0 111.056 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.639 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 4.7 p90 -178.05 -178.77 0.69 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.525 1.14 . . . . 0.0 110.983 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.47 142.44 47.15 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.492 1.12 . . . . 0.0 109.302 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' LYS . . . . . 0.515 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -46.0 119.34 2.22 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.504 1.127 . . . . 0.0 109.288 179.962 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.455 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 88.57 40.74 6.27 Favored Glycine 0 CA--C 1.53 0.999 0 O-C-N 124.541 1.151 . . . . 0.0 111.027 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . 0.418 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 37.0 t70 -111.14 167.8 9.99 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.481 0.754 . . . . 0.0 109.297 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.459 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 2.3 mp -116.68 149.93 18.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.505 1.128 . . . . 0.0 109.303 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . 0.581 ' HB3' ' O ' ' A' ' 173' ' ' GLU . 1.0 OUTLIER -141.74 146.01 35.5 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.494 1.121 . . . . 0.0 109.276 179.943 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.45 ' C ' ' HB3' ' A' ' 172' ' ' ALA . 0.9 OUTLIER -93.68 101.77 13.92 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.478 1.111 . . . . 0.0 110.3 179.968 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 161' ' ' ILE . . . . . 0.503 HD11 ' HB3' ' A' ' 170' ' ' TRP . 9.4 tp -79.23 128.47 38.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.488 1.118 . . . . 0.0 109.343 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.21 -26.18 3.69 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.525 1.14 . . . . 0.0 110.254 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 163' ' ' ASP . . . . . 0.405 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 45.9 m-20 -137.39 140.91 41.67 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.485 1.116 . . . . 0.0 109.295 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . 0.59 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -146.79 69.34 12.11 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.542 1.151 . . . . 0.0 109.378 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . 0.404 ' HG2' ' OE1' ' A' ' 166' ' ' GLU . 18.4 Cg_endo -75.0 -44.08 0.36 Allowed 'Trans proline' 0 C--N 1.359 1.104 0 O-C-N 124.499 1.789 . . . . 0.0 111.037 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 166' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 169' ' ' TRP . 6.6 mp0 -81.03 171.02 15.49 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.503 1.127 . . . . 0.0 110.315 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . 0.425 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 12.5 pm0 -112.41 52.39 0.77 Allowed 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.459 1.099 . . . . 0.0 110.261 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.425 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 0.1 OUTLIER 169.75 -31.68 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.517 1.136 . . . . 0.0 110.316 179.937 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 169' ' ' TRP . . . . . 0.451 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 73.3 m95 -125.52 101.4 6.91 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.562 1.164 . . . . 0.0 107.967 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 170' ' ' TRP . . . . . 0.59 ' CG ' ' HB3' ' A' ' 164' ' ' LYS . 10.2 m0 -106.86 174.71 5.77 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.534 1.146 . . . . 0.0 107.982 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . 0.409 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -109.06 113.48 26.39 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 124.522 1.139 . . . . 0.0 109.282 -179.998 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . 0.498 ' O ' ' CD2' ' A' ' 151' ' ' LEU . . . -136.55 164.01 29.19 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.534 1.146 . . . . 0.0 109.373 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.581 ' O ' ' HB3' ' A' ' 159' ' ' LEU . 7.5 mp0 -89.32 153.38 20.92 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.466 1.104 . . . . 0.0 110.345 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 174' ' ' ASP . . . . . 0.419 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.5 OUTLIER -88.1 -159.74 0.57 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.521 1.138 . . . . 0.0 109.353 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 94.4 p -81.71 9.85 7.12 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.472 1.108 . . . . 0.0 109.995 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -131.11 -5.34 3.89 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.511 1.132 . . . . 0.0 110.239 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . 0.512 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 100.96 -11.16 58.87 Favored Glycine 0 CA--C 1.532 1.094 0 O-C-N 124.547 1.154 . . . . 0.0 110.966 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 3.3 mttp -54.5 114.69 1.77 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.511 0.771 . . . . 0.0 109.234 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . 0.54 ' CG ' ' CD ' ' A' ' 173' ' ' GLU . 1.1 mtm180 -86.45 123.86 32.14 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.464 1.102 . . . . 0.0 110.279 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . 0.409 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.91 -169.16 19.2 Favored Glycine 0 CA--C 1.531 1.035 0 O-C-N 124.475 1.109 . . . . 0.0 111.022 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 181' ' ' MET . . . . . 0.451 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.1 OUTLIER -88.24 119.12 28.34 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.519 0.776 . . . . 0.0 111.044 179.971 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.476 HG12 ' CB ' ' A' ' 172' ' ' ALA . 1.6 pp -108.86 133.74 20.58 Favored Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.515 1.135 . . . . 0.0 109.318 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 183' ' ' PRO . . . . . 0.702 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.05 126.37 9.9 Favored 'Trans proline' 0 C--N 1.359 1.114 0 O-C-N 124.45 1.763 . . . . 0.0 110.952 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.838 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 60.5 t -71.71 -29.76 1.39 Allowed Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 124.445 1.09 . . . . 0.0 109.238 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 185' ' ' PRO . . . . . 0.838 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -74.99 -29.43 8.25 Favored 'Trans proline' 0 C--N 1.359 1.13 0 O-C-N 124.461 1.769 . . . . 0.0 110.994 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . 0.702 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 5.5 m-85 -100.33 -0.67 37.92 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.531 1.144 . . . . 0.0 110.966 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 187' ' ' VAL . . . . . 0.569 ' CG1' ' O ' ' A' ' 183' ' ' PRO . 1.4 m -137.11 160.73 36.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.51 1.131 . . . . 0.0 109.327 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 188' ' ' GLU . . . . . 0.465 ' O ' ' HB ' ' A' ' 137' ' ' VAL . 6.9 tp10 -116.76 149.94 39.1 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.538 1.148 . . . . 0.0 110.25 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.477 0 O-C-N 124.463 1.102 . . . . 0.0 109.284 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . 0.677 ' O ' ' CD1' ' A' ' 136' ' ' TYR . 3.6 p . . . . . 0 N--CA 1.453 -0.322 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . 0.677 ' CD1' ' O ' ' A' ' 135' ' ' CYS . 8.8 m-85 -149.38 179.98 7.52 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.419 1.074 . . . . 0.0 111.045 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.466 ' N ' ' O ' ' A' ' 159' ' ' LEU . 24.0 m -144.06 143.87 23.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 124.427 1.079 . . . . 0.0 109.307 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.564 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 28.0 ttm-85 -104.26 111.46 24.08 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.476 1.11 . . . . 0.0 110.306 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.413 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -79.63 107.25 12.25 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.526 1.142 . . . . 0.0 109.336 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.461 ' O ' ' HE2' ' A' ' 155' ' ' LYS . 7.4 mp -89.89 29.53 1.18 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.521 1.138 . . . . 0.0 109.278 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.606 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 42.7 m-85 -148.28 151.7 35.87 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.446 1.092 . . . . 0.0 111.011 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -93.82 133.17 37.5 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.558 1.161 . . . . 0.0 109.273 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.621 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 12.0 t80 . . . . . 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 0.0 111.027 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.455 HD23 ' CD1' ' A' ' 182' ' ' ILE . 10.5 tp . . . . . 0 N--CA 1.453 -0.286 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . 0.465 ' HA ' ' O ' ' A' ' 143' ' ' PHE . 18.4 Cg_endo -75.01 166.07 29.96 Favored 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.398 1.736 . . . . 0.0 111.018 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.621 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 3.5 p90 -166.18 -177.18 4.01 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.525 1.14 . . . . 0.0 111.015 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . 0.578 ' O ' ' C ' ' A' ' 155' ' ' LYS . 2.0 ttmt -133.82 129.79 37.02 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.476 1.11 . . . . 0.0 109.301 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' LYS . . . . . 0.578 ' C ' ' O ' ' A' ' 154' ' ' LYS . 12.5 ttmt -25.33 123.37 0.06 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.579 1.174 . . . . 0.0 109.373 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 74.36 49.94 10.96 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 124.49 1.119 . . . . 0.0 110.988 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . 0.426 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 28.8 t0 -113.41 165.2 12.69 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.516 0.774 . . . . 0.0 109.355 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.527 ' C ' ' HG ' ' A' ' 159' ' ' LEU . 1.3 mp -118.36 148.63 21.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.47 1.106 . . . . 0.0 109.298 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . 0.527 ' HG ' ' C ' ' A' ' 158' ' ' ILE . 1.3 mt -147.14 138.78 24.17 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.527 1.142 . . . . 0.0 109.307 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.529 ' HB3' ' HB2' ' A' ' 173' ' ' GLU . 0.8 OUTLIER -87.63 106.2 17.86 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.572 1.17 . . . . 0.0 110.272 -179.95 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 161' ' ' ILE . . . . . 0.486 ' CD1' ' HB2' ' A' ' 172' ' ' ALA . 2.2 mm -82.98 125.98 40.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.486 1.116 . . . . 0.0 109.268 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 10.5 ttt180 -127.62 -26.21 3.02 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.524 1.14 . . . . 0.0 110.277 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 163' ' ' ASP . . . . . 0.491 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -126.65 140.52 52.35 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.55 1.156 . . . . 0.0 109.344 179.981 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . 0.5 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 1.7 mtmt -146.32 63.4 8.82 Favored Pre-proline 0 C--N 1.324 -0.502 0 O-C-N 124.487 1.117 . . . . 0.0 109.312 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . 0.43 ' HD3' ' N ' ' A' ' 164' ' ' LYS . 18.5 Cg_endo -74.98 6.96 3.07 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.491 1.785 . . . . 0.0 110.995 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 166' ' ' GLU . . . . . 0.467 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 5.5 mm-40 -135.66 176.04 9.04 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.557 1.16 . . . . 0.0 110.282 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . 0.539 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 4.2 mm-40 -113.73 35.79 3.92 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.539 1.149 . . . . 0.0 110.244 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.539 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 0.4 OUTLIER -174.93 -37.84 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.48 1.112 . . . . 0.0 110.361 179.974 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 169' ' ' TRP . . . . . 0.448 ' O ' ' HB2' ' A' ' 166' ' ' GLU . 76.6 m95 -113.56 104.77 12.59 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 170' ' ' TRP . . . . . 0.523 ' CD2' HG22 ' A' ' 184' ' ' VAL . 38.7 m0 -111.2 159.91 17.45 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . 0.497 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -96.91 114.3 25.91 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.43 1.081 . . . . 0.0 109.296 179.969 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . 0.564 ' HB3' ' CD1' ' A' ' 182' ' ' ILE . . . -128.64 167.69 16.83 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.506 1.128 . . . . 0.0 109.29 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.529 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 2.0 mp0 -97.48 157.28 16.09 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.48 1.112 . . . . 0.0 110.38 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 174' ' ' ASP . . . . . 0.453 ' OD1' ' N ' ' A' ' 177' ' ' GLY . 46.2 p-10 -95.14 -159.92 0.75 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.478 1.111 . . . . 0.0 109.291 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 44.6 t -81.32 12.29 3.71 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.562 1.163 . . . . 0.0 109.97 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -132.31 -3.72 3.44 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.443 1.09 . . . . 0.0 110.346 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . 0.518 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 97.29 -12.25 65.17 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.494 1.122 . . . . 0.0 111.003 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . 0.45 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 0.1 OUTLIER -54.78 115.17 2.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.492 0.76 . . . . 0.0 109.306 -179.965 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . 0.435 ' HG2' ' CD ' ' A' ' 173' ' ' GLU . 0.3 OUTLIER -88.72 127.78 35.6 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.487 1.117 . . . . 0.0 110.286 -179.973 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . 0.497 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -153.48 -171.77 21.0 Favored Glycine 0 CA--C 1.529 0.946 0 O-C-N 124.441 1.088 . . . . 0.0 111.019 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.4 135.34 33.53 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.492 0.76 . . . . 0.0 111.039 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.564 ' CD1' ' HB3' ' A' ' 172' ' ' ALA . 30.4 mt -134.09 137.67 28.77 Favored Pre-proline 0 C--N 1.325 -0.466 0 O-C-N 124.422 1.076 . . . . 0.0 109.315 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 183' ' ' PRO . . . . . 0.729 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.1 Cg_endo -75.03 121.87 6.84 Favored 'Trans proline' 0 C--N 1.36 1.152 0 O-C-N 124.508 1.794 . . . . 0.0 111.027 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.84 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 24.6 t -69.5 -29.32 1.75 Allowed Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.536 1.147 . . . . 0.0 109.26 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 185' ' ' PRO . . . . . 0.84 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.98 -23.68 13.6 Favored 'Trans proline' 0 C--N 1.359 1.09 0 O-C-N 124.538 1.81 . . . . 0.0 111.012 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . 0.729 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.6 m-85 -99.42 -3.12 34.46 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.521 1.138 . . . . 0.0 111.0 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 187' ' ' VAL . . . . . 0.564 ' HA ' ' O ' ' A' ' 138' ' ' ARG . 5.2 m -130.34 162.41 38.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.542 1.151 . . . . 0.0 109.265 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 188' ' ' GLU . . . . . 0.443 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 1.0 OUTLIER -110.67 158.2 18.87 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.583 1.177 . . . . 0.0 110.286 179.993 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.512 0 O-C-N 124.505 1.128 . . . . 0.0 109.274 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . 0.43 ' O ' ' CD1' ' A' ' 136' ' ' TYR . 8.9 t . . . . . 0 N--CA 1.453 -0.296 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . 0.43 ' CD1' ' O ' ' A' ' 135' ' ' CYS . 36.3 m-85 -150.99 164.0 37.41 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.405 1.066 . . . . 0.0 111.062 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.505 ' O ' ' HA ' ' A' ' 158' ' ' ILE . 15.4 m -138.61 165.72 24.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.573 1.171 . . . . 0.0 109.332 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.481 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 16.1 ttp180 -124.04 112.93 17.74 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.475 1.109 . . . . 0.0 110.321 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.554 ' O ' ' N ' ' A' ' 156' ' ' GLY . . . -83.36 103.93 13.12 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.498 1.123 . . . . 0.0 109.305 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.408 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 0.7 OUTLIER -88.87 27.82 1.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.449 1.093 . . . . 0.0 109.41 179.93 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.423 ' CD1' ' HA ' ' A' ' 186' ' ' TYR . 58.1 m-85 -147.86 151.3 35.69 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.497 1.123 . . . . 0.0 110.98 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -88.9 126.21 35.28 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.536 1.148 . . . . 0.0 109.317 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.626 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 3.0 t80 . . . . . 0 C--N 1.324 -0.51 0 O-C-N 124.445 1.09 . . . . 0.0 111.007 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.5 HD21 ' CG2' ' A' ' 182' ' ' ILE . 15.8 tp . . . . . 0 N--CA 1.452 -0.342 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.03 162.34 37.22 Favored 'Trans proline' 0 C--N 1.36 1.168 0 O-C-N 124.465 1.771 . . . . 0.0 110.984 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.626 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 17.9 p90 -178.69 177.32 0.89 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.478 1.111 . . . . 0.0 111.01 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.57 140.7 49.48 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.512 1.132 . . . . 0.0 109.311 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.1 OUTLIER -45.28 131.01 8.18 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.527 1.142 . . . . 0.0 109.313 179.887 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 85.85 22.71 48.63 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 124.441 1.088 . . . . 0.0 111.002 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -99.07 167.9 10.42 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.504 0.767 . . . . 0.0 109.269 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.529 HG21 ' N ' ' A' ' 159' ' ' LEU . 51.5 mm -120.72 146.89 24.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.567 1.167 . . . . 0.0 109.306 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . 0.529 ' N ' HG21 ' A' ' 158' ' ' ILE . 0.9 OUTLIER -136.92 138.45 40.66 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.432 1.082 . . . . 0.0 109.347 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.48 ' C ' ' HB3' ' A' ' 172' ' ' ALA . 5.0 mtm180 -87.67 96.41 10.42 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.513 1.133 . . . . 0.0 110.311 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 161' ' ' ILE . . . . . 0.578 ' HA ' ' CB ' ' A' ' 172' ' ' ALA . 0.0 OUTLIER -84.44 125.85 40.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.431 1.082 . . . . 0.0 109.296 -179.951 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . 0.453 ' CG ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -119.04 -21.76 7.54 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.58 1.175 . . . . 0.0 110.322 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 163' ' ' ASP . . . . . 0.634 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -136.6 149.87 48.26 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.472 1.107 . . . . 0.0 109.307 -179.993 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . 0.538 ' CB ' ' CG ' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -155.48 74.17 5.35 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.488 1.118 . . . . 0.0 109.312 179.981 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 -38.34 1.64 Allowed 'Trans proline' 0 C--N 1.359 1.108 0 O-C-N 124.51 1.795 . . . . 0.0 111.086 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 166' ' ' GLU . . . . . 0.446 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.5 mm-40 -85.69 171.49 11.59 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.545 1.153 . . . . 0.0 110.271 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -110.49 50.42 0.81 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.589 1.181 . . . . 0.0 110.336 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 170.66 -32.19 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.435 1.085 . . . . 0.0 110.259 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -120.65 100.54 7.18 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.514 1.133 . . . . 0.0 107.974 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 170' ' ' TRP . . . . . 0.538 ' CG ' ' CB ' ' A' ' 164' ' ' LYS . 40.8 m0 -105.8 164.26 12.07 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.492 1.12 . . . . 0.0 107.991 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . 0.448 ' HB3' ' OD1' ' A' ' 163' ' ' ASP . 1.6 m-20 -98.91 114.08 26.52 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.441 1.088 . . . . 0.0 109.343 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . 0.578 ' CB ' ' HA ' ' A' ' 161' ' ' ILE . . . -139.0 166.31 24.83 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.466 1.103 . . . . 0.0 109.288 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.509 ' CG ' ' O ' ' A' ' 177' ' ' GLY . 2.1 mp0 -95.8 157.45 15.89 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.493 1.121 . . . . 0.0 110.369 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 174' ' ' ASP . . . . . 0.517 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.1 OUTLIER -89.84 -163.46 1.01 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.515 1.135 . . . . 0.0 109.32 -179.993 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 60.8 p -80.31 9.65 5.53 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.489 1.118 . . . . 0.0 110.024 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -131.08 -4.92 3.91 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.522 1.139 . . . . 0.0 110.31 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . 0.509 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 103.14 -11.45 55.39 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 124.53 1.144 . . . . 0.0 111.008 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 2.6 mttt -52.51 111.7 0.69 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.483 0.755 . . . . 0.0 109.286 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . 0.408 ' HG2' ' HG3' ' A' ' 173' ' ' GLU . 0.1 OUTLIER -88.79 123.51 33.26 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.451 1.094 . . . . 0.0 110.291 -179.981 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . 0.437 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -155.57 -161.8 10.88 Favored Glycine 0 CA--C 1.531 1.034 0 O-C-N 124.535 1.147 . . . . 0.0 110.991 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.9 mmt -93.73 116.11 28.58 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.506 0.768 . . . . 0.0 110.956 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.5 ' CG2' HD21 ' A' ' 151' ' ' LEU . 2.2 pp -103.48 132.28 21.24 Favored Pre-proline 0 C--N 1.324 -0.518 0 O-C-N 124.551 1.157 . . . . 0.0 109.259 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 183' ' ' PRO . . . . . 0.618 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.6 Cg_endo -74.99 123.39 7.85 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.521 1.801 . . . . 0.0 111.025 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.838 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 69.7 t -71.36 -30.57 1.65 Allowed Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.464 1.102 . . . . 0.0 109.261 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 185' ' ' PRO . . . . . 0.838 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.99 -28.22 9.36 Favored 'Trans proline' 0 C--N 1.36 1.143 0 O-C-N 124.547 1.814 . . . . 0.0 110.988 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . 0.618 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.8 m-85 -99.47 -5.07 30.01 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.47 1.106 . . . . 0.0 110.921 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 187' ' ' VAL . . . . . 0.545 ' CG1' ' O ' ' A' ' 183' ' ' PRO . 1.5 m -132.13 162.96 38.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.492 1.12 . . . . 0.0 109.269 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 188' ' ' GLU . . . . . 0.426 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 3.8 tt0 -111.82 147.97 34.59 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.5 1.125 . . . . 0.0 110.32 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 3.4 ptpp? . . . . . 0 C--N 1.324 -0.52 0 O-C-N 124.533 1.145 . . . . 0.0 109.284 -179.951 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . 0.637 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 20.4 p . . . . . 0 N--CA 1.452 -0.364 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . 0.637 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 27.1 m-85 -149.8 157.32 43.09 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.561 1.163 . . . . 0.0 111.0 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.553 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 21.9 m -136.65 137.59 47.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.568 1.168 . . . . 0.0 109.234 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.547 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 7.1 ttt180 -101.51 111.01 23.12 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.444 1.09 . . . . 0.0 110.285 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.44 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -80.55 110.77 16.34 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.453 1.096 . . . . 0.0 109.349 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.474 ' O ' ' CE ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -88.23 19.01 3.94 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.526 1.141 . . . . 0.0 109.296 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -141.7 172.2 13.01 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.541 1.15 . . . . 0.0 110.979 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -109.93 156.08 20.9 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.492 1.12 . . . . 0.0 109.283 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.585 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 65.3 t80 . . . . . 0 C--N 1.326 -0.45 0 O-C-N 124.572 1.17 . . . . 0.0 110.985 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.435 HD11 ' N ' ' A' ' 180' ' ' GLY . 24.8 tp . . . . . 0 N--CA 1.452 -0.335 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . 0.406 ' O ' ' OD1' ' A' ' 174' ' ' ASP . 18.3 Cg_endo -75.02 157.84 42.47 Favored 'Trans proline' 0 C--N 1.359 1.122 0 O-C-N 124.527 1.804 . . . . 0.0 110.952 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.594 ' CE2' HD12 ' A' ' 182' ' ' ILE . 25.8 p90 -166.43 -175.53 3.26 Favored 'General case' 0 C--N 1.327 -0.412 0 O-C-N 124.449 1.093 . . . . 0.0 110.95 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . 0.52 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -138.55 132.3 30.91 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.574 1.171 . . . . 0.0 109.326 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' LYS . . . . . 0.52 ' C ' ' O ' ' A' ' 154' ' ' LYS . 5.8 ttmt -31.15 130.76 0.11 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.526 1.141 . . . . 0.0 109.252 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 72.85 42.24 46.43 Favored Glycine 0 CA--C 1.53 1.005 0 O-C-N 124.496 1.123 . . . . 0.0 111.033 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . 0.412 ' HB2' ' O ' ' A' ' 154' ' ' LYS . 15.5 t70 -111.21 167.49 10.24 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.502 0.766 . . . . 0.0 109.305 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.433 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 1.8 mp -122.81 146.16 28.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 O-C-N 124.499 1.124 . . . . 0.0 109.23 -179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . 0.599 ' CD1' ' CD1' ' A' ' 182' ' ' ILE . 0.6 OUTLIER -142.07 138.69 31.92 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.481 1.113 . . . . 0.0 109.323 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.433 ' O ' ' N ' ' A' ' 173' ' ' GLU . 0.3 OUTLIER -91.49 105.07 17.49 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.522 1.139 . . . . 0.0 110.281 -179.976 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 161' ' ' ILE . . . . . 0.529 ' HA ' ' CB ' ' A' ' 172' ' ' ALA . 0.0 OUTLIER -85.79 126.48 40.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.469 1.105 . . . . 0.0 109.324 179.983 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.08 -25.92 6.08 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.52 1.137 . . . . 0.0 110.327 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 163' ' ' ASP . . . . . 0.605 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -137.23 157.4 46.74 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.532 1.145 . . . . 0.0 109.28 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . 0.556 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 5.5 mttt -142.66 78.82 15.67 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.526 1.141 . . . . 0.0 109.268 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.06 10.1 1.84 Allowed 'Trans proline' 0 C--N 1.36 1.141 0 O-C-N 124.528 1.804 . . . . 0.0 110.984 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 166' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -151.06 174.39 13.23 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.545 1.153 . . . . 0.0 110.261 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -99.07 7.98 45.38 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.505 1.128 . . . . 0.0 110.287 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.508 ' O ' ' N ' ' A' ' 184' ' ' VAL . 57.5 mt-30 -147.99 -45.11 0.16 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.582 1.176 . . . . 0.0 110.34 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -98.45 96.89 8.31 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 170' ' ' TRP . . . . . 0.64 ' CD2' ' CG2' ' A' ' 184' ' ' VAL . 31.5 m0 -102.06 154.82 18.62 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.521 1.138 . . . . 0.0 107.964 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . 0.43 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -88.2 111.13 21.29 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.463 1.102 . . . . 0.0 109.325 179.933 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . 0.529 ' CB ' ' HA ' ' A' ' 161' ' ' ILE . . . -134.92 166.65 22.52 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.487 1.117 . . . . 0.0 109.251 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.519 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.6 OUTLIER -96.31 155.48 16.75 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.554 1.159 . . . . 0.0 110.291 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 174' ' ' ASP . . . . . 0.409 ' CB ' ' HD2' ' A' ' 178' ' ' LYS . 0.7 OUTLIER -94.57 -162.08 0.91 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.442 1.089 . . . . 0.0 109.263 -179.984 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 38.1 m -79.33 7.23 8.21 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.476 1.11 . . . . 0.0 109.978 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . 0.418 ' HB2' ' HG2' ' A' ' 178' ' ' LYS . 2.6 mt-10 -125.72 -4.92 7.02 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.548 1.155 . . . . 0.0 110.291 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . 0.508 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 96.7 -12.0 66.22 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.5 1.125 . . . . 0.0 111.032 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . 0.418 ' HG2' ' HB2' ' A' ' 176' ' ' GLU . 0.1 OUTLIER -57.48 114.9 2.43 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.467 0.745 . . . . 0.0 109.29 -179.954 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . 0.453 ' HG3' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -88.94 127.34 35.65 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.52 1.137 . . . . 0.0 110.307 -179.992 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . 0.435 ' N ' HD11 ' A' ' 151' ' ' LEU . . . -153.42 -169.74 18.81 Favored Glycine 0 CA--C 1.53 0.998 0 O-C-N 124.422 1.077 . . . . 0.0 111.001 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.9 mmt -93.55 116.38 28.89 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 124.47 0.747 . . . . 0.0 111.04 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.599 ' CD1' ' CD1' ' A' ' 159' ' ' LEU . 1.3 tp -117.12 141.37 28.37 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.492 1.12 . . . . 0.0 109.255 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 183' ' ' PRO . . . . . 0.754 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.07 128.92 11.81 Favored 'Trans proline' 0 C--N 1.361 1.186 0 O-C-N 124.492 1.786 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.854 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 10.4 t -72.75 -28.8 1.06 Allowed Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.472 1.108 . . . . 0.0 109.277 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 185' ' ' PRO . . . . . 0.854 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -75.02 -17.56 19.39 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.473 1.775 . . . . 0.0 110.989 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . 0.754 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 9.9 m-85 -100.78 -6.63 24.63 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.524 1.14 . . . . 0.0 111.021 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 187' ' ' VAL . . . . . 0.547 ' HA ' ' O ' ' A' ' 138' ' ' ARG . 2.6 m -133.98 157.68 42.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.568 1.168 . . . . 0.0 109.292 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 188' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 1.3 tm-20 -98.78 152.62 19.49 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.508 1.13 . . . . 0.0 110.293 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 9.3 mtmm . . . . . 0 C--N 1.324 -0.502 0 O-C-N 124.573 1.17 . . . . 0.0 109.273 -179.974 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.452 -0.334 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . 0.433 ' C ' HG11 ' A' ' 137' ' ' VAL . 89.0 m-85 -138.54 178.73 6.93 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.448 1.093 . . . . 0.0 111.015 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.501 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 33.5 m -145.33 139.1 21.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.571 1.169 . . . . 0.0 109.271 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.606 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 12.2 ttm180 -101.35 114.84 29.2 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.442 1.089 . . . . 0.0 110.285 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.474 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -82.86 109.72 17.24 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.476 1.11 . . . . 0.0 109.279 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.588 HD11 ' N ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -89.92 23.97 2.58 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.511 1.132 . . . . 0.0 109.28 179.995 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.422 ' CA ' ' HG2' ' A' ' 155' ' ' LYS . 39.8 m-85 -143.82 155.47 44.14 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.48 1.113 . . . . 0.0 111.002 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.31 126.48 40.65 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.545 1.153 . . . . 0.0 109.339 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.578 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.6 OUTLIER . . . . . 0 C--N 1.326 -0.453 0 O-C-N 124.485 1.115 . . . . 0.0 110.981 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.538 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 7.7 tp . . . . . 0 N--CA 1.453 -0.296 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.99 -178.18 3.98 Favored 'Trans proline' 0 C--N 1.359 1.089 0 O-C-N 124.551 1.816 . . . . 0.0 111.012 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.578 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 1.6 p90 173.19 -177.89 0.07 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.53 1.144 . . . . 0.0 111.024 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . 0.416 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.4 OUTLIER -119.93 138.45 53.44 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.515 1.134 . . . . 0.0 109.301 179.98 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' LYS . . . . . 0.514 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.1 OUTLIER -39.06 123.94 1.39 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.469 1.106 . . . . 0.0 109.291 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.478 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 83.98 38.61 10.11 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.522 1.139 . . . . 0.0 110.999 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -108.52 169.04 8.9 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.521 0.777 . . . . 0.0 109.301 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.489 ' C ' ' HG ' ' A' ' 159' ' ' LEU . 8.4 mm -122.22 149.41 25.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 O-C-N 124.472 1.107 . . . . 0.0 109.346 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . 0.563 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 0.2 OUTLIER -143.78 141.21 30.31 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.543 1.152 . . . . 0.0 109.314 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.487 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.1 OUTLIER -86.66 96.73 10.23 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.456 1.098 . . . . 0.0 110.278 -179.97 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 161' ' ' ILE . . . . . 0.555 ' CD1' ' HB3' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -82.71 125.61 39.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.41 1.069 . . . . 0.0 109.281 179.995 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -124.39 -22.06 4.78 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.476 1.11 . . . . 0.0 110.306 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 163' ' ' ASP . . . . . 0.48 ' C ' ' HG3' ' A' ' 164' ' ' LYS . 71.2 m-20 -125.46 125.31 43.12 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.52 1.137 . . . . 0.0 109.365 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . 0.587 ' HG2' ' CE3' ' A' ' 170' ' ' TRP . 2.2 mtpt -136.47 63.08 46.53 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.559 1.162 . . . . 0.0 109.277 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . 0.441 ' HD3' ' N ' ' A' ' 164' ' ' LYS . 18.2 Cg_endo -75.03 -50.89 0.12 Allowed 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.508 1.794 . . . . 0.0 110.967 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 166' ' ' GLU . . . . . 0.511 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 0.6 OUTLIER -73.2 177.32 5.17 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.49 1.119 . . . . 0.0 110.359 179.979 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -117.81 47.57 1.53 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.566 1.166 . . . . 0.0 110.292 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.452 ' NE2' ' HG3' ' A' ' 185' ' ' PRO . 0.0 OUTLIER 174.87 -32.56 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.491 1.119 . . . . 0.0 110.3 -179.976 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 169' ' ' TRP . . . . . 0.581 ' CE3' ' HG2' ' A' ' 181' ' ' MET . 70.0 m95 -119.1 104.92 10.9 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.493 1.121 . . . . 0.0 108.01 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 170' ' ' TRP . . . . . 0.587 ' CE3' ' HG2' ' A' ' 164' ' ' LYS . 53.9 m0 -110.63 154.56 23.62 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . 0.474 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.9 OUTLIER -95.26 117.86 31.01 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.434 1.084 . . . . 0.0 109.326 179.918 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . 0.555 ' HB3' ' CD1' ' A' ' 161' ' ' ILE . . . -141.03 161.42 37.9 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.476 1.11 . . . . 0.0 109.28 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.563 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.8 OUTLIER -90.54 155.63 18.75 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.45 1.094 . . . . 0.0 110.326 -179.966 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 174' ' ' ASP . . . . . 0.516 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.4 OUTLIER -90.08 -161.41 0.79 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.449 1.093 . . . . 0.0 109.308 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 5.6 t -81.21 12.7 3.3 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.507 1.129 . . . . 0.0 109.994 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -132.23 -6.26 3.41 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.567 1.167 . . . . 0.0 110.318 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . 0.521 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 101.62 -12.98 58.15 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.476 1.11 . . . . 0.0 111.007 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . 0.48 ' O ' ' CD1' ' A' ' 151' ' ' LEU . 2.7 mtmt -52.75 113.28 1.03 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.545 0.791 . . . . 0.0 109.322 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . 0.465 ' CG ' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -89.24 125.02 34.91 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 124.531 1.145 . . . . 0.0 110.327 -179.979 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . 0.474 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.42 -165.96 14.5 Favored Glycine 0 CA--C 1.53 1.021 0 O-C-N 124.529 1.143 . . . . 0.0 110.954 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 181' ' ' MET . . . . . 0.581 ' HG2' ' CE3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -101.88 125.85 48.64 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.529 0.782 . . . . 0.0 111.004 179.976 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.538 ' CG2' ' HB3' ' A' ' 151' ' ' LEU . 2.2 pp -121.89 149.3 53.34 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.54 1.15 . . . . 0.0 109.292 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 183' ' ' PRO . . . . . 0.895 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -74.95 125.87 9.63 Favored 'Trans proline' 0 C--N 1.359 1.124 0 O-C-N 124.591 1.837 . . . . 0.0 110.966 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.852 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 55.4 t -68.98 -29.43 1.91 Allowed Pre-proline 0 C--N 1.326 -0.436 0 O-C-N 124.492 1.12 . . . . 0.0 109.265 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 185' ' ' PRO . . . . . 0.852 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -75.04 -24.28 12.9 Favored 'Trans proline' 0 C--N 1.359 1.079 0 O-C-N 124.542 1.812 . . . . 0.0 110.995 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . 0.895 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.0 m-85 -99.58 -0.18 40.97 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.525 1.141 . . . . 0.0 110.965 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 187' ' ' VAL . . . . . 0.606 ' HA ' ' O ' ' A' ' 138' ' ' ARG . 4.2 m -134.03 154.96 38.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 O-C-N 124.464 1.102 . . . . 0.0 109.313 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 188' ' ' GLU . . . . . 0.501 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.2 OUTLIER -106.11 159.53 16.01 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 0.0 110.275 -179.991 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.418 0 O-C-N 124.509 1.13 . . . . 0.0 109.32 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 10.4 p . . . . . 0 N--CA 1.453 -0.319 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . 0.421 ' HA ' ' HA ' ' A' ' 160' ' ' ARG . 43.0 m-85 -155.88 165.52 36.22 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.515 1.135 . . . . 0.0 111.013 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.542 HG21 ' CG2' ' A' ' 161' ' ' ILE . 19.8 m -142.86 147.02 21.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.58 1.175 . . . . 0.0 109.27 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.502 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 0.1 OUTLIER -103.08 111.55 23.96 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.523 1.139 . . . . 0.0 110.285 -179.981 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.412 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -82.12 104.39 12.42 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.501 1.126 . . . . 0.0 109.336 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.494 ' C ' ' HG2' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -88.74 24.27 2.07 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.564 1.165 . . . . 0.0 109.33 -179.998 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.497 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 9.6 m-85 -146.93 145.86 29.93 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.485 1.116 . . . . 0.0 110.989 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.6 152.26 22.75 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.57 1.169 . . . . 0.0 109.285 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.57 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.3 OUTLIER . . . . . 0 C--N 1.325 -0.469 0 O-C-N 124.434 1.084 . . . . 0.0 110.959 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.439 ' O ' ' CG2' ' A' ' 182' ' ' ILE . 8.8 tp . . . . . 0 N--CA 1.453 -0.29 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' PRO . . . . . 0.424 ' CB ' ' O ' ' A' ' 143' ' ' PHE . 18.2 Cg_endo -75.08 179.03 6.51 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.491 1.785 . . . . 0.0 111.035 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.57 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 0.4 OUTLIER -177.58 -171.81 0.33 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.43 1.081 . . . . 0.0 111.033 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.82 139.96 53.44 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.545 1.153 . . . . 0.0 109.287 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' LYS . . . . . 0.494 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -44.26 115.53 0.86 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.543 1.152 . . . . 0.0 109.312 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.444 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 93.35 43.73 3.93 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 124.605 1.191 . . . . 0.0 111.025 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -115.53 170.94 8.05 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.458 0.74 . . . . 0.0 109.295 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 158' ' ' ILE . . . . . 0.442 HG22 ' N ' ' A' ' 159' ' ' LEU . 48.8 mm -120.66 144.99 27.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.529 1.143 . . . . 0.0 109.376 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . 0.601 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 0.5 OUTLIER -140.88 133.74 29.03 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.497 1.123 . . . . 0.0 109.286 -179.91 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.483 ' C ' ' HB2' ' A' ' 172' ' ' ALA . 8.5 ttp85 -89.83 106.85 18.75 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.484 1.115 . . . . 0.0 110.298 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 161' ' ' ILE . . . . . 0.542 ' CG2' HG21 ' A' ' 137' ' ' VAL . 0.5 OUTLIER -83.42 127.8 39.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 124.468 1.105 . . . . 0.0 109.259 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.47 -20.59 6.01 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 124.498 1.124 . . . . 0.0 110.275 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 163' ' ' ASP . . . . . 0.447 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 3.7 m-20 -135.63 148.76 49.11 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.517 1.135 . . . . 0.0 109.343 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . 0.569 ' HG3' ' CE2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -145.68 76.36 12.92 Favored Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.36 1.038 . . . . 0.0 109.334 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -74.89 -46.95 0.22 Allowed 'Trans proline' 0 C--N 1.36 1.183 0 O-C-N 124.504 1.792 . . . . 0.0 111.049 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 166' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -91.17 173.87 7.7 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.416 1.072 . . . . 0.0 110.278 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . 0.458 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 1.6 mm-40 -104.04 36.43 2.35 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.453 1.096 . . . . 0.0 110.358 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 184' ' ' VAL . 3.3 mt-30 -173.09 -39.06 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.58 1.175 . . . . 0.0 110.312 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 169' ' ' TRP . . . . . 0.484 ' CZ3' ' HD3' ' A' ' 183' ' ' PRO . 85.6 m95 -109.66 98.6 7.92 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.527 1.142 . . . . 0.0 107.994 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 170' ' ' TRP . . . . . 0.595 ' CD2' HG23 ' A' ' 184' ' ' VAL . 20.7 m0 -105.01 160.04 15.34 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.5 1.125 . . . . 0.0 108.041 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . 0.545 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -92.02 112.16 23.99 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.53 1.144 . . . . 0.0 109.283 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . 0.499 ' CB ' HG22 ' A' ' 161' ' ' ILE . . . -135.0 164.17 28.23 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.575 1.172 . . . . 0.0 109.283 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.601 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 18.6 mp0 -95.02 157.87 15.71 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.481 1.113 . . . . 0.0 110.229 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 174' ' ' ASP . . . . . 0.506 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.4 OUTLIER -90.21 -158.89 0.56 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.564 1.165 . . . . 0.0 109.295 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 24.6 m -83.34 10.67 8.1 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.539 1.15 . . . . 0.0 109.958 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -133.61 -5.23 2.89 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.553 1.158 . . . . 0.0 110.294 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . 0.527 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 106.58 -17.59 39.29 Favored Glycine 0 CA--C 1.53 1.031 0 O-C-N 124.502 1.126 . . . . 0.0 110.983 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . 0.444 ' O ' ' HA ' ' A' ' 173' ' ' GLU . 0.6 OUTLIER -42.87 109.43 0.14 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.495 0.762 . . . . 0.0 109.336 179.956 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . 0.472 ' HG2' ' OE2' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -91.3 123.19 34.55 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.494 1.121 . . . . 0.0 110.278 -179.986 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . 0.545 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -157.25 -162.89 11.93 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.5 1.125 . . . . 0.0 110.998 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 41.5 mtp -104.78 120.75 42.12 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.446 0.733 . . . . 0.0 110.999 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.439 ' CG2' ' O ' ' A' ' 151' ' ' LEU . 2.5 pp -120.88 150.89 53.93 Favored Pre-proline 0 C--N 1.325 -0.47 0 O-C-N 124.489 1.118 . . . . 0.0 109.369 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 183' ' ' PRO . . . . . 0.776 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.02 131.27 14.07 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.451 1.764 . . . . 0.0 110.995 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.868 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 53.9 t -74.43 -28.98 0.9 Allowed Pre-proline 0 C--N 1.324 -0.521 0 O-C-N 124.509 1.131 . . . . 0.0 109.272 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 185' ' ' PRO . . . . . 0.868 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.2 Cg_endo -74.99 -19.25 18.05 Favored 'Trans proline' 0 C--N 1.361 1.191 0 O-C-N 124.442 1.759 . . . . 0.0 111.026 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . 0.776 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 8.5 m-85 -98.57 -1.36 41.22 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.532 1.145 . . . . 0.0 110.997 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 187' ' ' VAL . . . . . 0.502 ' HA ' ' O ' ' A' ' 138' ' ' ARG . 7.5 m -134.68 156.37 39.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 124.534 1.146 . . . . 0.0 109.26 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 188' ' ' GLU . . . . . 0.444 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 1.5 pp20? -108.55 168.12 9.55 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.489 1.118 . . . . 0.0 110.274 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 189' ' ' LYS . . . . . 0.417 ' O ' ' OE2' ' A' ' 188' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.475 0 O-C-N 124.555 1.159 . . . . 0.0 109.244 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.452 -0.329 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . 0.558 ' CE2' ' HB2' ' A' ' 160' ' ' ARG . 80.2 m-85 -152.71 169.23 23.24 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.541 1.15 . . . . 0.0 110.996 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.525 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 26.8 m -145.54 148.41 17.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.487 1.117 . . . . 0.0 109.306 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.464 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 5.6 ttp180 -104.34 111.47 24.12 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.514 1.134 . . . . 0.0 110.314 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.454 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -80.18 107.05 12.66 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.508 1.13 . . . . 0.0 109.34 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.405 ' O ' ' HG2' ' A' ' 155' ' ' LYS . 1.1 mt -88.33 21.8 2.72 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.5 1.125 . . . . 0.0 109.287 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.468 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 72.3 m-85 -141.55 138.86 32.99 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.487 1.117 . . . . 0.0 111.01 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.28 153.46 25.85 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.469 1.105 . . . . 0.0 109.319 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.618 ' CZ ' ' OD2' ' A' ' 150' ' ' ASP . 4.7 t80 -177.16 102.85 0.05 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.505 1.128 . . . . 0.0 110.991 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -134.66 101.85 5.08 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.47 1.106 . . . . 0.0 109.265 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -157.4 -128.53 1.05 Allowed Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.435 1.084 . . . . 0.0 111.017 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 171.32 84.65 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.488 0.758 . . . . 0.0 109.311 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -109.77 -75.08 0.63 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.498 1.124 . . . . 0.0 109.303 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -109.86 35.07 3.51 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.473 1.108 . . . . 0.0 110.327 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 65.88 17.72 10.9 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.47 1.106 . . . . 0.0 110.344 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.618 ' OD2' ' CZ ' ' A' ' 143' ' ' PHE . 3.8 t0 -58.15 134.8 56.79 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.455 1.097 . . . . 0.0 109.292 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.515 ' HB3' ' CD1' ' A' ' 182' ' ' ILE . 34.7 tp -66.55 111.86 7.91 Favored Pre-proline 0 C--N 1.326 -0.45 0 O-C-N 124.485 1.116 . . . . 0.0 109.273 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . 0.435 ' CB ' ' O ' ' A' ' 143' ' ' PHE . 18.4 Cg_endo -75.03 170.2 20.93 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.535 1.808 . . . . 0.0 111.029 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.597 ' CE1' ' HB3' ' A' ' 143' ' ' PHE . 0.7 OUTLIER -173.83 -175.59 1.1 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.502 1.126 . . . . 0.0 110.966 -179.996 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . 0.439 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -131.56 135.87 47.36 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.505 1.128 . . . . 0.0 109.313 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . 0.439 ' C ' ' O ' ' A' ' 154' ' ' LYS . 0.0 OUTLIER -37.54 110.88 0.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.511 1.132 . . . . 0.0 109.353 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 94.79 42.41 3.86 Favored Glycine 0 CA--C 1.529 0.955 0 O-C-N 124.496 1.122 . . . . 0.0 110.999 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . 0.404 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 17.6 t70 -111.68 165.88 11.65 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.496 0.762 . . . . 0.0 109.339 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.441 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 4.9 mp -119.89 140.16 44.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.504 1.128 . . . . 0.0 109.338 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.492 HD13 ' CG2' ' A' ' 182' ' ' ILE . 0.8 OUTLIER -137.07 134.64 36.72 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.5 1.125 . . . . 0.0 109.297 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.558 ' HB2' ' CE2' ' A' ' 136' ' ' TYR . 10.0 ttm180 -87.1 104.07 15.99 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.507 1.129 . . . . 0.0 110.28 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.492 HG23 ' CB ' ' A' ' 172' ' ' ALA . 0.8 OUTLIER -84.62 125.93 40.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.44 1.088 . . . . 0.0 109.286 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 5.9 ptt180 -121.43 -24.94 5.28 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.45 1.094 . . . . 0.0 110.279 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' ASP . . . . . 0.446 ' HB2' ' CB ' ' A' ' 171' ' ' ASN . 79.2 m-20 -126.4 131.82 51.66 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.471 1.107 . . . . 0.0 109.261 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.465 ' HD2' ' CD1' ' A' ' 161' ' ' ILE . 0.0 OUTLIER -133.46 69.62 76.96 Favored Pre-proline 0 C--N 1.325 -0.466 0 O-C-N 124.473 1.108 . . . . 0.0 109.248 179.998 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.02 -52.15 0.11 Allowed 'Trans proline' 0 C--N 1.359 1.12 0 O-C-N 124.512 1.796 . . . . 0.0 111.002 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' GLU . . . . . 0.444 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 4.1 mm-40 -76.73 175.1 9.71 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.478 1.111 . . . . 0.0 110.267 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . 0.522 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 3.3 pt-20 -106.56 31.69 5.05 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.467 1.104 . . . . 0.0 110.321 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.522 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 3.1 mt-30 -172.35 -40.17 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.475 1.11 . . . . 0.0 110.316 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -106.04 104.57 14.3 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 0.0 107.981 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' TRP . . . . . 0.56 ' CE3' HG21 ' A' ' 184' ' ' VAL . 50.1 m0 -109.45 154.6 22.4 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.527 1.142 . . . . 0.0 107.988 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . 0.448 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 1.0 OUTLIER -88.25 111.06 21.24 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.503 1.127 . . . . 0.0 109.355 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . 0.492 ' CB ' HG23 ' A' ' 161' ' ' ILE . . . -127.51 167.34 16.43 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.492 1.12 . . . . 0.0 109.292 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.51 ' CG ' ' O ' ' A' ' 177' ' ' GLY . 6.9 mp0 -101.39 156.28 17.55 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.473 1.108 . . . . 0.0 110.287 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . 0.478 ' OD1' ' N ' ' A' ' 178' ' ' LYS . 45.2 p-10 -93.85 -160.19 0.75 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.444 1.09 . . . . 0.0 109.316 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 45.0 t -80.92 11.46 3.97 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.478 1.111 . . . . 0.0 109.996 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -132.22 -2.25 3.56 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.435 1.084 . . . . 0.0 110.337 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . 0.51 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 96.01 -12.28 67.12 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.462 1.102 . . . . 0.0 110.985 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . 0.478 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 2.9 mtpp -52.67 113.25 1.01 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.474 0.749 . . . . 0.0 109.303 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . 0.441 ' HG2' ' CD ' ' A' ' 173' ' ' GLU . 0.5 OUTLIER -87.89 126.26 34.94 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.485 1.116 . . . . 0.0 110.304 -179.99 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.448 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -152.72 -169.3 17.83 Favored Glycine 0 CA--C 1.53 1.002 0 O-C-N 124.522 1.139 . . . . 0.0 110.993 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' MET . . . . . 0.425 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 1.4 mmt -86.78 126.03 34.33 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.528 0.781 . . . . 0.0 111.024 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.515 ' CD1' ' HB3' ' A' ' 151' ' ' LEU . 18.1 mm -121.5 134.56 24.58 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.475 1.109 . . . . 0.0 109.313 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' PRO . . . . . 0.681 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.01 121.13 6.38 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.543 1.812 . . . . 0.0 111.025 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.835 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 9.8 t -69.66 -30.28 2.04 Favored Pre-proline 0 C--N 1.325 -0.475 0 O-C-N 124.51 1.131 . . . . 0.0 109.299 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' PRO . . . . . 0.835 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -75.03 -23.96 13.24 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.527 1.804 . . . . 0.0 111.003 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . 0.681 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.5 m-85 -100.32 -5.02 28.02 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.545 1.153 . . . . 0.0 110.989 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 187' ' ' VAL . . . . . 0.476 ' O ' ' O ' ' A' ' 184' ' ' VAL . 3.3 m -128.49 152.63 36.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.539 1.149 . . . . 0.0 109.273 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 188' ' ' GLU . . . . . 0.525 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.0 OUTLIER -107.98 166.08 10.98 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.491 1.119 . . . . 0.0 110.322 179.992 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.18 117.09 29.33 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.491 1.12 . . . . 0.0 109.325 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -110.01 -65.93 1.11 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.488 1.118 . . . . 0.0 110.996 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 191' ' ' GLY . . . . . 0.439 ' C ' ' H ' ' A' ' 136' ' ' TYR . . . . . . . . 0 CA--C 1.53 1.026 0 O-C-N 124.484 1.115 . . . . 0.0 111.052 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . 0.554 ' HB3' ' CE2' ' A' ' 136' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . 0.554 ' CE2' ' HB3' ' A' ' 135' ' ' CYS . 68.1 m-85 -151.3 173.9 13.94 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.475 1.109 . . . . 0.0 111.035 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.523 ' HB ' ' CG2' ' A' ' 187' ' ' VAL . 4.2 m -147.67 149.55 15.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 O-C-N 124.492 1.12 . . . . 0.0 109.302 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.516 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 16.4 ttp180 -105.25 107.49 18.5 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.501 1.126 . . . . 0.0 110.316 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.459 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -80.92 103.95 11.1 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.47 1.106 . . . . 0.0 109.371 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.412 ' C ' ' HG2' ' A' ' 155' ' ' LYS . 2.9 mp -88.89 22.99 2.49 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.527 1.142 . . . . 0.0 109.332 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.429 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 36.4 m-85 -144.01 145.2 32.05 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.514 1.134 . . . . 0.0 111.009 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . 0.401 ' N ' ' HB2' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -87.63 152.66 21.99 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.563 1.164 . . . . 0.0 109.328 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.604 ' HB3' ' CZ ' ' A' ' 153' ' ' PHE . 5.8 t80 -179.89 153.78 0.54 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.469 1.105 . . . . 0.0 111.013 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . 0.452 ' O ' ' HB3' ' A' ' 152' ' ' PRO . 0.8 OUTLIER -111.41 -46.55 3.27 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.523 1.139 . . . . 0.0 109.332 179.965 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 98.91 137.14 9.66 Favored Glycine 0 CA--C 1.528 0.892 0 O-C-N 124.476 1.11 . . . . 0.0 111.007 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -138.02 51.44 1.88 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.471 0.748 . . . . 0.0 109.281 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 83.7 m-20 -128.3 -177.39 4.14 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.46 1.1 . . . . 0.0 109.269 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -92.12 28.99 1.72 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.51 1.131 . . . . 0.0 110.275 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 171.37 38.31 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.484 1.115 . . . . 0.0 110.307 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -86.75 175.0 8.46 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.571 1.169 . . . . 0.0 109.329 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.495 ' CD2' ' O ' ' A' ' 172' ' ' ALA . 11.6 tp -139.18 111.71 7.91 Favored Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.542 1.151 . . . . 0.0 109.344 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . 0.452 ' HB3' ' O ' ' A' ' 144' ' ' ASN . 18.2 Cg_endo -75.08 133.62 16.69 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.417 1.746 . . . . 0.0 110.967 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.604 ' CZ ' ' HB3' ' A' ' 143' ' ' PHE . 4.8 p90 -150.8 -179.05 6.95 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 0.0 111.023 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -130.94 147.16 52.54 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.447 1.092 . . . . 0.0 109.238 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . 0.412 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -56.34 118.12 4.46 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.538 1.149 . . . . 0.0 109.365 179.941 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 99.72 35.57 4.56 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.472 1.108 . . . . 0.0 110.984 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -120.61 170.29 9.56 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.522 0.778 . . . . 0.0 109.286 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.455 ' C ' ' HG ' ' A' ' 159' ' ' LEU . 5.2 mt -119.46 148.23 22.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 O-C-N 124.553 1.158 . . . . 0.0 109.268 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.526 HD11 ' CG2' ' A' ' 182' ' ' ILE . 0.4 OUTLIER -139.79 136.69 34.33 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.496 1.123 . . . . 0.0 109.28 -179.976 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.455 ' HA ' ' HA ' ' A' ' 136' ' ' TYR . 6.1 ttt-85 -87.69 100.96 13.21 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.554 1.159 . . . . 0.0 110.275 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.5 ' HA ' ' CB ' ' A' ' 172' ' ' ALA . 0.0 OUTLIER -86.1 130.55 36.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.566 1.166 . . . . 0.0 109.322 179.946 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -129.19 -24.49 2.85 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.5 1.125 . . . . 0.0 110.32 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' ASP . . . . . 0.427 ' HB2' ' CB ' ' A' ' 171' ' ' ASN . 8.7 m-20 -124.78 147.97 48.39 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.406 1.066 . . . . 0.0 109.305 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.468 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 10.9 mtmm -144.0 71.32 16.71 Favored Pre-proline 0 C--N 1.324 -0.508 0 O-C-N 124.535 1.147 . . . . 0.0 109.272 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -75.01 4.97 4.27 Favored 'Trans proline' 0 C--N 1.36 1.172 0 O-C-N 124.453 1.765 . . . . 0.0 111.05 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' GLU . . . . . 0.468 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 26.3 mm-40 -141.46 172.75 12.25 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.469 1.106 . . . . 0.0 110.316 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -100.07 16.38 24.25 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.521 1.138 . . . . 0.0 110.318 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.428 ' NE2' ' HG3' ' A' ' 185' ' ' PRO . 7.0 mt-30 -157.84 -43.19 0.06 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.53 1.144 . . . . 0.0 110.26 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' TRP . . . . . 0.504 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 90.0 m95 -100.18 101.03 11.96 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' TRP . . . . . 0.47 ' CD2' HG22 ' A' ' 184' ' ' VAL . 28.8 m0 -107.96 154.45 21.61 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.545 1.153 . . . . 0.0 108.026 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . 0.427 ' CB ' ' HB2' ' A' ' 163' ' ' ASP . 0.5 OUTLIER -87.77 111.79 21.73 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.471 1.107 . . . . 0.0 109.264 -179.921 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . 0.5 ' CB ' ' HA ' ' A' ' 161' ' ' ILE . . . -132.81 163.7 28.49 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.556 1.16 . . . . 0.0 109.286 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.488 ' CG ' ' O ' ' A' ' 177' ' ' GLY . 0.6 OUTLIER -95.98 158.88 15.25 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.493 1.12 . . . . 0.0 110.288 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -94.58 -166.18 1.43 Allowed 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.512 1.133 . . . . 0.0 109.261 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.91 5.64 6.2 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.529 1.143 . . . . 0.0 110.042 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -124.64 -5.31 7.59 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.444 1.09 . . . . 0.0 110.264 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . 0.488 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 98.34 -7.48 61.94 Favored Glycine 0 CA--C 1.53 0.979 0 O-C-N 124.429 1.081 . . . . 0.0 110.99 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 5.4 mtmt -56.76 112.77 1.4 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.481 0.753 . . . . 0.0 109.322 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.1 OUTLIER -87.8 123.37 32.52 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.49 1.119 . . . . 0.0 110.322 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.459 ' N ' HD12 ' A' ' 151' ' ' LEU . . . -155.46 -162.93 11.66 Favored Glycine 0 CA--C 1.531 1.072 0 O-C-N 124.514 1.134 . . . . 0.0 110.959 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' MET . . . . . 0.504 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.2 OUTLIER -88.25 130.65 35.04 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.606 0.827 . . . . 0.0 111.005 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.526 ' CG2' HD11 ' A' ' 159' ' ' LEU . 23.0 mm -126.92 131.83 24.05 Favored Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 124.53 1.144 . . . . 0.0 109.255 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 183' ' ' PRO . . . . . 0.685 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.02 123.19 7.69 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.485 1.782 . . . . 0.0 110.944 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.827 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 14.0 t -71.93 -31.08 1.64 Allowed Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.496 1.123 . . . . 0.0 109.331 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 185' ' ' PRO . . . . . 0.827 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.96 -21.01 16.38 Favored 'Trans proline' 0 C--N 1.36 1.145 0 O-C-N 124.508 1.794 . . . . 0.0 111.057 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . 0.685 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.9 m-85 -97.72 -21.47 16.97 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.481 1.113 . . . . 0.0 110.984 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 187' ' ' VAL . . . . . 0.523 ' CG2' ' HB ' ' A' ' 137' ' ' VAL . 1.4 m -116.35 157.93 17.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.474 1.109 . . . . 0.0 109.371 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 188' ' ' GLU . . . . . 0.4 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.2 OUTLIER -102.24 163.61 12.14 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.428 1.08 . . . . 0.0 110.331 179.968 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . 0.468 ' NZ ' ' CZ3' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -88.88 111.33 21.95 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.573 1.17 . . . . 0.0 109.3 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -96.4 -39.98 9.33 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.545 1.153 . . . . 0.0 111.006 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.947 0 O-C-N 124.489 1.118 . . . . 0.0 111.018 -179.976 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 27.0 p . . . . . 0 N--CA 1.452 -0.343 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . 0.575 ' CE1' ' HB2' ' A' ' 160' ' ' ARG . 12.7 m-85 -130.21 164.64 24.07 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.489 1.118 . . . . 0.0 111.044 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.542 HG21 ' CG2' ' A' ' 187' ' ' VAL . 0.5 OUTLIER -147.69 165.06 6.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.547 1.154 . . . . 0.0 109.274 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.451 ' HG3' ' CD1' ' A' ' 158' ' ' ILE . 2.5 ttm180 -125.49 118.68 26.31 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.498 1.124 . . . . 0.0 110.324 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.519 ' CB ' HG13 ' A' ' 187' ' ' VAL . . . -84.03 113.33 20.94 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.493 1.121 . . . . 0.0 109.287 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.8 mt -87.14 20.28 2.78 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.565 1.165 . . . . 0.0 109.329 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.446 ' CD2' ' CD2' ' A' ' 186' ' ' TYR . 17.8 t80 -142.8 166.78 23.72 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 124.467 1.105 . . . . 0.0 110.958 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -106.78 154.7 20.61 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.484 1.115 . . . . 0.0 109.321 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.603 ' CE1' ' OD1' ' A' ' 150' ' ' ASP . 11.0 t80 -178.55 102.3 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.495 1.122 . . . . 0.0 111.037 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . 0.411 ' HA ' ' HB3' ' A' ' 152' ' ' PRO . 10.8 p-10 -132.64 114.92 14.77 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.428 1.08 . . . . 0.0 109.302 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 129.05 79.36 0.23 Allowed Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.529 1.143 . . . . 0.0 111.008 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . 0.432 ' O ' ' N ' ' A' ' 148' ' ' GLU . 3.5 m-80 172.64 -72.41 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.461 0.742 . . . . 0.0 109.281 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . 0.437 ' O ' ' N ' ' A' ' 150' ' ' ASP . 0.7 OUTLIER 62.73 -81.7 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.49 1.119 . . . . 0.0 109.303 179.995 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.432 ' N ' ' O ' ' A' ' 146' ' ' ASN . 0.3 OUTLIER -49.6 -24.8 2.35 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.515 1.134 . . . . 0.0 110.23 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . 0.431 ' O ' ' HB3' ' A' ' 150' ' ' ASP . 1.5 tt0 -93.27 -24.49 18.14 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.567 1.167 . . . . 0.0 110.294 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.603 ' OD1' ' CE1' ' A' ' 143' ' ' PHE . 2.2 p30 170.38 143.53 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.451 1.095 . . . . 0.0 109.286 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.504 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 13.0 tp -61.03 124.61 80.91 Favored Pre-proline 0 C--N 1.325 -0.463 0 O-C-N 124.508 1.13 . . . . 0.0 109.307 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . 0.452 ' CB ' ' O ' ' A' ' 143' ' ' PHE . 18.3 Cg_endo -74.92 169.53 22.41 Favored 'Trans proline' 0 C--N 1.36 1.151 0 O-C-N 124.558 1.82 . . . . 0.0 111.039 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.466 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 2.0 p90 -174.86 173.13 2.79 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.522 1.139 . . . . 0.0 110.99 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . 0.495 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -123.39 127.3 48.27 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.529 1.143 . . . . 0.0 109.301 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . 0.495 ' C ' ' O ' ' A' ' 154' ' ' LYS . 0.9 OUTLIER -32.58 107.51 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.544 0 O-C-N 124.542 1.151 . . . . 0.0 109.298 -179.975 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 99.79 39.5 3.36 Favored Glycine 0 CA--C 1.53 0.988 0 O-C-N 124.453 1.096 . . . . 0.0 110.975 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . 0.441 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 22.2 t70 -111.9 172.05 7.13 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.454 0.737 . . . . 0.0 109.32 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.46 HD12 ' O ' ' A' ' 137' ' ' VAL . 6.1 mm -123.64 149.31 27.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.502 1.126 . . . . 0.0 109.294 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.454 ' HG ' ' C ' ' A' ' 158' ' ' ILE . 3.1 mt -145.86 140.07 26.78 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.456 1.098 . . . . 0.0 109.311 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.575 ' HB2' ' CE1' ' A' ' 136' ' ' TYR . 1.9 ttt180 -88.64 102.17 14.7 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.514 1.134 . . . . 0.0 110.302 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.522 ' CD1' ' HB2' ' A' ' 170' ' ' TRP . 0.1 OUTLIER -83.12 124.13 39.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.535 1.147 . . . . 0.0 109.287 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -118.91 -25.11 6.37 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.545 1.153 . . . . 0.0 110.335 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' ASP . . . . . 0.453 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 1.4 m-20 -131.74 157.77 42.92 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.53 1.144 . . . . 0.0 109.236 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.518 ' HB2' ' CG ' ' A' ' 170' ' ' TRP . 0.7 OUTLIER -165.13 65.29 1.1 Allowed Pre-proline 0 C--N 1.326 -0.432 0 O-C-N 124.497 1.123 . . . . 0.0 109.289 -179.956 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . 0.4 ' HD3' ' N ' ' A' ' 164' ' ' LYS . 18.4 Cg_endo -74.98 6.46 3.37 Favored 'Trans proline' 0 C--N 1.359 1.131 0 O-C-N 124.473 1.775 . . . . 0.0 110.992 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' GLU . . . . . 0.446 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 6.5 mm-40 -131.21 171.04 13.76 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.457 1.098 . . . . 0.0 110.279 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . 0.518 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 2.5 mt-10 -112.56 48.07 1.03 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.448 1.092 . . . . 0.0 110.277 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.518 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 1.3 mt-30 173.64 -32.12 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.487 1.117 . . . . 0.0 110.281 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' TRP . . . . . 0.436 ' O ' ' HB2' ' A' ' 166' ' ' GLU . 76.3 m95 -123.27 103.26 8.41 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.524 1.14 . . . . 0.0 107.994 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' TRP . . . . . 0.522 ' HB2' ' CD1' ' A' ' 161' ' ' ILE . 30.0 m0 -108.68 169.68 8.51 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.48 1.112 . . . . 0.0 108.002 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . 0.487 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -104.96 115.87 31.0 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.5 1.125 . . . . 0.0 109.236 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . 0.503 ' HB1' ' CD1' ' A' ' 161' ' ' ILE . . . -133.88 167.97 19.6 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.485 1.116 . . . . 0.0 109.307 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.54 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 4.0 mp0 -100.44 158.67 15.73 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.533 1.146 . . . . 0.0 110.297 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . 0.496 ' OD1' ' N ' ' A' ' 177' ' ' GLY . 44.2 p-10 -94.55 -161.25 0.84 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.574 1.171 . . . . 0.0 109.298 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.73 14.06 2.85 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.528 1.143 . . . . 0.0 109.97 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -133.47 -5.34 2.94 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.474 1.109 . . . . 0.0 110.297 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . 0.51 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 99.85 -12.72 60.91 Favored Glycine 0 CA--C 1.531 1.039 0 O-C-N 124.477 1.111 . . . . 0.0 110.921 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . 0.433 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 2.8 mttm -53.78 112.75 0.99 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.506 0.768 . . . . 0.0 109.298 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -88.51 128.08 35.54 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.402 1.064 . . . . 0.0 110.356 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.487 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -152.73 -167.87 16.03 Favored Glycine 0 CA--C 1.529 0.966 0 O-C-N 124.454 1.096 . . . . 0.0 111.039 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -96.75 118.91 34.22 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.522 0.778 . . . . 0.0 111.06 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.504 ' CG2' ' HB3' ' A' ' 151' ' ' LEU . 4.8 pt -112.77 141.39 25.32 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.505 1.128 . . . . 0.0 109.333 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 183' ' ' PRO . . . . . 0.777 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.1 Cg_endo -75.01 126.74 10.16 Favored 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.48 1.779 . . . . 0.0 111.058 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.828 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 48.8 t -71.98 -30.61 1.52 Allowed Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.498 1.124 . . . . 0.0 109.248 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 185' ' ' PRO . . . . . 0.828 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.94 -26.69 10.81 Favored 'Trans proline' 0 C--N 1.36 1.16 0 O-C-N 124.459 1.768 . . . . 0.0 111.005 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . 0.777 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 7.2 m-85 -98.76 2.46 46.95 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.451 1.094 . . . . 0.0 110.986 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 187' ' ' VAL . . . . . 0.586 HG21 ' HA ' ' A' ' 184' ' ' VAL . 2.0 m -140.02 160.25 26.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 124.453 1.096 . . . . 0.0 109.365 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 188' ' ' GLU . . . . . 0.411 ' O ' ' HB ' ' A' ' 137' ' ' VAL . 0.9 OUTLIER -111.45 149.08 31.79 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.544 1.152 . . . . 0.0 110.249 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.75 107.7 18.77 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.553 1.158 . . . . 0.0 109.274 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -102.55 -23.4 13.89 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.459 1.099 . . . . 0.0 111.067 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 191' ' ' GLY . . . . . 0.43 ' C ' ' H ' ' A' ' 136' ' ' TYR . . . . . . . . 0 CA--C 1.53 0.98 0 O-C-N 124.439 1.087 . . . . 0.0 111.01 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . 0.491 ' HB3' ' CE2' ' A' ' 136' ' ' TYR . 1.3 m . . . . . 0 N--CA 1.453 -0.313 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . 0.557 ' CE1' ' HD2' ' A' ' 160' ' ' ARG . 34.6 m-85 -150.58 177.62 9.86 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.514 1.134 . . . . 0.0 111.007 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.52 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 9.9 m -143.85 141.04 25.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.479 1.112 . . . . 0.0 109.302 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.602 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 14.0 ttp180 -99.65 112.28 24.52 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.551 1.157 . . . . 0.0 110.291 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.456 ' HB1' HG12 ' A' ' 187' ' ' VAL . . . -80.07 112.37 17.31 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.579 1.174 . . . . 0.0 109.309 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.497 ' N ' HD12 ' A' ' 140' ' ' LEU . 0.1 OUTLIER -91.15 22.9 3.51 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.586 1.179 . . . . 0.0 109.312 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.486 ' CG ' ' CD2' ' A' ' 186' ' ' TYR . 55.3 m-85 -147.36 156.24 42.72 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.549 1.156 . . . . 0.0 110.926 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.67 128.59 45.0 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.582 1.176 . . . . 0.0 109.27 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.62 ' HB3' ' CZ ' ' A' ' 153' ' ' PHE . 0.8 OUTLIER -164.15 123.35 1.95 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.468 1.105 . . . . 0.0 111.011 179.972 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . 0.461 ' O ' ' CA ' ' A' ' 152' ' ' PRO . 0.9 OUTLIER -89.82 -58.11 2.63 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.527 1.142 . . . . 0.0 109.302 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 162.64 125.03 0.74 Allowed Glycine 0 CA--C 1.531 1.071 0 O-C-N 124.444 1.09 . . . . 0.0 110.974 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . 0.576 ' OD1' ' CZ ' ' A' ' 143' ' ' PHE . 41.4 p30 -178.2 36.86 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.567 0.804 . . . . 0.0 109.25 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -135.51 -72.58 0.46 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.491 1.119 . . . . 0.0 109.31 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -140.54 39.31 1.87 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.517 1.136 . . . . 0.0 110.312 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 74.49 20.61 2.46 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.467 1.104 . . . . 0.0 110.321 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.475 ' OD2' ' CD2' ' A' ' 143' ' ' PHE . 2.0 p-10 -45.27 163.44 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.404 1.065 . . . . 0.0 109.259 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.64 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 14.6 tp -80.9 132.6 56.79 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.554 1.159 . . . . 0.0 109.352 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . 0.461 ' CA ' ' O ' ' A' ' 144' ' ' ASN . 18.2 Cg_endo -75.03 135.11 18.6 Favored 'Trans proline' 0 C--N 1.36 1.171 0 O-C-N 124.508 1.794 . . . . 0.0 111.04 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.62 ' CZ ' ' HB3' ' A' ' 143' ' ' PHE . 4.8 p90 -157.25 -178.59 7.47 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.469 1.105 . . . . 0.0 110.947 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.93 142.7 50.86 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.501 1.126 . . . . 0.0 109.273 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 4.7 ttpt -48.67 118.83 2.73 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.452 1.095 . . . . 0.0 109.29 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 91.82 42.99 4.6 Favored Glycine 0 CA--C 1.529 0.953 0 O-C-N 124.446 1.091 . . . . 0.0 110.981 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . 0.419 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 17.8 t70 -121.91 171.11 9.16 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.468 0.746 . . . . 0.0 109.271 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.416 ' O ' HD21 ' A' ' 159' ' ' LEU . 2.8 mp -119.62 147.97 22.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.523 1.14 . . . . 0.0 109.279 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.476 ' O ' ' N ' ' A' ' 137' ' ' VAL . 3.4 mt -143.5 139.9 30.04 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.443 1.089 . . . . 0.0 109.237 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.557 ' HD2' ' CE1' ' A' ' 136' ' ' TYR . 8.3 ttt180 -84.59 101.37 12.06 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.564 1.165 . . . . 0.0 110.265 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.483 ' CD1' ' HB1' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -82.91 122.67 37.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 O-C-N 124.511 1.132 . . . . 0.0 109.244 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.24 -26.73 5.81 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.54 1.15 . . . . 0.0 110.293 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.14 154.17 39.0 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.537 1.148 . . . . 0.0 109.32 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.475 ' HB2' ' CE2' ' A' ' 170' ' ' TRP . 5.6 ptpp? -165.85 71.14 1.26 Allowed Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.544 1.152 . . . . 0.0 109.253 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.09 -38.38 1.57 Allowed 'Trans proline' 0 C--N 1.36 1.164 0 O-C-N 124.463 1.77 . . . . 0.0 110.946 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' GLU . . . . . 0.44 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.3 mt-10 -85.58 -177.65 6.47 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.492 1.12 . . . . 0.0 110.277 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -114.1 17.33 17.82 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.416 1.073 . . . . 0.0 110.233 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.453 ' O ' ' N ' ' A' ' 184' ' ' VAL . 33.5 mt-30 -152.13 -40.05 0.11 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.481 1.113 . . . . 0.0 110.288 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' TRP . . . . . 0.449 ' CZ3' ' HB3' ' A' ' 150' ' ' ASP . 73.9 m95 -107.54 111.18 23.33 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' TRP . . . . . 0.535 ' CD2' ' CG2' ' A' ' 184' ' ' VAL . 51.3 m0 -114.84 164.17 14.48 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.552 1.158 . . . . 0.0 108.063 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -102.57 121.76 43.02 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.546 1.153 . . . . 0.0 109.304 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . 0.483 ' HB1' ' CD1' ' A' ' 161' ' ' ILE . . . -141.91 162.3 35.83 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.49 1.119 . . . . 0.0 109.312 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.519 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 2.2 mp0 -96.48 154.41 17.29 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.476 1.11 . . . . 0.0 110.246 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . 0.409 ' HA ' HD21 ' A' ' 159' ' ' LEU . 0.2 OUTLIER -89.13 -162.01 0.82 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.485 1.116 . . . . 0.0 109.268 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 2.4 m -79.18 5.73 11.43 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.47 1.106 . . . . 0.0 109.973 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -123.8 -5.38 8.04 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.466 1.104 . . . . 0.0 110.327 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . 0.501 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 97.48 -6.41 63.13 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.555 1.159 . . . . 0.0 110.969 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . 0.482 ' O ' ' CD1' ' A' ' 151' ' ' LEU . 0.9 OUTLIER -57.26 111.92 1.22 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.478 0.752 . . . . 0.0 109.292 -179.974 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . 0.434 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -87.02 125.57 34.18 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.46 1.1 . . . . 0.0 110.29 179.983 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.407 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -154.75 -173.97 24.2 Favored Glycine 0 CA--C 1.531 1.035 0 O-C-N 124.46 1.1 . . . . 0.0 110.98 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' MET . . . . . 0.45 ' O ' ' CA ' ' A' ' 150' ' ' ASP . 0.0 OUTLIER -96.67 128.06 43.25 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.526 0.78 . . . . 0.0 111.013 179.962 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.64 ' CG2' ' HB3' ' A' ' 151' ' ' LEU . 4.2 pt -128.38 156.65 76.56 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.448 1.093 . . . . 0.0 109.287 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 183' ' ' PRO . . . . . 0.781 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.1 Cg_endo -75.04 132.79 15.77 Favored 'Trans proline' 0 C--N 1.361 1.197 0 O-C-N 124.488 1.783 . . . . 0.0 111.003 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.825 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 39.2 t -78.38 -31.95 0.81 Allowed Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.525 1.141 . . . . 0.0 109.319 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 185' ' ' PRO . . . . . 0.825 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.99 -26.07 11.29 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.467 1.772 . . . . 0.0 110.983 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . 0.781 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 2.9 m-85 -96.58 7.66 46.02 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.488 1.117 . . . . 0.0 110.958 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 187' ' ' VAL . . . . . 0.602 ' HA ' ' O ' ' A' ' 138' ' ' ARG . 3.5 m -135.98 151.98 29.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 O-C-N 124.417 1.073 . . . . 0.0 109.322 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 188' ' ' GLU . . . . . 0.52 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 39.4 tt0 -101.85 153.25 20.0 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.499 1.124 . . . . 0.0 110.264 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 2.3 ptmm? -89.58 111.06 21.89 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.524 1.14 . . . . 0.0 109.272 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -154.56 104.94 2.59 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.444 1.09 . . . . 0.0 111.0 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.967 0 O-C-N 124.494 1.121 . . . . 0.0 111.009 -179.98 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 160' ' ' ARG . 3.6 m . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -150.93 163.35 38.9 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.526 1.141 . . . . 0.0 111.044 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.546 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 13.5 m -144.58 136.21 21.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.517 1.136 . . . . 0.0 109.296 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.497 ' CB ' ' HG2' ' A' ' 188' ' ' GLU . 6.6 ttp180 -103.27 110.9 23.05 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.474 1.108 . . . . 0.0 110.299 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.415 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -81.37 104.64 11.96 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.451 1.095 . . . . 0.0 109.334 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.411 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 1.7 mt -89.59 22.93 2.8 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.503 1.127 . . . . 0.0 109.218 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -140.52 149.7 42.79 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.5 1.125 . . . . 0.0 111.014 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.17 128.92 34.97 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.49 1.119 . . . . 0.0 109.312 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.598 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.4 OUTLIER -143.36 138.63 29.57 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.572 1.17 . . . . 0.0 111.007 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . 0.457 ' C ' ' HB3' ' A' ' 152' ' ' PRO . 2.3 t-20 -115.95 -32.73 5.32 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.463 1.102 . . . . 0.0 109.347 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 158.71 127.18 0.91 Allowed Glycine 0 CA--C 1.531 1.059 0 O-C-N 124.529 1.143 . . . . 0.0 111.011 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -135.98 6.73 3.15 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.565 0.803 . . . . 0.0 109.292 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . 0.534 ' O ' ' CB ' ' A' ' 148' ' ' GLU . 0.2 OUTLIER -133.87 -18.82 2.08 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.53 1.144 . . . . 0.0 109.234 -179.989 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.534 ' CB ' ' O ' ' A' ' 147' ' ' ASP . 1.2 pt-20 88.84 -22.56 0.12 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.42 1.075 . . . . 0.0 110.305 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -125.61 4.89 7.52 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.515 1.135 . . . . 0.0 110.374 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.417 ' HB2' ' O ' ' A' ' 181' ' ' MET . 17.1 p-10 -79.27 159.68 27.16 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 124.437 1.086 . . . . 0.0 109.248 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.491 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 6.4 tp -91.96 113.75 59.95 Favored Pre-proline 0 C--N 1.326 -0.423 0 O-C-N 124.441 1.088 . . . . 0.0 109.309 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . 0.457 ' HB3' ' C ' ' A' ' 144' ' ' ASN . 18.3 Cg_endo -74.99 171.28 18.63 Favored 'Trans proline' 0 C--N 1.36 1.138 0 O-C-N 124.465 1.771 . . . . 0.0 111.04 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.598 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 8.7 p90 -174.08 178.88 2.02 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.433 1.083 . . . . 0.0 111.008 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.62 135.94 54.16 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.53 1.144 . . . . 0.0 109.31 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.3 OUTLIER -42.9 108.07 0.1 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.523 1.139 . . . . 0.0 109.358 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 105.7 34.23 3.35 Favored Glycine 0 CA--C 1.529 0.946 0 O-C-N 124.448 1.093 . . . . 0.0 111.018 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -109.97 176.58 5.01 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.49 0.759 . . . . 0.0 109.308 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.438 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 51.7 mt -131.67 148.25 32.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.483 1.114 . . . . 0.0 109.288 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.49 HD12 ' CG2' ' A' ' 182' ' ' ILE . 2.3 mt -145.01 139.94 27.81 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.512 1.133 . . . . 0.0 109.409 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.494 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 14.0 ttt-85 -86.19 97.12 10.18 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.465 1.103 . . . . 0.0 110.311 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.486 ' HA ' ' CB ' ' A' ' 172' ' ' ALA . 0.0 OUTLIER -82.98 120.66 34.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.512 1.133 . . . . 0.0 109.284 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.11 -22.71 7.67 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.442 1.089 . . . . 0.0 110.373 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -122.05 137.4 54.82 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.458 1.098 . . . . 0.0 109.276 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.52 ' HB2' ' CE2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -147.92 66.95 9.92 Favored Pre-proline 0 C--N 1.325 -0.459 0 O-C-N 124.455 1.097 . . . . 0.0 109.292 179.967 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.0 -38.48 1.57 Allowed 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.523 1.801 . . . . 0.0 111.036 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' GLU . . . . . 0.469 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 8.8 mm-40 -88.08 176.21 7.39 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.469 1.106 . . . . 0.0 110.324 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . 0.443 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 6.7 pt-20 -113.99 47.71 1.17 Allowed 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.524 1.14 . . . . 0.0 110.229 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.443 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 0.2 OUTLIER 174.41 -33.84 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.545 1.153 . . . . 0.0 110.351 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' TRP . . . . . 0.471 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 74.5 m95 -117.07 105.32 12.15 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' TRP . . . . . 0.552 ' CE2' HG21 ' A' ' 184' ' ' VAL . 52.8 m0 -110.27 163.52 13.56 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.481 1.113 . . . . 0.0 107.997 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . 0.553 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -101.78 119.32 38.6 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.394 1.059 . . . . 0.0 109.287 179.985 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . 0.494 ' HA ' ' O ' ' A' ' 160' ' ' ARG . . . -136.78 167.52 21.29 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.53 1.144 . . . . 0.0 109.292 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.722 ' HG3' ' HA2' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -98.32 159.4 14.97 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.475 1.109 . . . . 0.0 110.301 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . 0.678 ' N ' ' HG2' ' A' ' 173' ' ' GLU . 42.8 p-10 -95.85 -157.03 0.55 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.581 1.176 . . . . 0.0 109.309 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 38.3 t -85.66 14.38 5.83 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.567 1.167 . . . . 0.0 110.09 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -136.78 -1.96 2.18 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.546 1.154 . . . . 0.0 110.334 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . 0.722 ' HA2' ' HG3' ' A' ' 173' ' ' GLU . . . 100.03 -17.53 57.03 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 124.531 1.145 . . . . 0.0 111.113 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . 0.452 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 5.3 mttm -49.62 108.28 0.19 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.584 0.814 . . . . 0.0 109.299 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . 0.438 ' HA ' ' HA ' ' A' ' 173' ' ' GLU . 33.4 mtm180 -90.75 127.04 36.19 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.457 1.098 . . . . 0.0 110.305 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.553 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -149.92 -164.13 11.57 Favored Glycine 0 CA--C 1.53 1.012 0 O-C-N 124.488 1.117 . . . . 0.0 110.978 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' MET . . . . . 0.471 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -100.69 126.81 47.24 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.533 0.784 . . . . 0.0 111.021 -179.979 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.491 ' CG2' ' HB3' ' A' ' 151' ' ' LEU . 0.2 OUTLIER -126.43 150.87 71.64 Favored Pre-proline 0 C--N 1.324 -0.506 0 O-C-N 124.554 1.159 . . . . 0.0 109.324 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 183' ' ' PRO . . . . . 0.756 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.1 Cg_endo -75.1 131.34 14.07 Favored 'Trans proline' 0 C--N 1.361 1.194 0 O-C-N 124.496 1.787 . . . . 0.0 111.006 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.839 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 55.3 t -76.18 -31.21 0.96 Allowed Pre-proline 0 C--N 1.325 -0.482 0 O-C-N 124.418 1.074 . . . . 0.0 109.287 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 185' ' ' PRO . . . . . 0.839 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.95 -24.13 13.23 Favored 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.553 1.817 . . . . 0.0 111.005 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . 0.756 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.6 m-85 -96.27 -5.02 41.2 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.463 1.102 . . . . 0.0 110.989 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 187' ' ' VAL . . . . . 0.613 HG23 ' HA ' ' A' ' 184' ' ' VAL . 2.9 m -127.73 153.72 37.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.484 1.115 . . . . 0.0 109.259 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 188' ' ' GLU . . . . . 0.546 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 4.6 pt-20 -105.78 155.59 19.14 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.509 1.13 . . . . 0.0 110.287 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.25 110.0 19.89 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.483 1.114 . . . . 0.0 109.332 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -96.42 -64.7 1.02 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.471 1.107 . . . . 0.0 111.046 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.039 0 O-C-N 124.51 1.131 . . . . 0.0 110.98 -179.985 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . 0.652 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 1.5 p . . . . . 0 N--CA 1.452 -0.335 0 N-CA-C 108.361 -0.978 . . . . 0.0 108.361 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . 0.652 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 0.0 OUTLIER -151.12 177.4 10.23 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.469 1.106 . . . . 0.0 110.999 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.558 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 28.5 m -142.48 155.24 18.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 O-C-N 124.586 1.179 . . . . 0.0 109.289 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.449 ' HA ' ' O ' ' A' ' 157' ' ' ASP . 0.2 OUTLIER -107.84 114.35 28.23 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.466 1.104 . . . . 0.0 110.248 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.523 ' O ' ' N ' ' A' ' 156' ' ' GLY . . . -80.63 110.23 15.91 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.422 1.076 . . . . 0.0 109.263 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.412 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 4.3 mt -88.5 23.79 2.13 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.547 1.154 . . . . 0.0 109.236 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.404 ' O ' ' N ' ' A' ' 155' ' ' LYS . 23.8 t80 -140.58 168.83 18.87 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 124.485 1.116 . . . . 0.0 110.994 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -109.14 122.79 48.06 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.54 1.15 . . . . 0.0 109.325 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.474 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 4.4 t80 -152.84 97.65 2.24 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.508 1.13 . . . . 0.0 111.004 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . 0.456 ' ND2' ' O ' ' A' ' 153' ' ' PHE . 9.7 m-80 -131.71 114.75 15.14 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.503 1.127 . . . . 0.0 109.303 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 81.75 103.7 0.38 Allowed Glycine 0 CA--C 1.53 1.009 0 O-C-N 124.442 1.089 . . . . 0.0 110.999 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . 0.447 ' OD1' ' CZ ' ' A' ' 143' ' ' PHE . 0.4 OUTLIER -151.65 -56.04 0.14 Allowed 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.517 0.775 . . . . 0.0 109.312 179.985 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . 0.414 ' OD1' ' ND2' ' A' ' 146' ' ' ASN . 0.0 OUTLIER -149.69 160.35 43.6 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.543 1.152 . . . . 0.0 109.292 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -79.48 40.37 0.43 Allowed 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.465 1.103 . . . . 0.0 110.273 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . 0.406 ' H ' ' C ' ' A' ' 147' ' ' ASP . 8.2 pt-20 -146.76 -31.05 0.35 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.532 1.145 . . . . 0.0 110.33 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.426 ' OD2' ' CE2' ' A' ' 143' ' ' PHE . 9.6 p-10 -85.25 151.08 24.34 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.44 1.087 . . . . 0.0 109.299 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.517 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 13.7 tp -96.04 128.34 37.54 Favored Pre-proline 0 C--N 1.324 -0.506 0 O-C-N 124.459 1.099 . . . . 0.0 109.318 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . 0.5 ' O ' ' OD2' ' A' ' 174' ' ' ASP . 18.3 Cg_endo -74.96 142.14 27.61 Favored 'Trans proline' 0 C--N 1.359 1.13 0 O-C-N 124.531 1.806 . . . . 0.0 111.048 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.474 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 7.5 p90 -164.92 -180.0 6.12 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.505 1.128 . . . . 0.0 111.036 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . 0.423 ' O ' ' C ' ' A' ' 155' ' ' LYS . 1.8 ttmt -135.76 144.17 45.67 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.489 1.118 . . . . 0.0 109.277 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . 0.423 ' C ' ' O ' ' A' ' 154' ' ' LYS . 2.8 tmpt? -38.32 135.49 0.74 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.473 1.108 . . . . 0.0 109.331 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 76.63 31.69 53.17 Favored Glycine 0 CA--C 1.529 0.912 0 O-C-N 124.433 1.083 . . . . 0.0 111.029 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . 0.449 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 6.6 t70 -105.47 165.99 10.75 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.48 0.753 . . . . 0.0 109.293 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.486 ' C ' ' HG ' ' A' ' 159' ' ' LEU . 18.7 mm -121.32 147.6 25.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.51 1.131 . . . . 0.0 109.328 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.525 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 0.6 OUTLIER -145.48 133.85 21.84 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.469 1.105 . . . . 0.0 109.33 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.479 ' HB3' ' HB2' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -87.62 105.08 17.1 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.575 1.172 . . . . 0.0 110.328 -179.983 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.464 ' HA ' ' CB ' ' A' ' 172' ' ' ALA . 0.0 OUTLIER -83.47 129.23 37.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.567 1.167 . . . . 0.0 109.289 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . 0.43 ' HB3' ' OD1' ' A' ' 163' ' ' ASP . 4.7 ttt-85 -124.05 -22.11 4.9 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.513 1.133 . . . . 0.0 110.257 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' ASP . . . . . 0.59 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -138.26 158.3 44.56 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.489 1.118 . . . . 0.0 109.245 -179.952 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.553 ' HB2' ' CG ' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -155.19 76.14 5.2 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.466 1.103 . . . . 0.0 109.303 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.03 -1.17 10.88 Favored 'Trans proline' 0 C--N 1.361 1.213 0 O-C-N 124.534 1.808 . . . . 0.0 110.999 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' GLU . . . . . 0.481 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.1 mt-10 -128.03 171.9 11.44 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.492 1.12 . . . . 0.0 110.301 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -100.24 14.99 29.06 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.53 1.144 . . . . 0.0 110.261 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.444 ' O ' ' N ' ' A' ' 184' ' ' VAL . 8.6 mt-30 -155.31 -45.73 0.08 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.449 1.093 . . . . 0.0 110.291 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' TRP . . . . . 0.432 ' O ' ' CE ' ' A' ' 181' ' ' MET . 91.1 m95 -98.32 103.17 15.09 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' TRP . . . . . 0.577 ' CD2' HG21 ' A' ' 184' ' ' VAL . 36.0 m0 -107.91 154.7 21.22 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.977 -1.119 . . . . 0.0 107.977 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . 0.445 ' HB3' ' OD2' ' A' ' 163' ' ' ASP . 1.2 t-20 -88.05 116.17 26.04 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.514 1.134 . . . . 0.0 109.294 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . 0.464 ' CB ' ' HA ' ' A' ' 161' ' ' ILE . . . -137.37 160.24 39.64 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.511 1.132 . . . . 0.0 109.216 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.557 ' CD ' ' CG ' ' A' ' 179' ' ' ARG . 2.6 mp0 -89.17 156.31 18.87 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.496 1.123 . . . . 0.0 110.279 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . 0.5 ' OD2' ' O ' ' A' ' 152' ' ' PRO . 0.4 OUTLIER -90.73 -162.07 0.87 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.478 1.111 . . . . 0.0 109.343 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 4.1 m -80.74 9.54 6.12 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.549 1.156 . . . . 0.0 109.996 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -132.04 -5.97 3.5 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.523 1.14 . . . . 0.0 110.338 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . 0.502 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 103.69 -10.4 52.88 Favored Glycine 0 CA--C 1.53 0.979 0 O-C-N 124.557 1.161 . . . . 0.0 111.011 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . 0.435 ' O ' ' CD1' ' A' ' 151' ' ' LEU . 1.2 mttt -53.89 114.19 1.49 Allowed 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.478 0.752 . . . . 0.0 109.319 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . 0.557 ' CG ' ' CD ' ' A' ' 173' ' ' GLU . 5.6 mtm105 -88.07 126.58 35.18 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.48 1.113 . . . . 0.0 110.281 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.442 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -155.53 -172.42 23.09 Favored Glycine 0 CA--C 1.53 0.999 0 O-C-N 124.53 1.144 . . . . 0.0 111.043 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' MET . . . . . 0.432 ' CE ' ' O ' ' A' ' 169' ' ' TRP . 84.5 mmm -99.94 117.87 35.16 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.506 0.768 . . . . 0.0 111.009 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.517 ' CG2' ' HB3' ' A' ' 151' ' ' LEU . 1.1 pt -117.96 151.28 48.68 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.494 1.121 . . . . 0.0 109.337 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 183' ' ' PRO . . . . . 0.778 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -74.9 131.02 13.94 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.58 1.832 . . . . 0.0 110.987 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.84 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 4.0 t -76.76 -30.72 0.85 Allowed Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.522 1.139 . . . . 0.0 109.251 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 185' ' ' PRO . . . . . 0.84 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -75.03 -22.42 14.78 Favored 'Trans proline' 0 C--N 1.36 1.137 0 O-C-N 124.503 1.791 . . . . 0.0 111.013 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . 0.778 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 11.6 m-85 -97.67 -4.89 36.47 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.443 1.089 . . . . 0.0 111.007 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 187' ' ' VAL . . . . . 0.469 HG12 ' CB ' ' A' ' 139' ' ' ALA . 4.0 m -127.3 151.31 33.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.556 1.16 . . . . 0.0 109.343 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 188' ' ' GLU . . . . . 0.558 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 2.4 mt-10 -101.84 144.42 30.52 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.468 1.105 . . . . 0.0 110.278 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.24 109.0 19.19 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.541 1.151 . . . . 0.0 109.27 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . 0.6 ' HB3' ' CD1' ' A' ' 136' ' ' TYR . 2.2 t80 -100.54 -25.92 14.02 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.51 1.131 . . . . 0.0 111.002 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 191' ' ' GLY . . . . . 0.623 ' O ' ' CE1' ' A' ' 136' ' ' TYR . . . . . . . . 0 CA--C 1.53 1.007 0 O-C-N 124.41 1.069 . . . . 0.0 111.018 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . 0.424 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 7.5 p . . . . . 0 N--CA 1.452 -0.35 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . 0.424 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 10.5 m-85 -150.88 167.17 28.34 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.463 1.102 . . . . 0.0 111.017 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.543 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 6.2 m -142.38 133.29 24.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.522 1.139 . . . . 0.0 109.306 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.493 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 23.6 ttp85 -101.57 110.18 22.12 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.509 1.131 . . . . 0.0 110.329 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.498 ' CB ' HG12 ' A' ' 187' ' ' VAL . . . -81.46 109.27 15.77 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.465 1.103 . . . . 0.0 109.317 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.431 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 5.2 mp -89.44 23.3 2.61 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.526 1.141 . . . . 0.0 109.347 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.421 ' O ' ' HA ' ' A' ' 155' ' ' LYS . 21.1 t80 -140.95 165.32 27.85 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.457 1.098 . . . . 0.0 110.972 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.81 127.52 53.15 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.518 1.136 . . . . 0.0 109.286 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.644 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 64.2 t80 -140.3 131.18 26.01 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.479 1.112 . . . . 0.0 110.968 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -138.88 126.73 22.23 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.56 1.163 . . . . 0.0 109.295 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . 0.458 ' O ' ' ND2' ' A' ' 146' ' ' ASN . . . -146.81 -131.61 2.22 Favored Glycine 0 CA--C 1.529 0.942 0 O-C-N 124.457 1.098 . . . . 0.0 111.006 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . 0.458 ' ND2' ' O ' ' A' ' 145' ' ' GLY . 3.9 p30 160.48 74.85 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.399 0.705 . . . . 0.0 109.316 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . 0.484 ' C ' ' H ' ' A' ' 149' ' ' GLU . 9.9 t70 -144.53 154.92 43.39 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.473 1.108 . . . . 0.0 109.305 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -77.65 25.19 0.2 Allowed 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.541 1.151 . . . . 0.0 110.332 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . 0.484 ' H ' ' C ' ' A' ' 147' ' ' ASP . 4.5 mt-10 -153.64 18.71 0.53 Allowed 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.469 1.106 . . . . 0.0 110.328 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.468 ' OD2' ' CB ' ' A' ' 147' ' ' ASP . 24.4 p30 -139.38 153.49 47.67 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.445 1.091 . . . . 0.0 109.239 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.518 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 13.8 tp -131.26 112.22 15.56 Favored Pre-proline 0 C--N 1.326 -0.451 0 O-C-N 124.449 1.093 . . . . 0.0 109.262 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.04 154.62 42.43 Favored 'Trans proline' 0 C--N 1.359 1.125 0 O-C-N 124.506 1.793 . . . . 0.0 111.062 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.644 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 4.8 p90 -164.69 -177.55 4.83 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.555 1.16 . . . . 0.0 111.043 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.43 138.44 51.46 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.538 1.149 . . . . 0.0 109.253 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -45.97 117.67 1.6 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.474 1.109 . . . . 0.0 109.283 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 96.48 35.42 5.45 Favored Glycine 0 CA--C 1.529 0.939 0 O-C-N 124.517 1.135 . . . . 0.0 110.985 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -113.86 173.23 6.53 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.508 0.769 . . . . 0.0 109.298 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.45 ' C ' ' HG ' ' A' ' 159' ' ' LEU . 24.1 mt -127.62 149.85 32.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.43 1.081 . . . . 0.0 109.328 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.564 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 0.2 OUTLIER -143.33 139.46 30.1 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.563 1.164 . . . . 0.0 109.283 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.442 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 8.4 ttp180 -87.51 107.06 18.4 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.504 1.127 . . . . 0.0 110.324 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.532 HD13 ' CB ' ' A' ' 172' ' ' ALA . 10.6 tp -84.45 128.17 39.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.445 1.091 . . . . 0.0 109.325 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.9 ttt180 -128.32 -24.29 3.12 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.506 1.129 . . . . 0.0 110.313 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' ASP . . . . . 0.413 ' O ' HD12 ' A' ' 161' ' ' ILE . 1.2 m-20 -127.07 151.93 47.96 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.515 1.134 . . . . 0.0 109.244 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.549 ' HG3' ' CE2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -147.67 80.25 9.07 Favored Pre-proline 0 C--N 1.326 -0.455 0 O-C-N 124.48 1.112 . . . . 0.0 109.289 179.998 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 -45.91 0.26 Allowed 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.499 1.789 . . . . 0.0 110.99 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' GLU . . . . . . . . . . . . . 62.6 mm-40 -93.11 -173.2 3.19 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.484 1.115 . . . . 0.0 110.305 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -108.16 -11.39 15.27 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.471 1.107 . . . . 0.0 110.261 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -123.64 -32.52 3.33 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.533 1.146 . . . . 0.0 110.306 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -110.51 112.93 25.17 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.562 1.164 . . . . 0.0 107.977 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' TRP . . . . . 0.644 ' CD2' ' CG2' ' A' ' 184' ' ' VAL . 45.9 m0 -112.69 159.35 19.0 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.527 1.142 . . . . 0.0 107.992 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . 0.475 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 1.5 t30 -94.65 115.16 27.21 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.507 1.129 . . . . 0.0 109.3 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . 0.532 ' CB ' HD13 ' A' ' 161' ' ' ILE . . . -136.58 164.86 27.21 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.521 1.138 . . . . 0.0 109.292 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.564 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 6.5 mp0 -97.77 153.85 18.0 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.518 1.136 . . . . 0.0 110.295 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.97 -161.5 0.64 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.541 1.15 . . . . 0.0 109.305 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 1.5 t -81.27 11.93 3.94 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.505 1.128 . . . . 0.0 110.057 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -133.56 -4.53 2.93 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.505 1.128 . . . . 0.0 110.226 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . 0.537 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 103.63 -15.3 53.11 Favored Glycine 0 CA--C 1.531 1.07 0 O-C-N 124.504 1.128 . . . . 0.0 110.994 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 2.2 mtpt -46.74 109.04 0.16 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.595 0.82 . . . . 0.0 109.358 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -89.21 123.5 33.5 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.533 1.146 . . . . 0.0 110.281 -179.946 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.492 ' HA3' ' HB2' ' A' ' 151' ' ' LEU . . . -154.57 -164.08 12.57 Favored Glycine 0 CA--C 1.53 0.982 0 O-C-N 124.5 1.125 . . . . 0.0 111.0 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' MET . . . . . 0.403 ' HB2' ' O ' ' A' ' 149' ' ' GLU . 1.0 OUTLIER -103.18 123.83 47.45 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.521 0.777 . . . . 0.0 111.002 179.971 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.571 ' N ' HD12 ' A' ' 182' ' ' ILE . 0.1 OUTLIER -122.7 152.19 61.66 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.506 1.129 . . . . 0.0 109.315 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 183' ' ' PRO . . . . . 0.742 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.01 129.82 12.69 Favored 'Trans proline' 0 C--N 1.358 1.065 0 O-C-N 124.571 1.827 . . . . 0.0 110.95 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.822 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 3.6 t -76.29 -32.24 1.07 Allowed Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.407 1.067 . . . . 0.0 109.203 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 185' ' ' PRO . . . . . 0.822 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -75.1 -24.19 12.9 Favored 'Trans proline' 0 C--N 1.359 1.095 0 O-C-N 124.519 1.8 . . . . 0.0 111.012 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . 0.742 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 9.1 m-85 -96.54 -1.41 47.16 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.53 1.144 . . . . 0.0 111.057 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 187' ' ' VAL . . . . . 0.508 HG21 ' HA ' ' A' ' 184' ' ' VAL . 9.4 m -128.57 152.36 36.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 O-C-N 124.575 1.172 . . . . 0.0 109.313 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 188' ' ' GLU . . . . . 0.543 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 2.2 tt0 -97.8 151.76 19.86 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.421 1.076 . . . . 0.0 110.404 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.47 106.22 17.83 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.552 1.157 . . . . 0.0 109.305 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -85.36 -52.18 6.05 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.494 1.121 . . . . 0.0 110.992 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.005 0 O-C-N 124.565 1.166 . . . . 0.0 111.003 179.975 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . 0.437 ' O ' ' HG2' ' A' ' 160' ' ' ARG . 67.7 m . . . . . 0 N--CA 1.453 -0.318 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . 0.413 ' N ' ' C ' ' A' ' 191' ' ' GLY . 41.5 m-85 -156.35 167.0 31.78 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.509 1.131 . . . . 0.0 110.937 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.485 ' CG2' HG22 ' A' ' 187' ' ' VAL . 0.5 OUTLIER -148.67 167.17 3.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.511 1.132 . . . . 0.0 109.282 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.465 ' N ' ' CG2' ' A' ' 137' ' ' VAL . 0.1 OUTLIER -128.41 117.03 20.67 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.47 1.106 . . . . 0.0 110.282 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.462 ' CB ' HG11 ' A' ' 187' ' ' VAL . . . -84.78 109.78 18.32 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.443 1.089 . . . . 0.0 109.304 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.402 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 1.4 mt -89.47 26.12 1.78 Allowed 'General case' 0 C--N 1.323 -0.55 0 O-C-N 124.544 1.153 . . . . 0.0 109.284 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.503 ' CD2' ' CD2' ' A' ' 186' ' ' TYR . 41.1 m-85 -144.3 150.43 37.86 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.489 1.118 . . . . 0.0 111.007 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -94.14 127.02 39.71 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.483 1.114 . . . . 0.0 109.286 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.592 ' CB ' ' CE1' ' A' ' 153' ' ' PHE . 5.0 t80 -142.81 130.66 21.61 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.41 1.069 . . . . 0.0 110.962 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -139.14 88.04 2.25 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.456 1.098 . . . . 0.0 109.329 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . 0.507 ' O ' ' CB ' ' A' ' 146' ' ' ASN . . . -116.19 -130.92 4.68 Favored Glycine 0 CA--C 1.53 1.024 0 O-C-N 124.468 1.105 . . . . 0.0 110.987 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . 0.507 ' CB ' ' O ' ' A' ' 145' ' ' GLY . 4.6 m-20 154.12 82.89 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.482 0.754 . . . . 0.0 109.274 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -132.98 163.31 29.48 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.481 1.113 . . . . 0.0 109.326 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -62.89 -13.26 32.07 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.502 1.126 . . . . 0.0 110.241 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . 0.426 ' O ' ' HB2' ' A' ' 181' ' ' MET . 17.4 mt-10 -141.27 49.09 1.65 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.564 1.165 . . . . 0.0 110.314 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.408 ' OD1' ' CZ ' ' A' ' 143' ' ' PHE . 1.4 t0 -147.07 149.69 33.56 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.439 1.087 . . . . 0.0 109.277 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.437 ' HB2' ' HA3' ' A' ' 180' ' ' GLY . 14.8 tp -134.44 118.2 13.62 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.522 1.139 . . . . 0.0 109.29 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.11 162.63 36.55 Favored 'Trans proline' 0 C--N 1.36 1.138 0 O-C-N 124.54 1.81 . . . . 0.0 110.98 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.592 ' CE1' ' CB ' ' A' ' 143' ' ' PHE . 8.2 p90 -175.48 178.89 1.55 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.513 1.133 . . . . 0.0 111.003 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . 0.426 ' HD3' ' N ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -123.29 143.71 49.89 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.602 1.189 . . . . 0.0 109.242 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . 0.426 ' N ' ' HD3' ' A' ' 154' ' ' LYS . 2.6 ttpt -53.72 114.23 1.48 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.44 1.088 . . . . 0.0 109.256 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 99.35 30.01 6.81 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.488 1.117 . . . . 0.0 111.035 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -107.3 174.41 5.9 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.451 0.736 . . . . 0.0 109.365 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.48 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 32.7 mt -121.32 155.95 25.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 O-C-N 124.482 1.114 . . . . 0.0 109.308 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.484 HD11 ' CG2' ' A' ' 182' ' ' ILE . 3.2 mt -144.76 148.35 34.01 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.475 1.11 . . . . 0.0 109.289 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.504 ' C ' ' HB1' ' A' ' 172' ' ' ALA . 0.3 OUTLIER -99.63 107.86 20.1 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.482 1.114 . . . . 0.0 110.291 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.497 HG12 ' CB ' ' A' ' 172' ' ' ALA . 1.6 mm -79.83 130.5 35.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.468 1.105 . . . . 0.0 109.292 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.6 ttt-85 -128.23 -25.5 2.97 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.494 1.121 . . . . 0.0 110.309 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -141.73 158.15 44.17 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.504 1.128 . . . . 0.0 109.285 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.56 ' HB3' ' CD1' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -142.4 77.58 17.34 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.554 1.158 . . . . 0.0 109.277 179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 -2.71 12.89 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.454 1.765 . . . . 0.0 110.981 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 169' ' ' TRP . 11.9 mt-10 -144.6 -171.76 3.67 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.503 1.127 . . . . 0.0 110.359 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -113.38 -16.84 12.4 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.466 1.104 . . . . 0.0 110.275 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.408 ' CD ' ' N ' ' A' ' 168' ' ' GLN . 4.0 mp0 -116.88 -24.59 7.58 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.491 1.12 . . . . 0.0 110.247 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' TRP . . . . . 0.418 ' O ' ' HB2' ' A' ' 166' ' ' GLU . 85.9 m95 -125.37 105.58 9.2 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.551 1.157 . . . . 0.0 107.959 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' TRP . . . . . 0.579 ' CE3' HG23 ' A' ' 184' ' ' VAL . 34.4 m0 -103.19 164.36 11.68 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.503 1.127 . . . . 0.0 107.997 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . 0.413 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.8 OUTLIER -99.39 97.48 8.52 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.448 1.092 . . . . 0.0 109.26 -179.949 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . 0.504 ' HB1' ' C ' ' A' ' 160' ' ' ARG . . . -124.39 166.87 15.21 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.468 1.105 . . . . 0.0 109.302 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.528 ' CG ' ' O ' ' A' ' 177' ' ' GLY . 0.8 OUTLIER -96.07 159.17 15.1 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.468 1.105 . . . . 0.0 110.298 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . 0.464 ' HA ' ' CD2' ' A' ' 159' ' ' LEU . 0.4 OUTLIER -90.28 -160.39 0.69 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.464 1.102 . . . . 0.0 109.249 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 2.5 m -81.24 8.35 9.19 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.505 1.128 . . . . 0.0 109.985 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -128.08 -5.61 5.54 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.491 1.119 . . . . 0.0 110.341 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . 0.528 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 101.06 -9.47 58.02 Favored Glycine 0 CA--C 1.53 0.994 0 O-C-N 124.472 1.108 . . . . 0.0 111.023 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . 0.419 ' O ' ' HA ' ' A' ' 173' ' ' GLU . 4.7 mtmt -53.74 111.8 0.8 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.469 0.746 . . . . 0.0 109.3 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . 0.444 ' CG ' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.61 122.31 30.35 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.476 1.11 . . . . 0.0 110.238 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.437 ' HA3' ' HB2' ' A' ' 151' ' ' LEU . . . -155.33 -164.98 13.63 Favored Glycine 0 CA--C 1.529 0.93 0 O-C-N 124.478 1.111 . . . . 0.0 111.023 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' MET . . . . . 0.426 ' HB2' ' O ' ' A' ' 149' ' ' GLU . 1.1 mmt -94.55 122.87 37.58 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.488 0.758 . . . . 0.0 110.983 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.484 ' CG2' HD11 ' A' ' 159' ' ' LEU . 18.0 pt -116.29 141.96 28.65 Favored Pre-proline 0 C--N 1.326 -0.454 0 O-C-N 124.495 1.122 . . . . 0.0 109.294 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 183' ' ' PRO . . . . . 0.643 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -74.99 126.64 10.1 Favored 'Trans proline' 0 C--N 1.36 1.132 0 O-C-N 124.472 1.775 . . . . 0.0 111.044 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.819 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 90.6 t -74.08 -31.21 1.24 Allowed Pre-proline 0 C--N 1.325 -0.491 0 O-C-N 124.541 1.151 . . . . 0.0 109.276 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 185' ' ' PRO . . . . . 0.819 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -75.01 -28.17 9.38 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.493 1.786 . . . . 0.0 111.023 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . 0.643 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.9 m-85 -98.07 2.86 49.18 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.532 1.145 . . . . 0.0 110.938 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 187' ' ' VAL . . . . . 0.593 ' CG1' ' O ' ' A' ' 183' ' ' PRO . 2.4 m -136.12 162.46 36.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.548 1.155 . . . . 0.0 109.29 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 188' ' ' GLU . . . . . 0.407 ' N ' ' O ' ' A' ' 138' ' ' ARG . 0.1 OUTLIER -116.35 155.3 28.7 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.505 1.128 . . . . 0.0 110.254 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.77 110.77 20.72 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.554 1.159 . . . . 0.0 109.316 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -93.82 -47.46 6.74 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.52 1.138 . . . . 0.0 110.99 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 191' ' ' GLY . . . . . 0.413 ' C ' ' N ' ' A' ' 136' ' ' TYR . . . . . . . . 0 CA--C 1.53 1.02 0 O-C-N 124.494 1.121 . . . . 0.0 111.055 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . 0.577 ' HB3' ' CD2' ' A' ' 136' ' ' TYR . 0.5 OUTLIER . . . . . 0 N--CA 1.452 -0.333 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . 0.577 ' CD2' ' HB3' ' A' ' 135' ' ' CYS . 0.4 OUTLIER -143.82 169.52 17.63 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.549 1.156 . . . . 0.0 110.971 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.46 ' O ' ' HA ' ' A' ' 158' ' ' ILE . 33.3 m -140.3 161.83 24.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.475 1.109 . . . . 0.0 109.269 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.411 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 30.5 ttm180 -118.35 113.69 21.8 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.563 1.165 . . . . 0.0 110.247 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.539 ' O ' ' N ' ' A' ' 156' ' ' GLY . . . -82.52 112.31 19.32 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.498 1.123 . . . . 0.0 109.282 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.442 ' C ' HD23 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -87.68 21.05 2.71 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.531 1.144 . . . . 0.0 109.229 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.411 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -147.47 164.05 34.59 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.464 1.103 . . . . 0.0 110.996 179.96 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -102.78 156.79 17.4 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.542 1.151 . . . . 0.0 109.309 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.651 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 20.6 t80 -177.5 139.57 0.25 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.535 1.147 . . . . 0.0 110.969 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . 0.401 ' HA ' ' HB3' ' A' ' 152' ' ' PRO . 3.8 p-10 -112.07 -52.23 2.8 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.584 1.177 . . . . 0.0 109.327 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . 0.537 ' O ' ' CB ' ' A' ' 146' ' ' ASN . . . 77.47 -76.4 1.69 Allowed Glycine 0 CA--C 1.53 0.985 0 O-C-N 124.563 1.164 . . . . 0.0 111.023 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . 0.552 ' O ' ' CB ' ' A' ' 147' ' ' ASP . 3.8 m-20 152.76 -17.07 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.475 0.75 . . . . 0.0 109.275 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . 0.552 ' CB ' ' O ' ' A' ' 146' ' ' ASN . 0.6 OUTLIER 86.67 -162.89 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.555 1.159 . . . . 0.0 109.34 -179.93 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.446 ' C ' ' O ' ' A' ' 147' ' ' ASP . 8.0 tt0 35.2 38.56 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.566 1.166 . . . . 0.0 110.318 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 168.3 -25.68 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.457 1.098 . . . . 0.0 110.343 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.414 ' O ' ' HA ' ' A' ' 147' ' ' ASP . 2.8 m-20 -146.54 167.77 22.88 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.469 1.105 . . . . 0.0 109.313 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.508 ' CD2' ' O ' ' A' ' 172' ' ' ALA . 14.5 tp -112.65 118.39 45.18 Favored Pre-proline 0 C--N 1.325 -0.459 0 O-C-N 124.527 1.142 . . . . 0.0 109.318 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . 0.441 ' HG3' ' OD1' ' A' ' 147' ' ' ASP . 18.3 Cg_endo -75.03 145.5 31.4 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.481 1.779 . . . . 0.0 110.975 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.651 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 5.9 p90 -157.5 -177.67 6.76 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.526 1.141 . . . . 0.0 110.999 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.29 140.06 43.11 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.525 1.141 . . . . 0.0 109.285 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 1.0 OUTLIER -43.61 131.13 5.25 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.493 1.12 . . . . 0.0 109.352 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.539 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 78.84 39.72 19.74 Favored Glycine 0 CA--C 1.53 0.997 0 O-C-N 124.548 1.155 . . . . 0.0 111.036 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -116.98 165.66 13.09 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.487 0.757 . . . . 0.0 109.292 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.46 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 11.2 mm -116.9 147.81 20.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.553 1.158 . . . . 0.0 109.327 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.506 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 0.9 OUTLIER -141.84 138.1 31.92 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.434 1.084 . . . . 0.0 109.34 179.972 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.0 OUTLIER -87.45 102.25 14.37 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.477 1.11 . . . . 0.0 110.352 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.493 ' CA ' ' HB2' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -84.86 123.28 39.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.494 1.121 . . . . 0.0 109.279 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -122.77 -22.89 5.2 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.501 1.125 . . . . 0.0 110.273 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -131.31 152.55 50.46 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.491 1.12 . . . . 0.0 109.265 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.575 ' CB ' ' CG ' ' A' ' 170' ' ' TRP . 3.4 pttp -160.15 66.63 2.62 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 124.519 1.137 . . . . 0.0 109.276 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -75.05 4.26 4.92 Favored 'Trans proline' 0 C--N 1.361 1.191 0 O-C-N 124.445 1.761 . . . . 0.0 110.935 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' GLU . . . . . 0.474 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 9.2 mt-10 -127.65 177.92 6.47 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.567 1.167 . . . . 0.0 110.272 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . 0.505 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 7.3 pt-20 -112.61 33.53 4.9 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.459 1.099 . . . . 0.0 110.302 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.505 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 3.4 mt-30 -175.66 -37.99 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.523 1.14 . . . . 0.0 110.309 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -108.43 100.22 9.53 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.554 1.159 . . . . 0.0 107.983 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' TRP . . . . . 0.575 ' CG ' ' CB ' ' A' ' 164' ' ' LYS . 37.3 m0 -108.15 153.75 22.71 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.518 1.136 . . . . 0.0 108.013 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . 0.427 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 2.8 t30 -88.04 110.23 20.45 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.475 1.11 . . . . 0.0 109.27 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . 0.508 ' O ' ' CD2' ' A' ' 151' ' ' LEU . . . -130.37 159.58 36.56 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.529 1.143 . . . . 0.0 109.385 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.521 ' CG ' ' O ' ' A' ' 177' ' ' GLY . 0.8 OUTLIER -92.26 156.79 17.04 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.458 1.099 . . . . 0.0 110.292 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . 0.461 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.5 OUTLIER -91.08 -160.32 0.71 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.498 1.124 . . . . 0.0 109.335 179.968 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.94 8.45 8.35 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.525 1.141 . . . . 0.0 110.004 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -128.66 -5.07 5.23 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.466 1.104 . . . . 0.0 110.287 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . 0.521 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 100.16 -11.01 60.23 Favored Glycine 0 CA--C 1.53 0.999 0 O-C-N 124.449 1.093 . . . . 0.0 111.05 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . 0.41 ' O ' HD21 ' A' ' 151' ' ' LEU . 10.7 mttp -52.6 111.75 0.7 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.583 0.813 . . . . 0.0 109.293 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -87.19 124.28 33.12 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.523 1.14 . . . . 0.0 110.282 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.427 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -155.13 -168.05 17.73 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.51 1.131 . . . . 0.0 110.906 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -89.19 122.13 32.17 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.441 0.73 . . . . 0.0 111.095 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.522 ' CG2' HG13 ' A' ' 187' ' ' VAL . 62.0 mt -121.29 143.07 36.56 Favored Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.476 1.11 . . . . 0.0 109.265 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 183' ' ' PRO . . . . . 0.607 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.0 Cg_endo -75.1 133.12 16.06 Favored 'Trans proline' 0 C--N 1.361 1.193 0 O-C-N 124.466 1.772 . . . . 0.0 110.928 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.828 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 42.2 t -80.09 -31.82 0.67 Allowed Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.508 1.13 . . . . 0.0 109.295 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 185' ' ' PRO . . . . . 0.828 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -75.03 -28.14 9.36 Favored 'Trans proline' 0 C--N 1.361 1.208 0 O-C-N 124.443 1.759 . . . . 0.0 110.989 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . 0.607 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 9.7 m-85 -96.9 12.29 32.83 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.418 1.074 . . . . 0.0 111.067 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 187' ' ' VAL . . . . . 0.529 HG11 ' CB ' ' A' ' 139' ' ' ALA . 1.7 m -149.55 149.97 14.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.55 1.156 . . . . 0.0 109.257 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 188' ' ' GLU . . . . . 0.455 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.6 OUTLIER -98.36 138.22 35.92 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.48 1.113 . . . . 0.0 110.318 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -86.65 103.64 15.32 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.513 1.133 . . . . 0.0 109.283 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . 0.457 ' HB3' ' CD1' ' A' ' 136' ' ' TYR . 1.2 t80 -87.72 -36.61 17.27 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.526 1.141 . . . . 0.0 110.979 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.024 0 O-C-N 124.514 1.134 . . . . 0.0 111.02 179.951 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . 0.418 ' SG ' ' O ' ' A' ' 191' ' ' GLY . 26.3 p . . . . . 0 N--CA 1.453 -0.312 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . 0.491 ' CE1' ' HB2' ' A' ' 160' ' ' ARG . 5.6 m-85 -155.48 171.69 19.5 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.608 1.193 . . . . 0.0 110.995 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.532 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 3.3 m -145.27 144.4 21.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.501 1.126 . . . . 0.0 109.327 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.497 ' O ' ' CD1' ' A' ' 140' ' ' LEU . 0.4 OUTLIER -106.31 112.91 26.13 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.543 1.152 . . . . 0.0 110.332 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.454 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -83.27 105.45 14.24 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.474 1.108 . . . . 0.0 109.276 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.527 ' C ' ' HG2' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -88.3 26.98 1.31 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.513 1.133 . . . . 0.0 109.236 179.974 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.401 ' CA ' ' HG2' ' A' ' 155' ' ' LYS . 6.4 m-85 -144.58 157.2 44.32 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.511 1.132 . . . . 0.0 110.993 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -93.28 130.89 38.84 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.513 1.133 . . . . 0.0 109.282 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.613 ' HB2' ' CZ ' ' A' ' 153' ' ' PHE . 35.5 t80 -142.26 133.36 26.04 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.518 1.136 . . . . 0.0 110.981 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . 0.421 ' HA ' ' HB3' ' A' ' 152' ' ' PRO . 53.6 t-20 -159.15 109.5 1.99 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.545 1.153 . . . . 0.0 109.243 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 87.67 135.11 4.62 Favored Glycine 0 CA--C 1.53 0.984 0 O-C-N 124.492 1.12 . . . . 0.0 111.0 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . 0.505 ' HB2' ' CZ ' ' A' ' 143' ' ' PHE . 2.7 t30 -179.4 -52.56 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.471 0.748 . . . . 0.0 109.267 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . 0.449 ' CG ' ' HB3' ' A' ' 150' ' ' ASP . 0.0 OUTLIER -149.32 -175.19 4.89 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.506 1.129 . . . . 0.0 109.35 -179.95 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -83.54 -25.85 30.63 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.485 1.116 . . . . 0.0 110.312 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -110.83 23.49 14.11 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.442 1.089 . . . . 0.0 110.302 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.449 ' HB3' ' CG ' ' A' ' 147' ' ' ASP . 0.0 OUTLIER -85.73 151.5 23.8 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.533 1.146 . . . . 0.0 109.294 179.947 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.596 ' CD2' ' CG2' ' A' ' 182' ' ' ILE . 12.2 tp -110.8 101.76 50.37 Favored Pre-proline 0 C--N 1.326 -0.446 0 O-C-N 124.526 1.141 . . . . 0.0 109.272 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . 0.421 ' HB3' ' HA ' ' A' ' 144' ' ' ASN . 18.1 Cg_endo -75.03 150.24 37.72 Favored 'Trans proline' 0 C--N 1.361 1.191 0 O-C-N 124.503 1.791 . . . . 0.0 110.98 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.613 ' CZ ' ' HB2' ' A' ' 143' ' ' PHE . 21.1 p90 -160.45 178.45 9.55 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.51 1.131 . . . . 0.0 110.937 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . 0.415 ' O ' ' C ' ' A' ' 155' ' ' LYS . 1.1 ttpp -126.28 143.5 51.13 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.545 1.153 . . . . 0.0 109.319 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . 0.527 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.1 OUTLIER -39.27 128.21 1.77 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.429 1.08 . . . . 0.0 109.267 -180.0 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.475 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 79.6 40.8 14.27 Favored Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.578 1.174 . . . . 0.0 111.033 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . 0.5 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 5.0 t70 -111.48 162.41 15.13 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.6 0.824 . . . . 0.0 109.277 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.452 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 75.7 mt -120.39 146.69 24.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.454 1.096 . . . . 0.0 109.271 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.556 ' HB3' ' O ' ' A' ' 173' ' ' GLU . 0.9 OUTLIER -141.53 141.85 33.56 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.538 1.149 . . . . 0.0 109.342 179.978 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.491 ' HB2' ' CE1' ' A' ' 136' ' ' TYR . 9.8 ttm-85 -93.48 102.14 14.35 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.553 1.158 . . . . 0.0 110.319 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.54 ' HA ' ' CB ' ' A' ' 172' ' ' ALA . 0.7 OUTLIER -82.13 125.53 39.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 O-C-N 124.599 1.187 . . . . 0.0 109.278 -179.982 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -121.11 -22.25 6.17 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 124.446 1.091 . . . . 0.0 110.254 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -134.0 144.53 48.78 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.597 1.186 . . . . 0.0 109.268 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.551 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -141.09 80.73 16.66 Favored Pre-proline 0 C--N 1.325 -0.483 0 O-C-N 124.503 1.127 . . . . 0.0 109.317 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.06 -50.35 0.13 Allowed 'Trans proline' 0 C--N 1.359 1.104 0 O-C-N 124.514 1.797 . . . . 0.0 110.929 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' GLU . . . . . 0.425 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 2.0 mt-10 -82.23 179.62 7.74 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 0.0 110.299 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -104.84 9.37 34.82 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.542 1.152 . . . . 0.0 110.284 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -146.55 -42.59 0.19 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.507 1.129 . . . . 0.0 110.279 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' TRP . . . . . 0.411 ' HH2' ' CZ ' ' A' ' 143' ' ' PHE . 68.2 m95 -103.61 111.39 23.85 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.487 1.117 . . . . 0.0 108.002 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' TRP . . . . . 0.571 ' CD2' HG23 ' A' ' 184' ' ' VAL . 50.2 m0 -113.71 164.66 13.42 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.54 1.15 . . . . 0.0 107.937 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . 0.453 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -96.75 117.06 30.22 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.457 1.098 . . . . 0.0 109.265 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . 0.54 ' CB ' ' HA ' ' A' ' 161' ' ' ILE . . . -139.59 163.45 32.53 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.586 1.179 . . . . 0.0 109.284 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.556 ' O ' ' HB3' ' A' ' 159' ' ' LEU . 2.7 mp0 -90.79 157.52 17.34 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.575 1.172 . . . . 0.0 110.31 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . 0.53 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 2.0 t0 -92.5 -160.67 0.76 Allowed 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.484 1.115 . . . . 0.0 109.364 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 43.1 t -81.13 6.68 13.05 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.484 1.115 . . . . 0.0 109.971 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -127.03 -3.64 6.37 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.523 1.139 . . . . 0.0 110.37 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . 0.512 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 98.88 -11.34 62.47 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.435 1.084 . . . . 0.0 111.011 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . 0.433 ' O ' HD13 ' A' ' 151' ' ' LEU . 21.4 mttt -51.91 115.79 1.85 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.521 0.777 . . . . 0.0 109.302 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . 0.497 ' HG2' ' CG ' ' A' ' 173' ' ' GLU . 0.5 OUTLIER -86.69 122.05 30.05 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.527 1.142 . . . . 0.0 110.353 179.97 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.453 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.82 -166.82 15.71 Favored Glycine 0 CA--C 1.53 1.03 0 O-C-N 124.518 1.136 . . . . 0.0 110.975 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 5.3 ttm -100.4 131.84 46.11 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.533 0.784 . . . . 0.0 110.975 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.596 ' CG2' ' CD2' ' A' ' 151' ' ' LEU . 0.2 OUTLIER -126.14 145.79 53.61 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.545 1.153 . . . . 0.0 109.306 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 183' ' ' PRO . . . . . 0.768 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -74.97 123.59 8.01 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.505 1.792 . . . . 0.0 111.021 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.835 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 5.1 t -69.49 -29.87 1.95 Allowed Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.553 1.158 . . . . 0.0 109.303 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 185' ' ' PRO . . . . . 0.835 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.97 -25.23 12.11 Favored 'Trans proline' 0 C--N 1.361 1.209 0 O-C-N 124.491 1.785 . . . . 0.0 111.05 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . 0.768 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.7 m-85 -99.92 0.12 40.59 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.461 1.101 . . . . 0.0 111.013 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 187' ' ' VAL . . . . . 0.484 HG13 ' O ' ' A' ' 183' ' ' PRO . 4.1 m -130.53 152.74 37.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.511 1.132 . . . . 0.0 109.329 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 188' ' ' GLU . . . . . 0.532 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.1 OUTLIER -105.01 166.7 10.2 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.581 1.175 . . . . 0.0 110.291 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.19 116.22 28.81 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.541 1.15 . . . . 0.0 109.295 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . 0.479 ' O ' ' C ' ' A' ' 191' ' ' GLY . 7.8 t80 -135.81 73.97 1.49 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.462 1.101 . . . . 0.0 111.005 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 191' ' ' GLY . . . . . 0.479 ' C ' ' O ' ' A' ' 190' ' ' TYR . . . . . . . . 0 CA--C 1.53 0.983 0 O-C-N 124.57 1.169 . . . . 0.0 110.951 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . 0.4 ' C ' ' CD1' ' A' ' 136' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.357 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . 0.528 ' N ' ' CD1' ' A' ' 136' ' ' TYR . 0.1 OUTLIER -149.72 167.13 27.32 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.437 1.086 . . . . 0.0 110.999 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.526 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 18.6 m -142.88 150.87 17.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.52 1.138 . . . . 0.0 109.299 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.512 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 17.2 ttt-85 -105.45 117.33 33.75 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.539 1.149 . . . . 0.0 110.305 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.438 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -82.08 110.59 17.45 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.535 1.147 . . . . 0.0 109.268 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.564 HD11 ' N ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -89.09 19.13 4.4 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.532 1.145 . . . . 0.0 109.302 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.458 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 9.6 m-85 -143.62 164.39 30.53 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.511 1.132 . . . . 0.0 110.926 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.53 155.79 17.1 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.433 1.083 . . . . 0.0 109.285 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.507 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 8.0 t80 -173.78 98.05 0.11 Allowed 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.578 1.174 . . . . 0.0 110.978 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -126.13 118.04 24.39 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.484 1.115 . . . . 0.0 109.304 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 73.68 115.44 0.07 OUTLIER Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.539 1.15 . . . . 0.0 111.031 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -157.25 -67.69 0.1 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.531 0.783 . . . . 0.0 109.323 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -139.67 169.06 18.42 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.446 1.092 . . . . 0.0 109.263 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -86.61 45.27 1.23 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.506 1.129 . . . . 0.0 110.288 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -162.95 -29.93 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.518 1.136 . . . . 0.0 110.363 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.564 ' OD1' ' CZ3' ' A' ' 169' ' ' TRP . 35.6 m-20 -75.42 130.47 39.02 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.507 1.129 . . . . 0.0 109.302 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.506 ' CD1' ' O ' ' A' ' 178' ' ' LYS . 13.1 tp -83.5 113.58 47.72 Favored Pre-proline 0 C--N 1.325 -0.467 0 O-C-N 124.48 1.112 . . . . 0.0 109.337 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . 0.425 ' HA ' ' O ' ' A' ' 143' ' ' PHE . 18.0 Cg_endo -75.07 159.02 41.59 Favored 'Trans proline' 0 C--N 1.359 1.118 0 O-C-N 124.557 1.82 . . . . 0.0 110.98 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.507 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 0.8 OUTLIER -167.69 -170.78 1.47 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.439 1.087 . . . . 0.0 110.979 -179.921 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -129.2 139.2 51.97 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.491 1.12 . . . . 0.0 109.296 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -46.5 116.93 1.43 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.563 1.165 . . . . 0.0 109.304 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 97.2 39.9 3.88 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.573 1.171 . . . . 0.0 111.041 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -118.46 178.5 4.43 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.457 0.739 . . . . 0.0 109.316 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.464 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 10.5 mt -130.1 145.83 35.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.55 1.156 . . . . 0.0 109.338 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.51 ' CD2' ' OD1' ' A' ' 174' ' ' ASP . 0.3 OUTLIER -140.21 140.81 35.93 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.513 1.133 . . . . 0.0 109.251 179.972 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.544 ' HB3' ' HB2' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.94 101.07 13.06 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.533 1.145 . . . . 0.0 110.333 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.51 ' CA ' ' HB2' ' A' ' 172' ' ' ALA . 0.3 OUTLIER -83.03 127.6 39.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.422 1.076 . . . . 0.0 109.325 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 24.3 ptt85 -127.69 -22.91 3.51 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.443 1.089 . . . . 0.0 110.302 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' ASP . . . . . 0.41 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 0.9 OUTLIER -121.51 144.08 48.91 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.552 1.157 . . . . 0.0 109.279 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.577 ' HD3' ' CZ3' ' A' ' 170' ' ' TRP . 57.3 mttt -148.64 69.42 10.24 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.501 1.125 . . . . 0.0 109.299 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.96 -52.06 0.11 Allowed 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.486 1.782 . . . . 0.0 111.057 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' GLU . . . . . 0.462 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.3 mm-40 -80.95 178.23 8.55 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.489 1.118 . . . . 0.0 110.321 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . 0.504 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 8.9 mm-40 -108.25 29.77 7.03 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.488 1.118 . . . . 0.0 110.259 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.504 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 2.1 mt-30 -167.93 -39.71 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.439 1.087 . . . . 0.0 110.311 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' TRP . . . . . 0.564 ' CZ3' ' OD1' ' A' ' 150' ' ' ASP . 78.8 m95 -105.25 106.3 16.74 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' TRP . . . . . 0.577 ' CZ3' ' HD3' ' A' ' 164' ' ' LYS . 51.0 m0 -112.22 162.8 15.08 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.478 1.111 . . . . 0.0 108.006 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . 0.477 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 1.1 t-20 -98.11 115.4 28.18 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.511 1.132 . . . . 0.0 109.326 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . 0.51 ' HB2' ' CA ' ' A' ' 161' ' ' ILE . . . -134.4 158.11 44.71 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.555 1.159 . . . . 0.0 109.291 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.544 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 1.3 mp0 -94.7 156.57 16.34 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.474 1.109 . . . . 0.0 110.272 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . 0.51 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.5 OUTLIER -90.43 -162.17 0.87 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.522 1.139 . . . . 0.0 109.317 179.992 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.81 10.0 5.57 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.533 1.145 . . . . 0.0 109.992 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -128.08 -5.73 5.54 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.595 1.184 . . . . 0.0 110.274 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . 0.512 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 99.97 -11.15 60.58 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.505 1.128 . . . . 0.0 110.997 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . 0.506 ' O ' ' CD1' ' A' ' 151' ' ' LEU . 8.5 mttt -53.23 111.79 0.76 Allowed 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.536 0.786 . . . . 0.0 109.327 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . 0.503 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.1 OUTLIER -89.75 127.36 35.94 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.479 1.112 . . . . 0.0 110.314 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.477 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.61 -168.56 18.15 Favored Glycine 0 CA--C 1.529 0.953 0 O-C-N 124.44 1.088 . . . . 0.0 110.967 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 181' ' ' MET . . . . . 0.423 ' O ' ' HA ' ' A' ' 150' ' ' ASP . 0.4 OUTLIER -103.46 126.27 50.51 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.446 0.733 . . . . 0.0 111.02 179.978 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.506 ' CG2' ' HB3' ' A' ' 151' ' ' LEU . 2.7 pp -130.42 155.68 80.67 Favored Pre-proline 0 C--N 1.324 -0.51 0 O-C-N 124.496 1.122 . . . . 0.0 109.288 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 183' ' ' PRO . . . . . 0.805 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.0 132.68 15.69 Favored 'Trans proline' 0 C--N 1.361 1.186 0 O-C-N 124.428 1.751 . . . . 0.0 110.993 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.855 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 19.6 t -75.26 -29.63 0.89 Allowed Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 124.501 1.126 . . . . 0.0 109.346 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 185' ' ' PRO . . . . . 0.855 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.0 Cg_endo -75.05 -20.09 17.1 Favored 'Trans proline' 0 C--N 1.361 1.19 0 O-C-N 124.469 1.773 . . . . 0.0 110.94 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . 0.805 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 6.7 m-85 -97.94 2.81 49.46 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.487 1.117 . . . . 0.0 110.993 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 187' ' ' VAL . . . . . 0.512 ' HA ' ' O ' ' A' ' 138' ' ' ARG . 6.3 m -137.89 155.1 29.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.479 1.112 . . . . 0.0 109.319 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 188' ' ' GLU . . . . . 0.526 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.8 OUTLIER -105.75 144.88 31.87 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.524 1.14 . . . . 0.0 110.275 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.64 107.89 18.38 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.517 1.136 . . . . 0.0 109.286 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . 0.41 ' HB3' ' CD2' ' A' ' 136' ' ' TYR . 1.3 t80 -97.81 -59.13 1.83 Allowed 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.539 1.149 . . . . 0.0 110.977 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.96 0 O-C-N 124.434 1.084 . . . . 0.0 111.034 179.973 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . 0.451 ' SG ' ' O ' ' A' ' 191' ' ' GLY . 20.1 p . . . . . 0 N--CA 1.452 -0.343 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . 0.457 ' CE1' ' HB2' ' A' ' 160' ' ' ARG . 2.1 m-85 -151.22 161.43 42.73 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.503 1.127 . . . . 0.0 110.967 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.49 ' CG1' HG21 ' A' ' 161' ' ' ILE . 31.0 m -143.85 146.33 21.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.579 1.174 . . . . 0.0 109.331 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.447 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 5.4 ttp180 -108.64 112.34 24.63 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.492 1.12 . . . . 0.0 110.308 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.441 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -80.86 109.14 15.14 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.578 1.174 . . . . 0.0 109.348 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.429 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 3.1 mp -88.49 25.02 1.79 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.474 1.109 . . . . 0.0 109.262 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.405 ' O ' ' N ' ' A' ' 155' ' ' LYS . 20.2 t80 -139.18 168.25 20.26 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.445 1.09 . . . . 0.0 111.046 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -113.59 125.63 54.38 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.488 1.118 . . . . 0.0 109.325 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.66 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 1.9 t80 -160.26 151.25 19.04 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.562 1.164 . . . . 0.0 111.027 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . 0.443 ' HA ' ' HB3' ' A' ' 152' ' ' PRO . 21.7 p30 -138.7 150.01 45.72 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.523 1.139 . . . . 0.0 109.263 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -138.05 -124.14 2.23 Favored Glycine 0 CA--C 1.529 0.919 0 O-C-N 124.516 1.135 . . . . 0.0 111.007 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . 0.411 ' O ' ' CB ' ' A' ' 147' ' ' ASP . 11.7 p-10 -178.42 33.16 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.416 0.715 . . . . 0.0 109.311 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . 0.42 ' O ' ' HB2' ' A' ' 150' ' ' ASP . 0.3 OUTLIER 75.08 -152.01 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.488 1.118 . . . . 0.0 109.375 -179.925 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.581 ' O ' ' CB ' ' A' ' 149' ' ' GLU . 2.2 tp10 51.3 41.2 27.78 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.486 1.116 . . . . 0.0 110.282 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . 0.581 ' CB ' ' O ' ' A' ' 148' ' ' GLU . 1.9 mt-10 92.75 25.22 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.488 1.117 . . . . 0.0 110.327 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 147' ' ' ASP . 0.2 OUTLIER -143.31 127.54 17.64 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.527 1.142 . . . . 0.0 109.319 -179.979 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.486 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 31.5 tp -122.51 118.18 28.77 Favored Pre-proline 0 C--N 1.325 -0.484 0 O-C-N 124.459 1.099 . . . . 0.0 109.32 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . 0.443 ' HB3' ' HA ' ' A' ' 144' ' ' ASN . 18.1 Cg_endo -75.05 143.09 28.49 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.467 1.772 . . . . 0.0 110.966 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.66 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 16.7 p90 -157.03 173.16 17.44 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.507 1.129 . . . . 0.0 111.008 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -130.68 137.27 49.48 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.522 1.139 . . . . 0.0 109.33 179.912 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . 0.429 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.8 OUTLIER -39.82 108.29 0.08 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.457 1.098 . . . . 0.0 109.298 179.959 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 103.07 33.72 4.21 Favored Glycine 0 CA--C 1.53 1.01 0 O-C-N 124.478 1.111 . . . . 0.0 111.002 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -109.55 168.81 9.12 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.448 0.734 . . . . 0.0 109.296 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.485 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 9.1 mt -126.13 147.06 30.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.525 1.141 . . . . 0.0 109.296 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.428 ' CD1' HG22 ' A' ' 182' ' ' ILE . 4.2 mt -143.5 139.36 29.78 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.556 1.16 . . . . 0.0 109.326 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.469 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -88.44 105.47 17.63 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.475 1.109 . . . . 0.0 110.322 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.49 HG21 ' CG1' ' A' ' 137' ' ' VAL . 1.1 pp -81.9 125.89 39.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.506 1.129 . . . . 0.0 109.252 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -121.67 -21.23 6.23 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.552 1.157 . . . . 0.0 110.273 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -131.84 137.69 48.18 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.528 1.142 . . . . 0.0 109.364 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.48 ' CG ' HD11 ' A' ' 161' ' ' ILE . 0.0 OUTLIER -140.15 72.44 33.08 Favored Pre-proline 0 C--N 1.324 -0.511 0 O-C-N 124.496 1.123 . . . . 0.0 109.251 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.04 -49.33 0.15 Allowed 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.465 1.771 . . . . 0.0 111.045 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' GLU . . . . . 0.469 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 5.9 mm-40 -79.38 174.4 11.61 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.469 1.105 . . . . 0.0 110.35 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . 0.534 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 0.0 OUTLIER -105.57 32.17 4.48 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.491 1.119 . . . . 0.0 110.319 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.534 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 3.7 mt-30 -172.57 -37.47 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.444 1.09 . . . . 0.0 110.284 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' TRP . . . . . 0.46 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 83.1 m95 -107.38 107.52 18.46 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.451 1.094 . . . . 0.0 108.057 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' TRP . . . . . 0.535 ' CD2' HG21 ' A' ' 184' ' ' VAL . 51.3 m0 -113.29 158.98 19.85 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.548 1.155 . . . . 0.0 107.994 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . 0.586 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -94.76 118.43 31.74 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.469 1.106 . . . . 0.0 109.336 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . 0.482 ' CB ' HG22 ' A' ' 161' ' ' ILE . . . -132.53 166.16 22.7 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.533 1.145 . . . . 0.0 109.287 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.697 ' HG2' ' N ' ' A' ' 174' ' ' ASP . 0.0 OUTLIER -98.13 160.04 14.55 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.581 1.176 . . . . 0.0 110.302 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . 0.697 ' N ' ' HG2' ' A' ' 173' ' ' GLU . 38.9 p-10 -97.44 -156.26 0.53 Allowed 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.506 1.129 . . . . 0.0 109.26 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.06 13.78 7.22 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.492 1.12 . . . . 0.0 110.054 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -136.52 -0.81 2.36 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.505 1.128 . . . . 0.0 110.251 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . 0.661 ' HA2' ' HG3' ' A' ' 173' ' ' GLU . . . 99.27 -19.17 55.06 Favored Glycine 0 CA--C 1.529 0.948 0 O-C-N 124.448 1.092 . . . . 0.0 111.015 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . 0.438 ' HB2' ' CG ' ' A' ' 174' ' ' ASP . 0.1 OUTLIER -47.26 111.1 0.36 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.498 0.764 . . . . 0.0 109.313 179.986 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -93.08 126.81 38.36 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.544 1.152 . . . . 0.0 110.368 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.586 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -149.48 -164.6 11.78 Favored Glycine 0 CA--C 1.531 1.089 0 O-C-N 124.514 1.134 . . . . 0.0 110.979 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 181' ' ' MET . . . . . 0.46 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 16.7 tpp -97.4 128.52 44.27 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.562 0.801 . . . . 0.0 111.001 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.494 ' C ' ' CD1' ' A' ' 182' ' ' ILE . 1.4 pp -127.51 144.54 51.3 Favored Pre-proline 0 C--N 1.325 -0.483 0 O-C-N 124.452 1.095 . . . . 0.0 109.317 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 183' ' ' PRO . . . . . 0.743 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.05 124.29 8.48 Favored 'Trans proline' 0 C--N 1.36 1.16 0 O-C-N 124.627 1.856 . . . . 0.0 110.933 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.831 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 37.5 t -71.16 -31.31 1.91 Allowed Pre-proline 0 C--N 1.324 -0.5 0 O-C-N 124.54 1.15 . . . . 0.0 109.322 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 185' ' ' PRO . . . . . 0.831 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -75.06 -23.66 13.48 Favored 'Trans proline' 0 C--N 1.36 1.133 0 O-C-N 124.475 1.776 . . . . 0.0 111.0 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . 0.743 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.9 m-85 -98.23 -2.5 39.55 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.517 1.136 . . . . 0.0 111.005 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 187' ' ' VAL . . . . . 0.475 HG23 ' CD1' ' A' ' 182' ' ' ILE . 7.2 m -127.54 153.6 36.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 O-C-N 124.482 1.114 . . . . 0.0 109.315 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 188' ' ' GLU . . . . . 0.467 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 6.0 mm-40 -101.11 160.64 14.22 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.604 1.19 . . . . 0.0 110.295 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.58 109.57 20.19 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.516 1.135 . . . . 0.0 109.296 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -94.61 -59.64 1.89 Allowed 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.531 1.144 . . . . 0.0 111.018 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 191' ' ' GLY . . . . . 0.451 ' O ' ' SG ' ' A' ' 135' ' ' CYS . . . . . . . . 0 CA--C 1.531 1.033 0 O-C-N 124.498 1.124 . . . . 0.0 111.015 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . 0.657 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 13.4 p . . . . . 0 N--CA 1.452 -0.346 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . 0.657 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 0.1 OUTLIER -136.4 174.75 10.27 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.422 1.077 . . . . 0.0 110.999 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.515 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 21.1 m -138.49 156.91 30.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 O-C-N 124.588 1.18 . . . . 0.0 109.297 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.526 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 13.1 ttp180 -108.35 121.71 45.48 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.476 1.11 . . . . 0.0 110.318 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.413 ' O ' ' N ' ' A' ' 156' ' ' GLY . . . -82.51 116.79 22.1 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.427 1.08 . . . . 0.0 109.315 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.52 HD11 ' N ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -93.33 25.8 3.22 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.477 1.111 . . . . 0.0 109.281 -179.973 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.4 ' HA ' ' HG2' ' A' ' 155' ' ' LYS . 11.7 t80 -150.65 163.54 38.26 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.511 1.132 . . . . 0.0 111.015 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.47 128.73 54.76 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.451 1.094 . . . . 0.0 109.332 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.578 ' HB2' ' CZ ' ' A' ' 153' ' ' PHE . 35.9 t80 -145.23 127.23 15.53 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.452 1.095 . . . . 0.0 110.947 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -144.49 96.08 2.81 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.497 1.123 . . . . 0.0 109.349 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -130.03 -135.98 3.96 Favored Glycine 0 CA--C 1.529 0.963 0 O-C-N 124.545 1.153 . . . . 0.0 110.961 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 163.61 90.07 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.512 0.772 . . . . 0.0 109.23 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -103.61 -61.92 1.36 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.476 1.11 . . . . 0.0 109.31 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 174.81 -43.88 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.502 1.126 . . . . 0.0 110.356 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . 0.434 ' O ' ' N ' ' A' ' 181' ' ' MET . 2.1 mp0 -121.43 4.04 10.22 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.535 1.147 . . . . 0.0 110.298 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.31 146.09 31.78 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.51 1.131 . . . . 0.0 109.321 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.479 ' CD2' ' O ' ' A' ' 172' ' ' ALA . 12.4 tp -117.83 115.54 36.91 Favored Pre-proline 0 C--N 1.325 -0.468 0 O-C-N 124.525 1.14 . . . . 0.0 109.328 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . 0.412 ' O ' ' OD1' ' A' ' 174' ' ' ASP . 18.3 Cg_endo -74.96 165.17 31.91 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.497 1.788 . . . . 0.0 110.949 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.578 ' CZ ' ' HB2' ' A' ' 143' ' ' PHE . 7.7 p90 -170.52 -174.82 1.73 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.493 1.121 . . . . 0.0 110.93 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 157' ' ' ASP . 0.0 OUTLIER -133.67 147.29 51.4 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.493 1.121 . . . . 0.0 109.259 -179.937 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . 0.485 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -51.82 120.01 4.84 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.582 1.176 . . . . 0.0 109.253 179.966 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.476 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 86.08 41.07 7.23 Favored Glycine 0 CA--C 1.53 1.019 0 O-C-N 124.512 1.133 . . . . 0.0 110.979 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . 0.451 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 15.1 t70 -114.06 174.3 6.01 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.512 0.772 . . . . 0.0 109.31 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.477 ' O ' HD23 ' A' ' 159' ' ' LEU . 7.3 mm -121.82 154.85 26.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 O-C-N 124.47 1.106 . . . . 0.0 109.337 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.503 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 6.2 mt -146.96 137.73 23.79 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.508 1.13 . . . . 0.0 109.302 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.532 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 5.0 ttm180 -87.06 109.02 19.13 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.56 1.162 . . . . 0.0 110.324 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.494 ' CD1' ' HB3' ' A' ' 172' ' ' ALA . 0.5 OUTLIER -79.99 125.38 38.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.563 1.165 . . . . 0.0 109.261 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -118.86 -25.03 6.41 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.516 1.135 . . . . 0.0 110.345 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -147.59 153.68 39.72 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.421 1.076 . . . . 0.0 109.227 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.561 ' HB2' ' CD2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -155.49 68.96 5.29 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.509 1.13 . . . . 0.0 109.268 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.95 -42.08 0.58 Allowed 'Trans proline' 0 C--N 1.359 1.103 0 O-C-N 124.535 1.808 . . . . 0.0 111.02 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' GLU . . . . . 0.491 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 10.7 mp0 -82.3 176.36 9.52 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.489 1.118 . . . . 0.0 110.321 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -114.94 48.98 1.08 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.478 1.112 . . . . 0.0 110.324 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.426 ' NE2' ' HG3' ' A' ' 185' ' ' PRO . 0.0 OUTLIER 171.96 -35.15 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.552 1.158 . . . . 0.0 110.255 -179.919 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' TRP . . . . . 0.514 ' CE3' ' HG2' ' A' ' 181' ' ' MET . 61.2 m95 -116.71 99.7 7.31 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.468 1.105 . . . . 0.0 108.028 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' TRP . . . . . 0.567 ' CD2' HG22 ' A' ' 184' ' ' VAL . 51.0 m0 -105.34 166.42 10.43 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . 0.404 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.6 OUTLIER -103.51 108.85 20.29 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.48 1.112 . . . . 0.0 109.308 179.994 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . 0.532 ' HA ' ' O ' ' A' ' 160' ' ' ARG . . . -134.82 166.24 23.42 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.488 1.118 . . . . 0.0 109.295 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.53 ' CG ' ' O ' ' A' ' 177' ' ' GLY . 0.8 OUTLIER -90.48 155.94 18.55 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.479 1.112 . . . . 0.0 110.32 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . 0.486 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.2 OUTLIER -88.71 -161.88 0.8 Allowed 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.478 1.111 . . . . 0.0 109.293 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 40.7 t -79.68 8.01 7.4 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.536 1.148 . . . . 0.0 110.023 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -129.37 -4.52 4.86 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.489 1.118 . . . . 0.0 110.346 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . 0.53 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 101.49 -11.64 58.14 Favored Glycine 0 CA--C 1.53 1.019 0 O-C-N 124.508 1.13 . . . . 0.0 111.014 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 4.3 mttm -52.58 113.43 1.06 Allowed 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.458 0.74 . . . . 0.0 109.28 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . 0.463 ' CG ' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.72 121.26 28.98 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.509 1.131 . . . . 0.0 110.316 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.424 ' N ' HD11 ' A' ' 151' ' ' LEU . . . -155.15 -164.23 12.85 Favored Glycine 0 CA--C 1.531 1.032 0 O-C-N 124.475 1.11 . . . . 0.0 111.009 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 181' ' ' MET . . . . . 0.514 ' HG2' ' CE3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -96.45 124.32 40.4 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.535 0.785 . . . . 0.0 110.996 -179.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.474 HD12 ' CB ' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -122.09 148.7 52.43 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.56 1.162 . . . . 0.0 109.32 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 183' ' ' PRO . . . . . 0.778 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.04 129.38 12.25 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.503 1.791 . . . . 0.0 110.979 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.829 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 79.9 t -75.43 -31.91 1.14 Allowed Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.477 1.11 . . . . 0.0 109.243 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 185' ' ' PRO . . . . . 0.829 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.2 Cg_endo -75.06 -24.77 12.41 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.508 1.794 . . . . 0.0 110.964 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . 0.778 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 5.4 m-85 -98.52 1.67 46.81 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.55 1.156 . . . . 0.0 110.992 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 187' ' ' VAL . . . . . 0.536 ' CG1' ' O ' ' A' ' 183' ' ' PRO . 2.5 m -135.06 145.82 31.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.438 1.086 . . . . 0.0 109.32 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 188' ' ' GLU . . . . . 0.515 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.5 OUTLIER -104.1 140.63 37.52 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.481 1.113 . . . . 0.0 110.256 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . 0.463 ' HA ' ' CG1' ' A' ' 137' ' ' VAL . 1.3 tmtm? -86.48 111.31 20.44 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.505 1.128 . . . . 0.0 109.308 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . 0.462 ' HB3' ' CD1' ' A' ' 136' ' ' TYR . 1.3 t80 -98.6 -40.01 8.42 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.474 1.109 . . . . 0.0 111.033 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 191' ' ' GLY . . . . . 0.623 ' O ' ' CE1' ' A' ' 136' ' ' TYR . . . . . . . . 0 CA--C 1.529 0.959 0 O-C-N 124.494 1.121 . . . . 0.0 111.044 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . 0.416 ' O ' ' HG3' ' A' ' 160' ' ' ARG . 99.3 m . . . . . 0 N--CA 1.453 -0.316 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . 0.494 ' CE1' ' HD2' ' A' ' 160' ' ' ARG . 6.2 m-85 -152.9 167.55 28.73 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.509 1.131 . . . . 0.0 111.021 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.551 ' CG2' ' HB2' ' A' ' 159' ' ' LEU . 16.6 m -142.93 137.26 26.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 O-C-N 124.496 1.122 . . . . 0.0 109.348 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.645 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 9.5 ttm180 -100.78 106.78 18.22 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.523 1.139 . . . . 0.0 110.269 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.473 ' HA ' ' CG1' ' A' ' 187' ' ' VAL . . . -80.36 104.47 10.93 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.486 1.116 . . . . 0.0 109.324 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.522 ' C ' ' HG2' ' A' ' 155' ' ' LYS . 6.5 mp -90.02 28.86 1.3 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.487 1.117 . . . . 0.0 109.36 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.475 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 34.0 m-85 -144.22 145.21 31.92 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.436 1.085 . . . . 0.0 111.011 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.09 131.62 35.86 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.452 1.095 . . . . 0.0 109.322 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.486 ' O ' ' CB ' ' A' ' 152' ' ' PRO . 2.5 t80 -153.89 95.78 1.9 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.521 1.138 . . . . 0.0 111.005 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -112.91 120.18 40.52 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 0.0 109.36 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . 0.577 ' O ' ' CB ' ' A' ' 146' ' ' ASN . . . -168.73 -130.06 1.15 Allowed Glycine 0 CA--C 1.531 1.038 0 O-C-N 124.557 1.161 . . . . 0.0 110.943 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . 0.577 ' CB ' ' O ' ' A' ' 145' ' ' GLY . 3.1 t-20 149.46 92.36 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.55 0.794 . . . . 0.0 109.241 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . 0.463 ' O ' ' HB2' ' A' ' 148' ' ' GLU . 0.2 OUTLIER -94.45 -75.26 0.51 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.539 1.149 . . . . 0.0 109.256 -179.984 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.519 ' O ' ' HB3' ' A' ' 149' ' ' GLU . 5.8 tp10 178.17 41.15 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.476 1.11 . . . . 0.0 110.258 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . 0.519 ' HB3' ' O ' ' A' ' 148' ' ' GLU . 8.0 pt-20 160.29 -21.96 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.499 1.124 . . . . 0.0 110.312 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -76.57 136.05 39.25 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.563 1.164 . . . . 0.0 109.3 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.518 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 8.0 tp -106.28 110.49 63.96 Favored Pre-proline 0 C--N 1.324 -0.505 0 O-C-N 124.471 1.107 . . . . 0.0 109.328 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . 0.486 ' CB ' ' O ' ' A' ' 143' ' ' PHE . 18.0 Cg_endo -75.06 169.23 23.05 Favored 'Trans proline' 0 C--N 1.36 1.146 0 O-C-N 124.507 1.793 . . . . 0.0 110.915 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.475 ' CE1' ' O ' ' A' ' 141' ' ' PHE . 0.8 OUTLIER -172.87 -170.82 0.7 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.488 1.118 . . . . 0.0 110.949 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . 0.463 ' O ' ' HG3' ' A' ' 154' ' ' LYS . 0.0 OUTLIER -125.78 140.07 52.99 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.454 1.096 . . . . 0.0 109.296 179.972 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . 0.522 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 1.3 tmmm? -45.85 117.02 1.35 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.507 1.129 . . . . 0.0 109.287 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.454 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 93.33 29.72 9.94 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.523 1.139 . . . . 0.0 110.99 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -100.55 169.36 9.12 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.519 0.776 . . . . 0.0 109.311 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.465 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 9.1 mt -122.24 147.06 26.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.556 1.16 . . . . 0.0 109.31 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.643 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 0.2 OUTLIER -141.02 136.89 32.54 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.547 1.154 . . . . 0.0 109.316 179.978 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.494 ' HD2' ' CE1' ' A' ' 136' ' ' TYR . 0.2 OUTLIER -88.12 111.02 21.12 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.601 1.188 . . . . 0.0 110.309 179.96 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.485 ' CD1' ' HB3' ' A' ' 172' ' ' ALA . 0.5 OUTLIER -80.48 125.21 39.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.551 1.157 . . . . 0.0 109.36 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -116.74 -26.51 6.95 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.532 1.145 . . . . 0.0 110.3 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' ASP . . . . . 0.465 ' OD2' ' CB ' ' A' ' 171' ' ' ASN . 0.0 OUTLIER -149.11 157.3 43.27 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.461 1.101 . . . . 0.0 109.353 -179.978 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.541 ' HG3' ' CE2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -145.88 92.15 5.46 Favored Pre-proline 0 C--N 1.325 -0.46 0 O-C-N 124.464 1.102 . . . . 0.0 109.278 179.994 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.03 -49.71 0.14 Allowed 'Trans proline' 0 C--N 1.361 1.201 0 O-C-N 124.478 1.778 . . . . 0.0 111.061 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' A' ' 169' ' ' TRP . 12.5 mt-10 -88.92 -177.53 5.5 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.596 1.185 . . . . 0.0 110.306 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -106.52 -9.78 16.49 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.507 1.13 . . . . 0.0 110.315 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -120.29 -27.66 5.19 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.539 1.15 . . . . 0.0 110.29 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' TRP . . . . . 0.473 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 59.7 m95 -121.65 117.75 27.46 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.543 1.152 . . . . 0.0 107.95 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' TRP . . . . . 0.554 ' CD2' HG22 ' A' ' 184' ' ' VAL . 33.9 m0 -114.2 165.08 13.04 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.519 1.137 . . . . 0.0 107.947 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . 0.465 ' CB ' ' OD2' ' A' ' 163' ' ' ASP . 0.4 OUTLIER -100.37 115.2 29.45 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.493 1.121 . . . . 0.0 109.295 -179.98 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . 0.485 ' HB3' ' CD1' ' A' ' 161' ' ' ILE . . . -136.79 168.44 19.53 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.521 1.138 . . . . 0.0 109.238 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.643 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.8 OUTLIER -97.38 154.57 17.37 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.483 1.114 . . . . 0.0 110.305 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . 0.546 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.1 OUTLIER -88.29 -163.97 1.05 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.551 1.157 . . . . 0.0 109.325 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 23.2 t -77.9 9.46 3.56 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.482 1.114 . . . . 0.0 109.982 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -128.66 -5.66 5.19 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.495 1.122 . . . . 0.0 110.276 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . 0.539 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 99.9 -11.31 60.7 Favored Glycine 0 CA--C 1.53 1.028 0 O-C-N 124.445 1.091 . . . . 0.0 110.94 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . 0.446 ' O ' HD22 ' A' ' 151' ' ' LEU . 0.8 OUTLIER -53.39 112.47 0.9 Allowed 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.505 0.768 . . . . 0.0 109.306 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . 0.451 ' CG ' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.59 124.61 33.07 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.499 1.124 . . . . 0.0 110.322 -179.988 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.434 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -155.73 -165.44 14.39 Favored Glycine 0 CA--C 1.53 0.971 0 O-C-N 124.473 1.108 . . . . 0.0 111.019 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 181' ' ' MET . . . . . 0.473 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -99.64 131.29 45.73 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.479 0.753 . . . . 0.0 111.003 179.99 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.518 ' CG2' ' HB3' ' A' ' 151' ' ' LEU . 2.2 pp -132.62 148.88 71.35 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.466 1.104 . . . . 0.0 109.312 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 183' ' ' PRO . . . . . 0.741 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.0 129.71 12.59 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.488 1.783 . . . . 0.0 111.045 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.834 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 54.6 t -74.5 -31.53 1.23 Allowed Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.49 1.119 . . . . 0.0 109.319 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 185' ' ' PRO . . . . . 0.834 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.93 -17.43 19.75 Favored 'Trans proline' 0 C--N 1.36 1.172 0 O-C-N 124.509 1.794 . . . . 0.0 111.06 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . 0.741 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 5.2 m-85 -98.33 -12.61 21.33 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.46 1.1 . . . . 0.0 111.019 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 187' ' ' VAL . . . . . 0.645 ' HA ' ' O ' ' A' ' 138' ' ' ARG . 2.3 m -126.97 157.01 38.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.503 1.127 . . . . 0.0 109.385 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 188' ' ' GLU . . . . . 0.435 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 3.4 pt-20 -98.13 161.8 13.53 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.44 1.087 . . . . 0.0 110.297 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.07 112.14 22.33 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.51 1.131 . . . . 0.0 109.249 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -122.52 166.16 15.24 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 124.546 1.153 . . . . 0.0 110.998 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.022 0 O-C-N 124.496 1.123 . . . . 0.0 110.971 179.983 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 85.6 m . . . . . 0 N--CA 1.453 -0.317 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -129.81 177.31 7.35 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.509 1.131 . . . . 0.0 110.963 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.485 ' CG2' HG22 ' A' ' 187' ' ' VAL . 1.4 m -149.79 166.77 2.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.402 1.064 . . . . 0.0 109.284 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.418 ' HA ' ' O ' ' A' ' 157' ' ' ASP . 2.3 ttt-85 -128.15 116.27 19.68 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.463 1.102 . . . . 0.0 110.235 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.534 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -83.87 107.25 16.15 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.528 1.142 . . . . 0.0 109.283 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.515 ' C ' ' HG2' ' A' ' 155' ' ' LYS . 1.1 mp -88.54 26.52 1.45 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.59 1.181 . . . . 0.0 109.356 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.568 ' CD1' ' HA ' ' A' ' 186' ' ' TYR . 84.2 m-85 -153.4 146.61 24.7 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.444 1.09 . . . . 0.0 110.993 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.89 153.79 34.38 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.54 1.15 . . . . 0.0 109.304 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.639 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -165.7 140.85 4.9 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.527 1.142 . . . . 0.0 111.044 179.948 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -131.7 -44.76 0.98 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.472 1.107 . . . . 0.0 109.269 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -166.15 121.9 1.02 Allowed Glycine 0 CA--C 1.53 1.03 0 O-C-N 124.45 1.094 . . . . 0.0 110.976 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . 0.576 ' HB2' ' CZ ' ' A' ' 143' ' ' PHE . 9.3 t30 -116.95 -47.8 2.68 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.474 0.75 . . . . 0.0 109.281 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . 0.515 ' O ' ' CB ' ' A' ' 148' ' ' GLU . 0.7 OUTLIER -113.83 -63.84 1.39 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.458 1.099 . . . . 0.0 109.273 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.515 ' CB ' ' O ' ' A' ' 147' ' ' ASP . 1.2 mt-10 159.81 -25.6 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.471 1.107 . . . . 0.0 110.39 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -112.54 -5.36 14.03 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.531 1.144 . . . . 0.0 110.288 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -65.27 153.45 41.04 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.568 1.167 . . . . 0.0 109.336 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.522 ' O ' ' CE2' ' A' ' 153' ' ' PHE . 15.5 tp -92.21 112.48 55.34 Favored Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.471 1.107 . . . . 0.0 109.291 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.0 167.26 27.45 Favored 'Trans proline' 0 C--N 1.361 1.189 0 O-C-N 124.529 1.805 . . . . 0.0 111.056 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.639 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 4.7 p90 -178.05 -178.77 0.69 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.525 1.14 . . . . 0.0 110.983 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.47 142.44 47.15 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.492 1.12 . . . . 0.0 109.302 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . 0.515 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -46.0 119.34 2.22 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.504 1.127 . . . . 0.0 109.288 179.962 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.455 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 88.57 40.74 6.27 Favored Glycine 0 CA--C 1.53 0.999 0 O-C-N 124.541 1.151 . . . . 0.0 111.027 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . 0.418 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 37.0 t70 -111.14 167.8 9.99 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.481 0.754 . . . . 0.0 109.297 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.459 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 2.3 mp -116.68 149.93 18.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.505 1.128 . . . . 0.0 109.303 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.581 ' HB3' ' O ' ' A' ' 173' ' ' GLU . 1.0 OUTLIER -141.74 146.01 35.5 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.494 1.121 . . . . 0.0 109.276 179.943 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.45 ' C ' ' HB3' ' A' ' 172' ' ' ALA . 0.9 OUTLIER -93.68 101.77 13.92 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.478 1.111 . . . . 0.0 110.3 179.968 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.503 HD11 ' HB3' ' A' ' 170' ' ' TRP . 9.4 tp -79.23 128.47 38.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.488 1.118 . . . . 0.0 109.343 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.21 -26.18 3.69 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.525 1.14 . . . . 0.0 110.254 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' ASP . . . . . 0.405 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 45.9 m-20 -137.39 140.91 41.67 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.485 1.116 . . . . 0.0 109.295 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.59 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -146.79 69.34 12.11 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.542 1.151 . . . . 0.0 109.378 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . 0.404 ' HG2' ' OE1' ' A' ' 166' ' ' GLU . 18.4 Cg_endo -75.0 -44.08 0.36 Allowed 'Trans proline' 0 C--N 1.359 1.104 0 O-C-N 124.499 1.789 . . . . 0.0 111.037 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 169' ' ' TRP . 6.6 mp0 -81.03 171.02 15.49 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.503 1.127 . . . . 0.0 110.315 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . 0.425 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 12.5 pm0 -112.41 52.39 0.77 Allowed 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.459 1.099 . . . . 0.0 110.261 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.425 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 0.1 OUTLIER 169.75 -31.68 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.517 1.136 . . . . 0.0 110.316 179.937 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' TRP . . . . . 0.451 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 73.3 m95 -125.52 101.4 6.91 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.562 1.164 . . . . 0.0 107.967 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' TRP . . . . . 0.59 ' CG ' ' HB3' ' A' ' 164' ' ' LYS . 10.2 m0 -106.86 174.71 5.77 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.534 1.146 . . . . 0.0 107.982 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . 0.409 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -109.06 113.48 26.39 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 124.522 1.139 . . . . 0.0 109.282 -179.998 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . 0.498 ' O ' ' CD2' ' A' ' 151' ' ' LEU . . . -136.55 164.01 29.19 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.534 1.146 . . . . 0.0 109.373 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.581 ' O ' ' HB3' ' A' ' 159' ' ' LEU . 7.5 mp0 -89.32 153.38 20.92 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.466 1.104 . . . . 0.0 110.345 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . 0.419 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.5 OUTLIER -88.1 -159.74 0.57 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.521 1.138 . . . . 0.0 109.353 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 94.4 p -81.71 9.85 7.12 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.472 1.108 . . . . 0.0 109.995 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -131.11 -5.34 3.89 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.511 1.132 . . . . 0.0 110.239 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . 0.512 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 100.96 -11.16 58.87 Favored Glycine 0 CA--C 1.532 1.094 0 O-C-N 124.547 1.154 . . . . 0.0 110.966 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 3.3 mttp -54.5 114.69 1.77 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.511 0.771 . . . . 0.0 109.234 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . 0.54 ' CG ' ' CD ' ' A' ' 173' ' ' GLU . 1.1 mtm180 -86.45 123.86 32.14 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.464 1.102 . . . . 0.0 110.279 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.409 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.91 -169.16 19.2 Favored Glycine 0 CA--C 1.531 1.035 0 O-C-N 124.475 1.109 . . . . 0.0 111.022 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 181' ' ' MET . . . . . 0.451 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.1 OUTLIER -88.24 119.12 28.34 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.519 0.776 . . . . 0.0 111.044 179.971 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.476 HG12 ' CB ' ' A' ' 172' ' ' ALA . 1.6 pp -108.86 133.74 20.58 Favored Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.515 1.135 . . . . 0.0 109.318 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 183' ' ' PRO . . . . . 0.702 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.05 126.37 9.9 Favored 'Trans proline' 0 C--N 1.359 1.114 0 O-C-N 124.45 1.763 . . . . 0.0 110.952 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.838 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 60.5 t -71.71 -29.76 1.39 Allowed Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 124.445 1.09 . . . . 0.0 109.238 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 185' ' ' PRO . . . . . 0.838 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -74.99 -29.43 8.25 Favored 'Trans proline' 0 C--N 1.359 1.13 0 O-C-N 124.461 1.769 . . . . 0.0 110.994 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . 0.702 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 5.5 m-85 -100.33 -0.67 37.92 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.531 1.144 . . . . 0.0 110.966 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 187' ' ' VAL . . . . . 0.569 ' CG1' ' O ' ' A' ' 183' ' ' PRO . 1.4 m -137.11 160.73 36.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.51 1.131 . . . . 0.0 109.327 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 188' ' ' GLU . . . . . 0.465 ' O ' ' HB ' ' A' ' 137' ' ' VAL . 6.9 tp10 -116.76 149.94 39.1 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.538 1.148 . . . . 0.0 110.25 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.43 110.41 19.14 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.463 1.102 . . . . 0.0 109.284 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -124.31 70.83 1.11 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.491 1.119 . . . . 0.0 111.015 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.991 0 O-C-N 124.462 1.101 . . . . 0.0 111.037 -179.999 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . 0.677 ' O ' ' CD1' ' A' ' 136' ' ' TYR . 3.6 p . . . . . 0 N--CA 1.453 -0.322 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . 0.677 ' CD1' ' O ' ' A' ' 135' ' ' CYS . 8.8 m-85 -149.38 179.98 7.52 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.419 1.074 . . . . 0.0 111.045 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.466 ' N ' ' O ' ' A' ' 159' ' ' LEU . 24.0 m -144.06 143.87 23.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 124.427 1.079 . . . . 0.0 109.307 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.564 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 28.0 ttm-85 -104.26 111.46 24.08 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.476 1.11 . . . . 0.0 110.306 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.413 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -79.63 107.25 12.25 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.526 1.142 . . . . 0.0 109.336 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.461 ' O ' ' HE2' ' A' ' 155' ' ' LYS . 7.4 mp -89.89 29.53 1.18 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.521 1.138 . . . . 0.0 109.278 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.606 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 42.7 m-85 -148.28 151.7 35.87 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.446 1.092 . . . . 0.0 111.011 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -93.82 133.17 37.5 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.558 1.161 . . . . 0.0 109.273 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.621 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 12.0 t80 -161.0 85.03 0.67 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 0.0 111.027 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . 0.422 ' HA ' ' CB ' ' A' ' 152' ' ' PRO . 13.0 p-10 -126.11 92.37 3.57 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.498 1.124 . . . . 0.0 109.312 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 125.96 95.02 0.97 Allowed Glycine 0 CA--C 1.53 1.005 0 O-C-N 124.512 1.133 . . . . 0.0 110.995 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -158.87 -70.94 0.09 Allowed 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.506 0.768 . . . . 0.0 109.345 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -163.28 145.08 9.76 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.585 1.178 . . . . 0.0 109.295 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.58 -13.41 9.22 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.47 1.106 . . . . 0.0 110.285 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -78.19 -24.74 47.02 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.481 1.113 . . . . 0.0 110.292 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -109.73 128.28 55.17 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.496 1.123 . . . . 0.0 109.286 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.455 HD23 ' CD1' ' A' ' 182' ' ' ILE . 10.5 tp -75.4 116.54 55.68 Favored Pre-proline 0 C--N 1.324 -0.517 0 O-C-N 124.492 1.12 . . . . 0.0 109.32 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . 0.465 ' HA ' ' O ' ' A' ' 143' ' ' PHE . 18.4 Cg_endo -75.01 166.07 29.96 Favored 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.398 1.736 . . . . 0.0 111.018 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.621 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 3.5 p90 -166.18 -177.18 4.01 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.525 1.14 . . . . 0.0 111.015 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . 0.578 ' O ' ' C ' ' A' ' 155' ' ' LYS . 2.0 ttmt -133.82 129.79 37.02 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.476 1.11 . . . . 0.0 109.301 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . 0.578 ' C ' ' O ' ' A' ' 154' ' ' LYS . 12.5 ttmt -25.33 123.37 0.06 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.579 1.174 . . . . 0.0 109.373 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 74.36 49.94 10.96 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 124.49 1.119 . . . . 0.0 110.988 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . 0.426 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 28.8 t0 -113.41 165.2 12.69 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.516 0.774 . . . . 0.0 109.355 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.527 ' C ' ' HG ' ' A' ' 159' ' ' LEU . 1.3 mp -118.36 148.63 21.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.47 1.106 . . . . 0.0 109.298 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.527 ' HG ' ' C ' ' A' ' 158' ' ' ILE . 1.3 mt -147.14 138.78 24.17 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.527 1.142 . . . . 0.0 109.307 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.529 ' HB3' ' HB2' ' A' ' 173' ' ' GLU . 0.8 OUTLIER -87.63 106.2 17.86 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.572 1.17 . . . . 0.0 110.272 -179.95 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.486 ' CD1' ' HB2' ' A' ' 172' ' ' ALA . 2.2 mm -82.98 125.98 40.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.486 1.116 . . . . 0.0 109.268 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 10.5 ttt180 -127.62 -26.21 3.02 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.524 1.14 . . . . 0.0 110.277 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' ASP . . . . . 0.491 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -126.65 140.52 52.35 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.55 1.156 . . . . 0.0 109.344 179.981 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.5 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 1.7 mtmt -146.32 63.4 8.82 Favored Pre-proline 0 C--N 1.324 -0.502 0 O-C-N 124.487 1.117 . . . . 0.0 109.312 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . 0.43 ' HD3' ' N ' ' A' ' 164' ' ' LYS . 18.5 Cg_endo -74.98 6.96 3.07 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.491 1.785 . . . . 0.0 110.995 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' GLU . . . . . 0.467 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 5.5 mm-40 -135.66 176.04 9.04 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.557 1.16 . . . . 0.0 110.282 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . 0.539 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 4.2 mm-40 -113.73 35.79 3.92 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.539 1.149 . . . . 0.0 110.244 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.539 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 0.4 OUTLIER -174.93 -37.84 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.48 1.112 . . . . 0.0 110.361 179.974 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' TRP . . . . . 0.448 ' O ' ' HB2' ' A' ' 166' ' ' GLU . 76.6 m95 -113.56 104.77 12.59 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 170' ' ' TRP . . . . . 0.523 ' CD2' HG22 ' A' ' 184' ' ' VAL . 38.7 m0 -111.2 159.91 17.45 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . 0.497 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -96.91 114.3 25.91 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.43 1.081 . . . . 0.0 109.296 179.969 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . 0.564 ' HB3' ' CD1' ' A' ' 182' ' ' ILE . . . -128.64 167.69 16.83 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.506 1.128 . . . . 0.0 109.29 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.529 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 2.0 mp0 -97.48 157.28 16.09 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.48 1.112 . . . . 0.0 110.38 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . 0.453 ' OD1' ' N ' ' A' ' 177' ' ' GLY . 46.2 p-10 -95.14 -159.92 0.75 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.478 1.111 . . . . 0.0 109.291 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 44.6 t -81.32 12.29 3.71 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.562 1.163 . . . . 0.0 109.97 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -132.31 -3.72 3.44 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.443 1.09 . . . . 0.0 110.346 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . 0.518 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 97.29 -12.25 65.17 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.494 1.122 . . . . 0.0 111.003 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . 0.45 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 0.1 OUTLIER -54.78 115.17 2.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.492 0.76 . . . . 0.0 109.306 -179.965 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . 0.435 ' HG2' ' CD ' ' A' ' 173' ' ' GLU . 0.3 OUTLIER -88.72 127.78 35.6 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.487 1.117 . . . . 0.0 110.286 -179.973 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.497 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -153.48 -171.77 21.0 Favored Glycine 0 CA--C 1.529 0.946 0 O-C-N 124.441 1.088 . . . . 0.0 111.019 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.4 135.34 33.53 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.492 0.76 . . . . 0.0 111.039 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.564 ' CD1' ' HB3' ' A' ' 172' ' ' ALA . 30.4 mt -134.09 137.67 28.77 Favored Pre-proline 0 C--N 1.325 -0.466 0 O-C-N 124.422 1.076 . . . . 0.0 109.315 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 183' ' ' PRO . . . . . 0.729 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.1 Cg_endo -75.03 121.87 6.84 Favored 'Trans proline' 0 C--N 1.36 1.152 0 O-C-N 124.508 1.794 . . . . 0.0 111.027 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.84 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 24.6 t -69.5 -29.32 1.75 Allowed Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.536 1.147 . . . . 0.0 109.26 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 185' ' ' PRO . . . . . 0.84 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.98 -23.68 13.6 Favored 'Trans proline' 0 C--N 1.359 1.09 0 O-C-N 124.538 1.81 . . . . 0.0 111.012 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . 0.729 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.6 m-85 -99.42 -3.12 34.46 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.521 1.138 . . . . 0.0 111.0 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 187' ' ' VAL . . . . . 0.564 ' HA ' ' O ' ' A' ' 138' ' ' ARG . 5.2 m -130.34 162.41 38.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.542 1.151 . . . . 0.0 109.265 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 188' ' ' GLU . . . . . 0.443 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 1.0 OUTLIER -110.67 158.2 18.87 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.583 1.177 . . . . 0.0 110.286 179.993 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.55 110.09 21.4 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.505 1.128 . . . . 0.0 109.274 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . 0.411 ' O ' ' HB2' ' A' ' 136' ' ' TYR . 41.3 t80 -161.48 126.02 3.44 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.491 1.119 . . . . 0.0 111.061 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 191' ' ' GLY . . . . . 0.573 ' HA3' ' CD2' ' A' ' 136' ' ' TYR . . . . . . . . 0 CA--C 1.531 1.037 0 O-C-N 124.567 1.167 . . . . 0.0 110.958 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . 0.43 ' O ' ' CD1' ' A' ' 136' ' ' TYR . 8.9 t . . . . . 0 N--CA 1.453 -0.296 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . 0.43 ' CD1' ' O ' ' A' ' 135' ' ' CYS . 36.3 m-85 -150.99 164.0 37.41 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.405 1.066 . . . . 0.0 111.062 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.505 ' O ' ' HA ' ' A' ' 158' ' ' ILE . 15.4 m -138.61 165.72 24.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.573 1.171 . . . . 0.0 109.332 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.481 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 16.1 ttp180 -124.04 112.93 17.74 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.475 1.109 . . . . 0.0 110.321 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.554 ' O ' ' N ' ' A' ' 156' ' ' GLY . . . -83.36 103.93 13.12 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.498 1.123 . . . . 0.0 109.305 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.408 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 0.7 OUTLIER -88.87 27.82 1.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.449 1.093 . . . . 0.0 109.41 179.93 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.423 ' CD1' ' HA ' ' A' ' 186' ' ' TYR . 58.1 m-85 -147.86 151.3 35.69 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.497 1.123 . . . . 0.0 110.98 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -88.9 126.21 35.28 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.536 1.148 . . . . 0.0 109.317 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.626 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 3.0 t80 -130.3 145.12 51.73 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.445 1.09 . . . . 0.0 111.007 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . 0.515 ' O ' ' HB3' ' A' ' 152' ' ' PRO . 11.9 t-20 -114.11 -35.0 5.18 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.5 1.125 . . . . 0.0 109.264 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . 0.423 ' HA2' ' CG ' ' A' ' 150' ' ' ASP . . . 142.59 141.45 3.88 Favored Glycine 0 CA--C 1.53 1.025 0 O-C-N 124.522 1.139 . . . . 0.0 110.963 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . 0.459 ' CG ' ' N ' ' A' ' 147' ' ' ASP . 12.2 p-10 -128.29 -47.41 1.32 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.486 0.756 . . . . 0.0 109.215 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . 0.551 ' H ' ' HB3' ' A' ' 150' ' ' ASP . 7.7 p-10 -108.03 169.21 8.76 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.643 1.214 . . . . 0.0 109.351 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 54.8 tt0 -63.39 -40.54 97.49 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.478 1.111 . . . . 0.0 110.331 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . 0.424 ' C ' ' OD2' ' A' ' 147' ' ' ASP . 38.1 mt-10 -94.82 23.56 5.39 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.47 1.107 . . . . 0.0 110.312 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.551 ' HB3' ' H ' ' A' ' 147' ' ' ASP . 0.6 OUTLIER -74.77 159.59 31.79 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.527 1.142 . . . . 0.0 109.353 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.5 HD21 ' CG2' ' A' ' 182' ' ' ILE . 15.8 tp -125.03 108.57 27.8 Favored Pre-proline 0 C--N 1.325 -0.48 0 O-C-N 124.491 1.12 . . . . 0.0 109.31 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . 0.515 ' HB3' ' O ' ' A' ' 144' ' ' ASN . 18.3 Cg_endo -75.03 162.34 37.22 Favored 'Trans proline' 0 C--N 1.36 1.168 0 O-C-N 124.465 1.771 . . . . 0.0 110.984 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.626 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 17.9 p90 -178.69 177.32 0.89 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.478 1.111 . . . . 0.0 111.01 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.57 140.7 49.48 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.512 1.132 . . . . 0.0 109.311 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.1 OUTLIER -45.28 131.01 8.18 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.527 1.142 . . . . 0.0 109.313 179.887 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 85.85 22.71 48.63 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 124.441 1.088 . . . . 0.0 111.002 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -99.07 167.9 10.42 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.504 0.767 . . . . 0.0 109.269 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.529 HG21 ' N ' ' A' ' 159' ' ' LEU . 51.5 mm -120.72 146.89 24.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.567 1.167 . . . . 0.0 109.306 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.529 ' N ' HG21 ' A' ' 158' ' ' ILE . 0.9 OUTLIER -136.92 138.45 40.66 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.432 1.082 . . . . 0.0 109.347 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.48 ' C ' ' HB3' ' A' ' 172' ' ' ALA . 5.0 mtm180 -87.67 96.41 10.42 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.513 1.133 . . . . 0.0 110.311 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.578 ' HA ' ' CB ' ' A' ' 172' ' ' ALA . 0.0 OUTLIER -84.44 125.85 40.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.431 1.082 . . . . 0.0 109.296 -179.951 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . 0.453 ' CG ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -119.04 -21.76 7.54 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.58 1.175 . . . . 0.0 110.322 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' ASP . . . . . 0.634 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -136.6 149.87 48.26 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.472 1.107 . . . . 0.0 109.307 -179.993 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.538 ' CB ' ' CG ' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -155.48 74.17 5.35 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.488 1.118 . . . . 0.0 109.312 179.981 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 -38.34 1.64 Allowed 'Trans proline' 0 C--N 1.359 1.108 0 O-C-N 124.51 1.795 . . . . 0.0 111.086 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' GLU . . . . . 0.446 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.5 mm-40 -85.69 171.49 11.59 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.545 1.153 . . . . 0.0 110.271 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -110.49 50.42 0.81 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.589 1.181 . . . . 0.0 110.336 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 170.66 -32.19 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.435 1.085 . . . . 0.0 110.259 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -120.65 100.54 7.18 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.514 1.133 . . . . 0.0 107.974 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 170' ' ' TRP . . . . . 0.538 ' CG ' ' CB ' ' A' ' 164' ' ' LYS . 40.8 m0 -105.8 164.26 12.07 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.492 1.12 . . . . 0.0 107.991 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . 0.448 ' HB3' ' OD1' ' A' ' 163' ' ' ASP . 1.6 m-20 -98.91 114.08 26.52 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.441 1.088 . . . . 0.0 109.343 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . 0.578 ' CB ' ' HA ' ' A' ' 161' ' ' ILE . . . -139.0 166.31 24.83 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.466 1.103 . . . . 0.0 109.288 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.509 ' CG ' ' O ' ' A' ' 177' ' ' GLY . 2.1 mp0 -95.8 157.45 15.89 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.493 1.121 . . . . 0.0 110.369 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . 0.517 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.1 OUTLIER -89.84 -163.46 1.01 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.515 1.135 . . . . 0.0 109.32 -179.993 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 60.8 p -80.31 9.65 5.53 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.489 1.118 . . . . 0.0 110.024 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -131.08 -4.92 3.91 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.522 1.139 . . . . 0.0 110.31 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . 0.509 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 103.14 -11.45 55.39 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 124.53 1.144 . . . . 0.0 111.008 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 2.6 mttt -52.51 111.7 0.69 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.483 0.755 . . . . 0.0 109.286 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . 0.408 ' HG2' ' HG3' ' A' ' 173' ' ' GLU . 0.1 OUTLIER -88.79 123.51 33.26 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.451 1.094 . . . . 0.0 110.291 -179.981 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.437 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -155.57 -161.8 10.88 Favored Glycine 0 CA--C 1.531 1.034 0 O-C-N 124.535 1.147 . . . . 0.0 110.991 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.9 mmt -93.73 116.11 28.58 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.506 0.768 . . . . 0.0 110.956 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.5 ' CG2' HD21 ' A' ' 151' ' ' LEU . 2.2 pp -103.48 132.28 21.24 Favored Pre-proline 0 C--N 1.324 -0.518 0 O-C-N 124.551 1.157 . . . . 0.0 109.259 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 183' ' ' PRO . . . . . 0.618 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.6 Cg_endo -74.99 123.39 7.85 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.521 1.801 . . . . 0.0 111.025 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.838 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 69.7 t -71.36 -30.57 1.65 Allowed Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.464 1.102 . . . . 0.0 109.261 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 185' ' ' PRO . . . . . 0.838 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.99 -28.22 9.36 Favored 'Trans proline' 0 C--N 1.36 1.143 0 O-C-N 124.547 1.814 . . . . 0.0 110.988 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . 0.618 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.8 m-85 -99.47 -5.07 30.01 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.47 1.106 . . . . 0.0 110.921 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 187' ' ' VAL . . . . . 0.545 ' CG1' ' O ' ' A' ' 183' ' ' PRO . 1.5 m -132.13 162.96 38.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.492 1.12 . . . . 0.0 109.269 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 188' ' ' GLU . . . . . 0.426 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 3.8 tt0 -111.82 147.97 34.59 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.5 1.125 . . . . 0.0 110.32 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 3.4 ptpp? -88.23 103.15 15.52 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.533 1.145 . . . . 0.0 109.284 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . 0.42 ' HB3' ' O ' ' A' ' 136' ' ' TYR . 20.7 t80 -88.54 -31.17 18.81 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.568 1.167 . . . . 0.0 110.96 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.962 0 O-C-N 124.474 1.109 . . . . 0.0 110.982 -179.984 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . 0.637 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 20.4 p . . . . . 0 N--CA 1.452 -0.364 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . 0.637 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 27.1 m-85 -149.8 157.32 43.09 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.561 1.163 . . . . 0.0 111.0 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.553 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 21.9 m -136.65 137.59 47.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.568 1.168 . . . . 0.0 109.234 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.547 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 7.1 ttt180 -101.51 111.01 23.12 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.444 1.09 . . . . 0.0 110.285 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.44 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -80.55 110.77 16.34 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.453 1.096 . . . . 0.0 109.349 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.474 ' O ' ' CE ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -88.23 19.01 3.94 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.526 1.141 . . . . 0.0 109.296 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -141.7 172.2 13.01 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.541 1.15 . . . . 0.0 110.979 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -109.93 156.08 20.9 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.492 1.12 . . . . 0.0 109.283 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.585 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 65.3 t80 -175.3 104.42 0.08 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.572 1.17 . . . . 0.0 110.985 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 16.9 p-10 -129.01 87.7 2.6 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.523 1.139 . . . . 0.0 109.318 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -131.04 -131.5 3.29 Favored Glycine 0 CA--C 1.531 1.042 0 O-C-N 124.509 1.131 . . . . 0.0 110.99 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 164.99 88.71 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.514 0.773 . . . . 0.0 109.343 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.2 -60.73 1.82 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.412 1.07 . . . . 0.0 109.353 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 177.87 -43.39 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.486 1.116 . . . . 0.0 110.286 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 181' ' ' MET . 54.9 mt-10 -130.14 13.2 5.66 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.469 1.105 . . . . 0.0 110.309 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.18 155.72 24.81 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.478 1.111 . . . . 0.0 109.353 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.435 HD11 ' N ' ' A' ' 180' ' ' GLY . 24.8 tp -119.75 115.46 33.59 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.425 1.078 . . . . 0.0 109.316 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . 0.406 ' O ' ' OD1' ' A' ' 174' ' ' ASP . 18.3 Cg_endo -75.02 157.84 42.47 Favored 'Trans proline' 0 C--N 1.359 1.122 0 O-C-N 124.527 1.804 . . . . 0.0 110.952 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.594 ' CE2' HD12 ' A' ' 182' ' ' ILE . 25.8 p90 -166.43 -175.53 3.26 Favored 'General case' 0 C--N 1.327 -0.412 0 O-C-N 124.449 1.093 . . . . 0.0 110.95 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . 0.52 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -138.55 132.3 30.91 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.574 1.171 . . . . 0.0 109.326 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . 0.52 ' C ' ' O ' ' A' ' 154' ' ' LYS . 5.8 ttmt -31.15 130.76 0.11 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.526 1.141 . . . . 0.0 109.252 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 72.85 42.24 46.43 Favored Glycine 0 CA--C 1.53 1.005 0 O-C-N 124.496 1.123 . . . . 0.0 111.033 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . 0.412 ' HB2' ' O ' ' A' ' 154' ' ' LYS . 15.5 t70 -111.21 167.49 10.24 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.502 0.766 . . . . 0.0 109.305 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.433 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 1.8 mp -122.81 146.16 28.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 O-C-N 124.499 1.124 . . . . 0.0 109.23 -179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.599 ' CD1' ' CD1' ' A' ' 182' ' ' ILE . 0.6 OUTLIER -142.07 138.69 31.92 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.481 1.113 . . . . 0.0 109.323 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.433 ' O ' ' N ' ' A' ' 173' ' ' GLU . 0.3 OUTLIER -91.49 105.07 17.49 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.522 1.139 . . . . 0.0 110.281 -179.976 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.529 ' HA ' ' CB ' ' A' ' 172' ' ' ALA . 0.0 OUTLIER -85.79 126.48 40.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.469 1.105 . . . . 0.0 109.324 179.983 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.08 -25.92 6.08 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.52 1.137 . . . . 0.0 110.327 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' ASP . . . . . 0.605 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -137.23 157.4 46.74 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.532 1.145 . . . . 0.0 109.28 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.556 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 5.5 mttt -142.66 78.82 15.67 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.526 1.141 . . . . 0.0 109.268 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.06 10.1 1.84 Allowed 'Trans proline' 0 C--N 1.36 1.141 0 O-C-N 124.528 1.804 . . . . 0.0 110.984 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -151.06 174.39 13.23 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.545 1.153 . . . . 0.0 110.261 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -99.07 7.98 45.38 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.505 1.128 . . . . 0.0 110.287 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.508 ' O ' ' N ' ' A' ' 184' ' ' VAL . 57.5 mt-30 -147.99 -45.11 0.16 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.582 1.176 . . . . 0.0 110.34 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -98.45 96.89 8.31 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 170' ' ' TRP . . . . . 0.64 ' CD2' ' CG2' ' A' ' 184' ' ' VAL . 31.5 m0 -102.06 154.82 18.62 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.521 1.138 . . . . 0.0 107.964 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . 0.43 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -88.2 111.13 21.29 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.463 1.102 . . . . 0.0 109.325 179.933 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . 0.529 ' CB ' ' HA ' ' A' ' 161' ' ' ILE . . . -134.92 166.65 22.52 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.487 1.117 . . . . 0.0 109.251 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.519 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.6 OUTLIER -96.31 155.48 16.75 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.554 1.159 . . . . 0.0 110.291 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . 0.409 ' CB ' ' HD2' ' A' ' 178' ' ' LYS . 0.7 OUTLIER -94.57 -162.08 0.91 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.442 1.089 . . . . 0.0 109.263 -179.984 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 38.1 m -79.33 7.23 8.21 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.476 1.11 . . . . 0.0 109.978 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . 0.418 ' HB2' ' HG2' ' A' ' 178' ' ' LYS . 2.6 mt-10 -125.72 -4.92 7.02 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.548 1.155 . . . . 0.0 110.291 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . 0.508 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 96.7 -12.0 66.22 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.5 1.125 . . . . 0.0 111.032 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . 0.418 ' HG2' ' HB2' ' A' ' 176' ' ' GLU . 0.1 OUTLIER -57.48 114.9 2.43 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.467 0.745 . . . . 0.0 109.29 -179.954 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . 0.453 ' HG3' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -88.94 127.34 35.65 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.52 1.137 . . . . 0.0 110.307 -179.992 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.435 ' N ' HD11 ' A' ' 151' ' ' LEU . . . -153.42 -169.74 18.81 Favored Glycine 0 CA--C 1.53 0.998 0 O-C-N 124.422 1.077 . . . . 0.0 111.001 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 181' ' ' MET . . . . . 0.45 ' N ' ' O ' ' A' ' 149' ' ' GLU . 1.9 mmt -93.55 116.38 28.89 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 124.47 0.747 . . . . 0.0 111.04 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.599 ' CD1' ' CD1' ' A' ' 159' ' ' LEU . 1.3 tp -117.12 141.37 28.37 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.492 1.12 . . . . 0.0 109.255 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 183' ' ' PRO . . . . . 0.754 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.07 128.92 11.81 Favored 'Trans proline' 0 C--N 1.361 1.186 0 O-C-N 124.492 1.786 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.854 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 10.4 t -72.75 -28.8 1.06 Allowed Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.472 1.108 . . . . 0.0 109.277 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 185' ' ' PRO . . . . . 0.854 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -75.02 -17.56 19.39 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.473 1.775 . . . . 0.0 110.989 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . 0.754 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 9.9 m-85 -100.78 -6.63 24.63 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.524 1.14 . . . . 0.0 111.021 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 187' ' ' VAL . . . . . 0.547 ' HA ' ' O ' ' A' ' 138' ' ' ARG . 2.6 m -133.98 157.68 42.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.568 1.168 . . . . 0.0 109.292 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 188' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 1.3 tm-20 -98.78 152.62 19.49 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.508 1.13 . . . . 0.0 110.293 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 9.3 mtmm -88.99 106.82 18.68 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.573 1.17 . . . . 0.0 109.273 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -90.91 -38.2 13.05 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.52 1.137 . . . . 0.0 111.05 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 191' ' ' GLY . . . . . 0.489 ' O ' ' SG ' ' A' ' 135' ' ' CYS . . . . . . . . 0 CA--C 1.53 0.997 0 O-C-N 124.548 1.155 . . . . 0.0 111.04 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.452 -0.334 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . 0.433 ' C ' HG11 ' A' ' 137' ' ' VAL . 89.0 m-85 -138.54 178.73 6.93 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.448 1.093 . . . . 0.0 111.015 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.501 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 33.5 m -145.33 139.1 21.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.571 1.169 . . . . 0.0 109.271 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.606 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 12.2 ttm180 -101.35 114.84 29.2 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.442 1.089 . . . . 0.0 110.285 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.474 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -82.86 109.72 17.24 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.476 1.11 . . . . 0.0 109.279 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.588 HD11 ' N ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -89.92 23.97 2.58 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.511 1.132 . . . . 0.0 109.28 179.995 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.422 ' CA ' ' HG2' ' A' ' 155' ' ' LYS . 39.8 m-85 -143.82 155.47 44.14 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.48 1.113 . . . . 0.0 111.002 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.31 126.48 40.65 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.545 1.153 . . . . 0.0 109.339 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.578 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.6 OUTLIER -137.98 123.1 19.19 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.485 1.115 . . . . 0.0 110.981 -179.944 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . 0.503 ' C ' ' HB3' ' A' ' 152' ' ' PRO . 3.0 m-20 -86.23 -42.49 13.74 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.522 1.139 . . . . 0.0 109.35 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 126.31 138.22 4.8 Favored Glycine 0 CA--C 1.529 0.91 0 O-C-N 124.481 1.113 . . . . 0.0 111.056 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -114.05 -34.62 5.33 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.427 0.722 . . . . 0.0 109.311 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -136.59 165.57 25.56 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.48 1.113 . . . . 0.0 109.329 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -83.02 37.66 0.55 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.497 1.123 . . . . 0.0 110.24 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -133.68 -27.1 1.53 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.511 1.132 . . . . 0.0 110.267 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.58 122.31 38.19 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.508 1.13 . . . . 0.0 109.3 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.538 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 7.7 tp -76.05 114.27 35.72 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 124.532 1.145 . . . . 0.0 109.345 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . 0.503 ' HB3' ' C ' ' A' ' 144' ' ' ASN . 18.3 Cg_endo -74.99 -178.18 3.98 Favored 'Trans proline' 0 C--N 1.359 1.089 0 O-C-N 124.551 1.816 . . . . 0.0 111.012 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.578 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 1.6 p90 173.19 -177.89 0.07 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.53 1.144 . . . . 0.0 111.024 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . 0.416 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.4 OUTLIER -119.93 138.45 53.44 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.515 1.134 . . . . 0.0 109.301 179.98 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . 0.514 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.1 OUTLIER -39.06 123.94 1.39 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.469 1.106 . . . . 0.0 109.291 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.478 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 83.98 38.61 10.11 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.522 1.139 . . . . 0.0 110.999 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -108.52 169.04 8.9 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.521 0.777 . . . . 0.0 109.301 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.489 ' C ' ' HG ' ' A' ' 159' ' ' LEU . 8.4 mm -122.22 149.41 25.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 O-C-N 124.472 1.107 . . . . 0.0 109.346 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.563 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 0.2 OUTLIER -143.78 141.21 30.31 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.543 1.152 . . . . 0.0 109.314 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.487 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.1 OUTLIER -86.66 96.73 10.23 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.456 1.098 . . . . 0.0 110.278 -179.97 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.555 ' CD1' ' HB3' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -82.71 125.61 39.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.41 1.069 . . . . 0.0 109.281 179.995 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -124.39 -22.06 4.78 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.476 1.11 . . . . 0.0 110.306 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' ASP . . . . . 0.48 ' C ' ' HG3' ' A' ' 164' ' ' LYS . 71.2 m-20 -125.46 125.31 43.12 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.52 1.137 . . . . 0.0 109.365 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.587 ' HG2' ' CE3' ' A' ' 170' ' ' TRP . 2.2 mtpt -136.47 63.08 46.53 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.559 1.162 . . . . 0.0 109.277 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . 0.441 ' HD3' ' N ' ' A' ' 164' ' ' LYS . 18.2 Cg_endo -75.03 -50.89 0.12 Allowed 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.508 1.794 . . . . 0.0 110.967 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' GLU . . . . . 0.511 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 0.6 OUTLIER -73.2 177.32 5.17 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.49 1.119 . . . . 0.0 110.359 179.979 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -117.81 47.57 1.53 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.566 1.166 . . . . 0.0 110.292 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.452 ' NE2' ' HG3' ' A' ' 185' ' ' PRO . 0.0 OUTLIER 174.87 -32.56 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.491 1.119 . . . . 0.0 110.3 -179.976 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 169' ' ' TRP . . . . . 0.581 ' CE3' ' HG2' ' A' ' 181' ' ' MET . 70.0 m95 -119.1 104.92 10.9 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.493 1.121 . . . . 0.0 108.01 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 170' ' ' TRP . . . . . 0.587 ' CE3' ' HG2' ' A' ' 164' ' ' LYS . 53.9 m0 -110.63 154.56 23.62 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . 0.474 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.9 OUTLIER -95.26 117.86 31.01 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.434 1.084 . . . . 0.0 109.326 179.918 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . 0.555 ' HB3' ' CD1' ' A' ' 161' ' ' ILE . . . -141.03 161.42 37.9 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.476 1.11 . . . . 0.0 109.28 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.563 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.8 OUTLIER -90.54 155.63 18.75 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.45 1.094 . . . . 0.0 110.326 -179.966 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . 0.516 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.4 OUTLIER -90.08 -161.41 0.79 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.449 1.093 . . . . 0.0 109.308 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 5.6 t -81.21 12.7 3.3 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.507 1.129 . . . . 0.0 109.994 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -132.23 -6.26 3.41 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.567 1.167 . . . . 0.0 110.318 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . 0.521 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 101.62 -12.98 58.15 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.476 1.11 . . . . 0.0 111.007 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . 0.48 ' O ' ' CD1' ' A' ' 151' ' ' LEU . 2.7 mtmt -52.75 113.28 1.03 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.545 0.791 . . . . 0.0 109.322 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . 0.465 ' CG ' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -89.24 125.02 34.91 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 124.531 1.145 . . . . 0.0 110.327 -179.979 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.474 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.42 -165.96 14.5 Favored Glycine 0 CA--C 1.53 1.021 0 O-C-N 124.529 1.143 . . . . 0.0 110.954 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 181' ' ' MET . . . . . 0.581 ' HG2' ' CE3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -101.88 125.85 48.64 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.529 0.782 . . . . 0.0 111.004 179.976 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.538 ' CG2' ' HB3' ' A' ' 151' ' ' LEU . 2.2 pp -121.89 149.3 53.34 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.54 1.15 . . . . 0.0 109.292 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 183' ' ' PRO . . . . . 0.895 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -74.95 125.87 9.63 Favored 'Trans proline' 0 C--N 1.359 1.124 0 O-C-N 124.591 1.837 . . . . 0.0 110.966 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.852 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 55.4 t -68.98 -29.43 1.91 Allowed Pre-proline 0 C--N 1.326 -0.436 0 O-C-N 124.492 1.12 . . . . 0.0 109.265 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 185' ' ' PRO . . . . . 0.852 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -75.04 -24.28 12.9 Favored 'Trans proline' 0 C--N 1.359 1.079 0 O-C-N 124.542 1.812 . . . . 0.0 110.995 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . 0.895 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.0 m-85 -99.58 -0.18 40.97 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.525 1.141 . . . . 0.0 110.965 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 187' ' ' VAL . . . . . 0.606 ' HA ' ' O ' ' A' ' 138' ' ' ARG . 4.2 m -134.03 154.96 38.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 O-C-N 124.464 1.102 . . . . 0.0 109.313 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 188' ' ' GLU . . . . . 0.501 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.2 OUTLIER -106.11 159.53 16.01 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 0.0 110.275 -179.991 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.69 110.72 21.21 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 124.509 1.13 . . . . 0.0 109.32 180.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -83.32 -56.89 3.51 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.505 1.128 . . . . 0.0 110.995 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.011 0 O-C-N 124.497 1.123 . . . . 0.0 110.98 -179.988 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 10.4 p . . . . . 0 N--CA 1.453 -0.319 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . 0.427 ' HB2' ' O ' ' A' ' 191' ' ' GLY . 43.0 m-85 -155.88 165.52 36.22 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.515 1.135 . . . . 0.0 111.013 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.542 HG21 ' CG2' ' A' ' 161' ' ' ILE . 19.8 m -142.86 147.02 21.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.58 1.175 . . . . 0.0 109.27 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.502 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 0.1 OUTLIER -103.08 111.55 23.96 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.523 1.139 . . . . 0.0 110.285 -179.981 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.412 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -82.12 104.39 12.42 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.501 1.126 . . . . 0.0 109.336 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.494 ' C ' ' HG2' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -88.74 24.27 2.07 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.564 1.165 . . . . 0.0 109.33 -179.998 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.497 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 9.6 m-85 -146.93 145.86 29.93 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.485 1.116 . . . . 0.0 110.989 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.6 152.26 22.75 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.57 1.169 . . . . 0.0 109.285 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.57 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.3 OUTLIER -168.48 126.56 1.1 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.434 1.084 . . . . 0.0 110.959 179.956 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . 0.472 ' HA ' ' CB ' ' A' ' 152' ' ' PRO . 15.1 t-20 -142.01 87.0 2.01 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.394 1.059 . . . . 0.0 109.307 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 104.22 121.72 4.97 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.495 1.122 . . . . 0.0 111.026 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . 0.482 ' HB2' ' CE1' ' A' ' 143' ' ' PHE . 17.5 t-20 -146.35 -62.32 0.31 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.494 0.761 . . . . 0.0 109.326 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -144.77 -175.88 4.85 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.526 1.141 . . . . 0.0 109.338 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -87.05 35.56 0.7 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.433 1.083 . . . . 0.0 110.348 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -176.39 32.78 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.485 1.116 . . . . 0.0 110.283 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.601 ' OD2' ' CZ3' ' A' ' 169' ' ' TRP . 3.2 t70 -117.3 139.87 50.27 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.521 1.138 . . . . 0.0 109.326 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.439 ' O ' ' CG2' ' A' ' 182' ' ' ILE . 8.8 tp -100.55 107.34 48.03 Favored Pre-proline 0 C--N 1.325 -0.483 0 O-C-N 124.455 1.097 . . . . 0.0 109.258 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . 0.472 ' CB ' ' HA ' ' A' ' 144' ' ' ASN . 18.2 Cg_endo -75.08 179.03 6.51 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.491 1.785 . . . . 0.0 111.035 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.57 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 0.4 OUTLIER -177.58 -171.81 0.33 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.43 1.081 . . . . 0.0 111.033 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.82 139.96 53.44 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.545 1.153 . . . . 0.0 109.287 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . 0.494 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -44.26 115.53 0.86 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.543 1.152 . . . . 0.0 109.312 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.444 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 93.35 43.73 3.93 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 124.605 1.191 . . . . 0.0 111.025 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -115.53 170.94 8.05 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.458 0.74 . . . . 0.0 109.295 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' ILE . . . . . 0.442 HG22 ' N ' ' A' ' 159' ' ' LEU . 48.8 mm -120.66 144.99 27.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.529 1.143 . . . . 0.0 109.376 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . 0.601 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 0.5 OUTLIER -140.88 133.74 29.03 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.497 1.123 . . . . 0.0 109.286 -179.91 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.483 ' C ' ' HB2' ' A' ' 172' ' ' ALA . 8.5 ttp85 -89.83 106.85 18.75 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.484 1.115 . . . . 0.0 110.298 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.542 ' CG2' HG21 ' A' ' 137' ' ' VAL . 0.5 OUTLIER -83.42 127.8 39.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 124.468 1.105 . . . . 0.0 109.259 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.47 -20.59 6.01 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 124.498 1.124 . . . . 0.0 110.275 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' ASP . . . . . 0.447 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 3.7 m-20 -135.63 148.76 49.11 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.517 1.135 . . . . 0.0 109.343 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.569 ' HG3' ' CE2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -145.68 76.36 12.92 Favored Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.36 1.038 . . . . 0.0 109.334 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -74.89 -46.95 0.22 Allowed 'Trans proline' 0 C--N 1.36 1.183 0 O-C-N 124.504 1.792 . . . . 0.0 111.049 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -91.17 173.87 7.7 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.416 1.072 . . . . 0.0 110.278 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . 0.458 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 1.6 mm-40 -104.04 36.43 2.35 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.453 1.096 . . . . 0.0 110.358 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 184' ' ' VAL . 3.3 mt-30 -173.09 -39.06 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.58 1.175 . . . . 0.0 110.312 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 169' ' ' TRP . . . . . 0.601 ' CZ3' ' OD2' ' A' ' 150' ' ' ASP . 85.6 m95 -109.66 98.6 7.92 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.527 1.142 . . . . 0.0 107.994 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 170' ' ' TRP . . . . . 0.595 ' CD2' HG23 ' A' ' 184' ' ' VAL . 20.7 m0 -105.01 160.04 15.34 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.5 1.125 . . . . 0.0 108.041 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . 0.545 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -92.02 112.16 23.99 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.53 1.144 . . . . 0.0 109.283 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . 0.499 ' CB ' HG22 ' A' ' 161' ' ' ILE . . . -135.0 164.17 28.23 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.575 1.172 . . . . 0.0 109.283 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.601 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 18.6 mp0 -95.02 157.87 15.71 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.481 1.113 . . . . 0.0 110.229 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 174' ' ' ASP . . . . . 0.506 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.4 OUTLIER -90.21 -158.89 0.56 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.564 1.165 . . . . 0.0 109.295 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 24.6 m -83.34 10.67 8.1 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.539 1.15 . . . . 0.0 109.958 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -133.61 -5.23 2.89 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.553 1.158 . . . . 0.0 110.294 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . 0.527 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 106.58 -17.59 39.29 Favored Glycine 0 CA--C 1.53 1.031 0 O-C-N 124.502 1.126 . . . . 0.0 110.983 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . 0.444 ' O ' ' HA ' ' A' ' 173' ' ' GLU . 0.6 OUTLIER -42.87 109.43 0.14 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.495 0.762 . . . . 0.0 109.336 179.956 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . 0.472 ' HG2' ' OE2' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -91.3 123.19 34.55 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.494 1.121 . . . . 0.0 110.278 -179.986 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.545 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -157.25 -162.89 11.93 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.5 1.125 . . . . 0.0 110.998 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 41.5 mtp -104.78 120.75 42.12 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.446 0.733 . . . . 0.0 110.999 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.439 ' CG2' ' O ' ' A' ' 151' ' ' LEU . 2.5 pp -120.88 150.89 53.93 Favored Pre-proline 0 C--N 1.325 -0.47 0 O-C-N 124.489 1.118 . . . . 0.0 109.369 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 183' ' ' PRO . . . . . 0.776 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.02 131.27 14.07 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.451 1.764 . . . . 0.0 110.995 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.868 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 53.9 t -74.43 -28.98 0.9 Allowed Pre-proline 0 C--N 1.324 -0.521 0 O-C-N 124.509 1.131 . . . . 0.0 109.272 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 185' ' ' PRO . . . . . 0.868 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.2 Cg_endo -74.99 -19.25 18.05 Favored 'Trans proline' 0 C--N 1.361 1.191 0 O-C-N 124.442 1.759 . . . . 0.0 111.026 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . 0.776 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 8.5 m-85 -98.57 -1.36 41.22 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.532 1.145 . . . . 0.0 110.997 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 187' ' ' VAL . . . . . 0.502 ' HA ' ' O ' ' A' ' 138' ' ' ARG . 7.5 m -134.68 156.37 39.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 124.534 1.146 . . . . 0.0 109.26 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 188' ' ' GLU . . . . . 0.444 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 1.5 pp20? -108.55 168.12 9.55 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.489 1.118 . . . . 0.0 110.274 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . 0.417 ' O ' ' OE2' ' A' ' 188' ' ' GLU . 0.1 OUTLIER -86.75 116.09 24.62 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.555 1.159 . . . . 0.0 109.244 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -108.2 -34.43 6.84 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.486 1.116 . . . . 0.0 110.987 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 191' ' ' GLY . . . . . 0.427 ' O ' ' HB2' ' A' ' 136' ' ' TYR . . . . . . . . 0 CA--C 1.529 0.96 0 O-C-N 124.567 1.167 . . . . 0.0 110.99 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.452 -0.329 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 136' ' ' TYR . . . . . 0.558 ' CE2' ' HB2' ' A' ' 160' ' ' ARG . 80.2 m-85 -152.71 169.23 23.24 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.541 1.15 . . . . 0.0 110.996 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.567 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 26.8 m -145.54 148.41 17.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.487 1.117 . . . . 0.0 109.306 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.504 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 5.6 ttp180 -104.34 111.47 24.12 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.514 1.134 . . . . 0.0 110.314 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.483 ' CB ' HG12 ' A' ' 187' ' ' VAL . . . -80.18 107.05 12.66 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.508 1.13 . . . . 0.0 109.34 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.404 ' O ' ' HG2' ' A' ' 155' ' ' LYS . 1.1 mt -88.33 21.8 2.72 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.5 1.125 . . . . 0.0 109.287 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.507 ' CD1' ' HA ' ' A' ' 186' ' ' TYR . 72.3 m-85 -141.55 138.86 32.99 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.487 1.117 . . . . 0.0 111.01 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.28 153.46 25.85 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.469 1.105 . . . . 0.0 109.319 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.597 ' HB3' ' CE1' ' A' ' 153' ' ' PHE . 4.7 t80 . . . . . 0 C--N 1.325 -0.49 0 O-C-N 124.505 1.128 . . . . 0.0 110.991 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.762 HD23 ' CG1' ' A' ' 182' ' ' ILE . 34.7 tp . . . . . 0 N--CA 1.453 -0.305 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' PRO . . . . . 0.596 ' HD2' HD12 ' A' ' 151' ' ' LEU . 18.4 Cg_endo -75.03 170.2 20.93 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.535 1.808 . . . . 0.0 111.029 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.597 ' CE1' ' HB3' ' A' ' 143' ' ' PHE . 0.7 OUTLIER -173.83 -175.59 1.1 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.502 1.126 . . . . 0.0 110.966 -179.996 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 154' ' ' LYS . . . . . 0.439 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -131.56 135.87 47.36 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.505 1.128 . . . . 0.0 109.313 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 155' ' ' LYS . . . . . 0.439 ' C ' ' O ' ' A' ' 154' ' ' LYS . 0.0 OUTLIER -37.54 110.88 0.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.511 1.132 . . . . 0.0 109.353 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 94.79 42.41 3.86 Favored Glycine 0 CA--C 1.529 0.955 0 O-C-N 124.496 1.122 . . . . 0.0 110.999 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 157' ' ' ASP . . . . . 0.431 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 17.6 t70 -111.68 165.88 11.65 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.496 0.762 . . . . 0.0 109.339 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.465 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 4.9 mp -119.89 140.16 44.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.504 1.128 . . . . 0.0 109.338 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.742 HD13 HD12 ' A' ' 182' ' ' ILE . 0.8 OUTLIER -137.07 134.64 36.72 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.5 1.125 . . . . 0.0 109.297 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.558 ' HB2' ' CE2' ' A' ' 136' ' ' TYR . 10.0 ttm180 -87.1 104.07 15.99 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.507 1.129 . . . . 0.0 110.28 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 161' ' ' ILE . . . . . 0.795 HG22 ' HB2' ' A' ' 172' ' ' ALA . 0.8 OUTLIER -84.62 125.93 40.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.44 1.088 . . . . 0.0 109.286 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 5.9 ptt180 -121.43 -24.94 5.28 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.45 1.094 . . . . 0.0 110.279 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 163' ' ' ASP . . . . . 0.446 ' HB2' ' CB ' ' A' ' 171' ' ' ASN . 79.2 m-20 -126.4 131.82 51.66 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.471 1.107 . . . . 0.0 109.261 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 164' ' ' LYS . . . . . 0.548 ' CG ' HD13 ' A' ' 161' ' ' ILE . 0.0 OUTLIER -133.46 69.62 76.96 Favored Pre-proline 0 C--N 1.325 -0.466 0 O-C-N 124.473 1.108 . . . . 0.0 109.248 179.998 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.02 -52.15 0.11 Allowed 'Trans proline' 0 C--N 1.359 1.12 0 O-C-N 124.512 1.796 . . . . 0.0 111.002 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 166' ' ' GLU . . . . . 0.444 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 4.1 mm-40 -76.73 175.1 9.71 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.478 1.111 . . . . 0.0 110.267 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 167' ' ' GLU . . . . . 0.522 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 3.3 pt-20 -106.56 31.69 5.05 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.467 1.104 . . . . 0.0 110.321 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.522 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 3.1 mt-30 -172.35 -40.17 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.475 1.11 . . . . 0.0 110.316 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -106.04 104.57 14.3 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 0.0 107.981 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 170' ' ' TRP . . . . . 0.704 ' CE2' HG21 ' A' ' 184' ' ' VAL . 50.1 m0 -109.45 154.6 22.4 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.527 1.142 . . . . 0.0 107.988 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 171' ' ' ASN . . . . . 0.468 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 1.0 OUTLIER -88.25 111.06 21.24 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.503 1.127 . . . . 0.0 109.355 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 172' ' ' ALA . . . . . 0.795 ' HB2' HG22 ' A' ' 161' ' ' ILE . . . -127.51 167.34 16.43 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.492 1.12 . . . . 0.0 109.292 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.51 ' CG ' ' O ' ' A' ' 177' ' ' GLY . 6.9 mp0 -101.39 156.28 17.55 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.473 1.108 . . . . 0.0 110.287 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 174' ' ' ASP . . . . . 0.654 ' HB3' HD11 ' A' ' 151' ' ' LEU . 45.2 p-10 -93.85 -160.19 0.75 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.444 1.09 . . . . 0.0 109.316 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 45.0 t -80.92 11.46 3.97 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.478 1.111 . . . . 0.0 109.996 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -132.22 -2.25 3.56 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.435 1.084 . . . . 0.0 110.337 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 177' ' ' GLY . . . . . 0.51 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 96.01 -12.28 67.12 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.462 1.102 . . . . 0.0 110.985 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 178' ' ' LYS . . . . . 0.478 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 2.9 mtpp -52.67 113.25 1.01 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.474 0.749 . . . . 0.0 109.303 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 179' ' ' ARG . . . . . 0.441 ' HG2' ' CD ' ' A' ' 173' ' ' GLU . 0.5 OUTLIER -87.89 126.26 34.94 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.485 1.116 . . . . 0.0 110.304 -179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 180' ' ' GLY . . . . . 0.468 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -152.72 -169.3 17.83 Favored Glycine 0 CA--C 1.53 1.002 0 O-C-N 124.522 1.139 . . . . 0.0 110.993 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.4 mmt -86.78 126.03 34.33 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.528 0.781 . . . . 0.0 111.024 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.762 ' CG1' HD23 ' A' ' 151' ' ' LEU . 18.1 mm -121.5 134.56 24.58 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.475 1.109 . . . . 0.0 109.313 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 183' ' ' PRO . . . . . 0.683 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.2 Cg_endo -75.01 121.13 6.38 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.543 1.812 . . . . 0.0 111.025 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.835 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 9.8 t -69.66 -30.28 2.04 Favored Pre-proline 0 C--N 1.325 -0.475 0 O-C-N 124.51 1.131 . . . . 0.0 109.299 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 185' ' ' PRO . . . . . 0.835 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -75.03 -23.96 13.24 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.527 1.804 . . . . 0.0 111.003 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.681 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.5 m-85 -100.32 -5.02 28.02 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.545 1.153 . . . . 0.0 110.989 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 187' ' ' VAL . . . . . 0.701 HG11 ' CG2' ' A' ' 182' ' ' ILE . 3.3 m -128.49 152.63 36.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.539 1.149 . . . . 0.0 109.273 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 188' ' ' GLU . . . . . 0.567 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.0 OUTLIER -107.98 166.08 10.98 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.491 1.119 . . . . 0.0 110.322 179.992 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.501 0 O-C-N 124.491 1.12 . . . . 0.0 109.325 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' CYS . . . . . 0.553 ' HB3' ' CE2' ' A' ' 136' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 136' ' ' TYR . . . . . 0.553 ' CE2' ' HB3' ' A' ' 135' ' ' CYS . 68.1 m-85 -151.3 173.9 13.94 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.475 1.109 . . . . 0.0 111.035 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.522 ' HB ' ' CG2' ' A' ' 187' ' ' VAL . 4.2 m -147.67 149.55 15.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 O-C-N 124.492 1.12 . . . . 0.0 109.302 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.83 HH21 HD21 ' A' ' 140' ' ' LEU . 16.4 ttp180 -105.25 107.49 18.5 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.501 1.126 . . . . 0.0 110.316 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.482 ' CB ' HG12 ' A' ' 187' ' ' VAL . . . -80.92 103.95 11.1 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.47 1.106 . . . . 0.0 109.371 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.83 HD21 HH21 ' A' ' 138' ' ' ARG . 2.9 mp -88.89 22.99 2.49 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.527 1.142 . . . . 0.0 109.332 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.429 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 36.4 m-85 -144.01 145.2 32.05 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.514 1.134 . . . . 0.0 111.009 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 142' ' ' ASP . . . . . 0.402 ' N ' ' HB2' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -87.63 152.66 21.99 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.563 1.164 . . . . 0.0 109.328 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.603 ' HB3' ' CZ ' ' A' ' 153' ' ' PHE . 5.8 t80 . . . . . 0 C--N 1.326 -0.449 0 O-C-N 124.469 1.105 . . . . 0.0 111.013 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.66 HD22 ' O ' ' A' ' 172' ' ' ALA . 11.6 tp . . . . . 0 N--CA 1.453 -0.287 0 N-CA-C 109.344 -0.614 . . . . 0.0 109.344 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.08 133.62 16.69 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.417 1.746 . . . . 0.0 110.967 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.603 ' CZ ' ' HB3' ' A' ' 143' ' ' PHE . 4.8 p90 -150.8 -179.05 6.95 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 0.0 111.023 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -130.94 147.16 52.54 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.447 1.092 . . . . 0.0 109.238 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 155' ' ' LYS . . . . . 0.412 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -56.34 118.12 4.46 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.538 1.149 . . . . 0.0 109.365 179.941 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 99.72 35.57 4.56 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.472 1.108 . . . . 0.0 110.984 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -120.61 170.29 9.56 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.522 0.778 . . . . 0.0 109.286 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.486 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 5.2 mt -119.46 148.23 22.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 O-C-N 124.553 1.158 . . . . 0.0 109.268 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.644 HD23 ' HA ' ' A' ' 174' ' ' ASP . 0.4 OUTLIER -139.79 136.69 34.33 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.496 1.123 . . . . 0.0 109.28 -179.976 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.445 ' HB3' ' HB2' ' A' ' 173' ' ' GLU . 6.1 ttt-85 -87.69 100.96 13.21 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.554 1.159 . . . . 0.0 110.275 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 161' ' ' ILE . . . . . 0.916 HD11 ' HG2' ' A' ' 164' ' ' LYS . 0.0 OUTLIER -86.1 130.55 36.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.566 1.166 . . . . 0.0 109.322 179.946 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -129.19 -24.49 2.85 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.5 1.125 . . . . 0.0 110.32 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 163' ' ' ASP . . . . . 0.427 ' HB2' ' CB ' ' A' ' 171' ' ' ASN . 8.7 m-20 -124.78 147.97 48.39 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.406 1.066 . . . . 0.0 109.305 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 164' ' ' LYS . . . . . 0.916 ' HG2' HD11 ' A' ' 161' ' ' ILE . 10.9 mtmm -144.0 71.32 16.71 Favored Pre-proline 0 C--N 1.324 -0.508 0 O-C-N 124.535 1.147 . . . . 0.0 109.272 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -75.01 4.97 4.27 Favored 'Trans proline' 0 C--N 1.36 1.172 0 O-C-N 124.453 1.765 . . . . 0.0 111.05 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 166' ' ' GLU . . . . . 0.468 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 26.3 mm-40 -141.46 172.75 12.25 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.469 1.106 . . . . 0.0 110.316 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -100.07 16.38 24.25 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.521 1.138 . . . . 0.0 110.318 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -157.84 -43.19 0.06 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.53 1.144 . . . . 0.0 110.26 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 169' ' ' TRP . . . . . 0.502 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 90.0 m95 -100.18 101.03 11.96 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 170' ' ' TRP . . . . . 0.779 ' CE2' HG21 ' A' ' 184' ' ' VAL . 28.8 m0 -107.96 154.45 21.61 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.545 1.153 . . . . 0.0 108.026 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 171' ' ' ASN . . . . . 0.449 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.5 OUTLIER -87.77 111.79 21.73 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.471 1.107 . . . . 0.0 109.264 -179.921 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 172' ' ' ALA . . . . . 0.66 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -132.81 163.7 28.49 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.556 1.16 . . . . 0.0 109.286 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.494 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.6 OUTLIER -95.98 158.88 15.25 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.493 1.12 . . . . 0.0 110.288 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 174' ' ' ASP . . . . . 0.644 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.2 OUTLIER -94.58 -166.18 1.43 Allowed 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.512 1.133 . . . . 0.0 109.261 -179.898 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.91 5.64 6.2 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.529 1.143 . . . . 0.0 110.042 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -124.64 -5.31 7.59 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.444 1.09 . . . . 0.0 110.264 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 177' ' ' GLY . . . . . 0.488 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 98.34 -7.48 61.94 Favored Glycine 0 CA--C 1.53 0.979 0 O-C-N 124.429 1.081 . . . . 0.0 110.99 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 178' ' ' LYS . . . . . 0.635 ' O ' HD11 ' A' ' 151' ' ' LEU . 5.4 mtmt -56.76 112.77 1.4 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.481 0.753 . . . . 0.0 109.322 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 179' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.1 OUTLIER -87.8 123.37 32.52 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.49 1.119 . . . . 0.0 110.322 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 180' ' ' GLY . . . . . 0.604 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -155.46 -162.93 11.66 Favored Glycine 0 CA--C 1.531 1.072 0 O-C-N 124.514 1.134 . . . . 0.0 110.959 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 181' ' ' MET . . . . . 0.502 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.2 OUTLIER -88.25 130.65 35.04 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.606 0.827 . . . . 0.0 111.005 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.639 HD12 HD13 ' A' ' 159' ' ' LEU . 23.0 mm -126.92 131.83 24.05 Favored Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 124.53 1.144 . . . . 0.0 109.255 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 183' ' ' PRO . . . . . 0.751 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.3 Cg_endo -75.02 123.19 7.69 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.485 1.782 . . . . 0.0 110.944 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.827 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 14.0 t -71.93 -31.08 1.64 Allowed Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.496 1.123 . . . . 0.0 109.331 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 185' ' ' PRO . . . . . 0.827 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.96 -21.01 16.38 Favored 'Trans proline' 0 C--N 1.36 1.145 0 O-C-N 124.508 1.794 . . . . 0.0 111.057 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.685 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.9 m-85 -97.72 -21.47 16.97 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.481 1.113 . . . . 0.0 110.984 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 187' ' ' VAL . . . . . 0.751 HG13 ' O ' ' A' ' 183' ' ' PRO . 1.4 m -116.35 157.93 17.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.474 1.109 . . . . 0.0 109.371 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 188' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.2 OUTLIER -102.24 163.61 12.14 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.428 1.08 . . . . 0.0 110.331 179.968 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 189' ' ' LYS . . . . . 0.61 ' NZ ' HG22 ' A' ' 184' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.448 0 O-C-N 124.573 1.17 . . . . 0.0 109.3 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 27.0 p . . . . . 0 N--CA 1.452 -0.343 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 136' ' ' TYR . . . . . 0.576 ' CE1' ' HB2' ' A' ' 160' ' ' ARG . 12.7 m-85 -130.21 164.64 24.07 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.489 1.118 . . . . 0.0 111.044 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.756 HG21 ' CG2' ' A' ' 187' ' ' VAL . 0.5 OUTLIER -147.69 165.06 6.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.547 1.154 . . . . 0.0 109.274 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.5 ' N ' HG23 ' A' ' 137' ' ' VAL . 2.5 ttm180 -125.49 118.68 26.31 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.498 1.124 . . . . 0.0 110.324 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.475 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -84.03 113.33 20.94 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.493 1.121 . . . . 0.0 109.287 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.8 mt -87.14 20.28 2.78 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.565 1.165 . . . . 0.0 109.329 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.446 ' CD2' ' CD2' ' A' ' 186' ' ' TYR . 17.8 t80 -142.8 166.78 23.72 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 124.467 1.105 . . . . 0.0 110.958 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -106.78 154.7 20.61 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.484 1.115 . . . . 0.0 109.321 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.465 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 11.0 t80 . . . . . 0 C--N 1.324 -0.505 0 O-C-N 124.495 1.122 . . . . 0.0 111.037 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.504 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 13.0 tp . . . . . 0 N--CA 1.453 -0.295 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' PRO . . . . . 0.452 ' CB ' ' O ' ' A' ' 143' ' ' PHE . 18.3 Cg_endo -74.92 169.53 22.41 Favored 'Trans proline' 0 C--N 1.36 1.151 0 O-C-N 124.558 1.82 . . . . 0.0 111.039 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.465 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 2.0 p90 -174.86 173.13 2.79 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.522 1.139 . . . . 0.0 110.99 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 154' ' ' LYS . . . . . 0.495 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -123.39 127.3 48.27 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.529 1.143 . . . . 0.0 109.301 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 155' ' ' LYS . . . . . 0.495 ' C ' ' O ' ' A' ' 154' ' ' LYS . 0.9 OUTLIER -32.58 107.51 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.544 0 O-C-N 124.542 1.151 . . . . 0.0 109.298 -179.975 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 99.79 39.5 3.36 Favored Glycine 0 CA--C 1.53 0.988 0 O-C-N 124.453 1.096 . . . . 0.0 110.975 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 157' ' ' ASP . . . . . 0.477 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 22.2 t70 -111.9 172.05 7.13 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.454 0.737 . . . . 0.0 109.32 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.742 HD13 ' O ' ' A' ' 137' ' ' VAL . 6.1 mm -123.64 149.31 27.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.502 1.126 . . . . 0.0 109.294 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.953 HD13 HG21 ' A' ' 182' ' ' ILE . 3.1 mt -145.86 140.07 26.78 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.456 1.098 . . . . 0.0 109.311 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.576 ' HB2' ' CE1' ' A' ' 136' ' ' TYR . 1.9 ttt180 -88.64 102.17 14.7 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.514 1.134 . . . . 0.0 110.302 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 161' ' ' ILE . . . . . 0.998 HD12 ' HB2' ' A' ' 172' ' ' ALA . 0.1 OUTLIER -83.12 124.13 39.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.535 1.147 . . . . 0.0 109.287 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -118.91 -25.11 6.37 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.545 1.153 . . . . 0.0 110.335 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 163' ' ' ASP . . . . . 0.455 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 1.4 m-20 -131.74 157.77 42.92 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.53 1.144 . . . . 0.0 109.236 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 164' ' ' LYS . . . . . 0.518 ' HB2' ' CG ' ' A' ' 170' ' ' TRP . 0.7 OUTLIER -165.13 65.29 1.1 Allowed Pre-proline 0 C--N 1.326 -0.432 0 O-C-N 124.497 1.123 . . . . 0.0 109.289 -179.956 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 6.46 3.37 Favored 'Trans proline' 0 C--N 1.359 1.131 0 O-C-N 124.473 1.775 . . . . 0.0 110.992 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 166' ' ' GLU . . . . . 0.446 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 6.5 mm-40 -131.21 171.04 13.76 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.457 1.098 . . . . 0.0 110.279 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 167' ' ' GLU . . . . . 0.518 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 2.5 mt-10 -112.56 48.07 1.03 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.448 1.092 . . . . 0.0 110.277 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.518 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 1.3 mt-30 173.64 -32.12 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.487 1.117 . . . . 0.0 110.281 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 169' ' ' TRP . . . . . 0.436 ' O ' ' HB2' ' A' ' 166' ' ' GLU . 76.3 m95 -123.27 103.26 8.41 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.524 1.14 . . . . 0.0 107.994 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 170' ' ' TRP . . . . . 0.972 ' HB2' HD11 ' A' ' 161' ' ' ILE . 30.0 m0 -108.68 169.68 8.51 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.48 1.112 . . . . 0.0 108.002 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 171' ' ' ASN . . . . . 0.512 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -104.96 115.87 31.0 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.5 1.125 . . . . 0.0 109.236 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 172' ' ' ALA . . . . . 0.998 ' HB2' HD12 ' A' ' 161' ' ' ILE . . . -133.88 167.97 19.6 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.485 1.116 . . . . 0.0 109.307 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.538 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 4.0 mp0 -100.44 158.67 15.73 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.533 1.146 . . . . 0.0 110.297 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 174' ' ' ASP . . . . . 0.496 ' OD1' ' N ' ' A' ' 177' ' ' GLY . 44.2 p-10 -94.55 -161.25 0.84 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.574 1.171 . . . . 0.0 109.298 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.73 14.06 2.85 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.528 1.143 . . . . 0.0 109.97 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -133.47 -5.34 2.94 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.474 1.109 . . . . 0.0 110.297 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 177' ' ' GLY . . . . . 0.51 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 99.85 -12.72 60.91 Favored Glycine 0 CA--C 1.531 1.039 0 O-C-N 124.477 1.111 . . . . 0.0 110.921 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 178' ' ' LYS . . . . . 0.433 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 2.8 mttm -53.78 112.75 0.99 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.506 0.768 . . . . 0.0 109.298 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 179' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -88.51 128.08 35.54 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.402 1.064 . . . . 0.0 110.356 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 180' ' ' GLY . . . . . 0.512 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -152.73 -167.87 16.03 Favored Glycine 0 CA--C 1.529 0.966 0 O-C-N 124.454 1.096 . . . . 0.0 111.039 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -96.75 118.91 34.22 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.522 0.778 . . . . 0.0 111.06 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.953 HG21 HD13 ' A' ' 159' ' ' LEU . 4.8 pt -112.77 141.39 25.32 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.505 1.128 . . . . 0.0 109.333 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 183' ' ' PRO . . . . . 0.775 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.1 Cg_endo -75.01 126.74 10.16 Favored 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.48 1.779 . . . . 0.0 111.058 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.828 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 48.8 t -71.98 -30.61 1.52 Allowed Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.498 1.124 . . . . 0.0 109.248 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 185' ' ' PRO . . . . . 0.828 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.94 -26.69 10.81 Favored 'Trans proline' 0 C--N 1.36 1.16 0 O-C-N 124.459 1.768 . . . . 0.0 111.005 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.775 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 7.2 m-85 -98.76 2.46 46.95 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.451 1.094 . . . . 0.0 110.986 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 187' ' ' VAL . . . . . 0.756 ' CG2' HG21 ' A' ' 137' ' ' VAL . 2.0 m -140.02 160.25 26.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 124.453 1.096 . . . . 0.0 109.365 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 188' ' ' GLU . . . . . 0.412 ' O ' ' HB ' ' A' ' 137' ' ' VAL . 0.9 OUTLIER -111.45 149.08 31.79 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.544 1.152 . . . . 0.0 110.249 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.496 0 O-C-N 124.553 1.158 . . . . 0.0 109.274 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' CYS . . . . . 0.491 ' HB3' ' CE2' ' A' ' 136' ' ' TYR . 1.3 m . . . . . 0 N--CA 1.453 -0.313 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' TYR . . . . . 0.558 ' CE1' ' HD2' ' A' ' 160' ' ' ARG . 34.6 m-85 -150.58 177.62 9.86 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.514 1.134 . . . . 0.0 111.007 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.877 HG21 HD11 ' A' ' 182' ' ' ILE . 9.9 m -143.85 141.04 25.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.479 1.112 . . . . 0.0 109.302 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.633 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 14.0 ttp180 -99.65 112.28 24.52 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.551 1.157 . . . . 0.0 110.291 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.489 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -80.07 112.37 17.31 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.579 1.174 . . . . 0.0 109.309 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.65 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.1 OUTLIER -91.15 22.9 3.51 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.586 1.179 . . . . 0.0 109.312 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.486 ' CG ' ' CD2' ' A' ' 186' ' ' TYR . 55.3 m-85 -147.36 156.24 42.72 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.549 1.156 . . . . 0.0 110.926 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.67 128.59 45.0 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.582 1.176 . . . . 0.0 109.27 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.622 ' HB3' ' CZ ' ' A' ' 153' ' ' PHE . 0.8 OUTLIER . . . . . 0 C--N 1.326 -0.447 0 O-C-N 124.468 1.105 . . . . 0.0 111.011 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.64 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 14.6 tp . . . . . 0 N--CA 1.454 -0.262 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 135.11 18.6 Favored 'Trans proline' 0 C--N 1.36 1.171 0 O-C-N 124.508 1.794 . . . . 0.0 111.04 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.622 ' CZ ' ' HB3' ' A' ' 143' ' ' PHE . 4.8 p90 -157.25 -178.59 7.47 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.469 1.105 . . . . 0.0 110.947 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.93 142.7 50.86 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.501 1.126 . . . . 0.0 109.273 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 4.7 ttpt -48.67 118.83 2.73 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.452 1.095 . . . . 0.0 109.29 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 91.82 42.99 4.6 Favored Glycine 0 CA--C 1.529 0.953 0 O-C-N 124.446 1.091 . . . . 0.0 110.981 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 157' ' ' ASP . . . . . 0.451 ' C ' HD12 ' A' ' 158' ' ' ILE . 17.8 t70 -121.91 171.11 9.16 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.468 0.746 . . . . 0.0 109.271 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.583 ' O ' HD23 ' A' ' 159' ' ' LEU . 2.8 mp -119.62 147.97 22.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.523 1.14 . . . . 0.0 109.279 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.906 HD12 HD13 ' A' ' 182' ' ' ILE . 3.4 mt -143.5 139.9 30.04 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.443 1.089 . . . . 0.0 109.237 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.558 ' HD2' ' CE1' ' A' ' 136' ' ' TYR . 8.3 ttt180 -84.59 101.37 12.06 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.564 1.165 . . . . 0.0 110.265 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 161' ' ' ILE . . . . . 0.822 HD12 ' HB2' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -82.91 122.67 37.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 O-C-N 124.511 1.132 . . . . 0.0 109.244 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.24 -26.73 5.81 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.54 1.15 . . . . 0.0 110.293 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.14 154.17 39.0 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.537 1.148 . . . . 0.0 109.32 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 164' ' ' LYS . . . . . 0.474 ' HB2' ' CE2' ' A' ' 170' ' ' TRP . 5.6 ptpp? -165.85 71.14 1.26 Allowed Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.544 1.152 . . . . 0.0 109.253 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.09 -38.38 1.57 Allowed 'Trans proline' 0 C--N 1.36 1.164 0 O-C-N 124.463 1.77 . . . . 0.0 110.946 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 166' ' ' GLU . . . . . 0.44 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.3 mt-10 -85.58 -177.65 6.47 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.492 1.12 . . . . 0.0 110.277 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -114.1 17.33 17.82 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.416 1.073 . . . . 0.0 110.233 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.453 ' O ' ' N ' ' A' ' 184' ' ' VAL . 33.5 mt-30 -152.13 -40.05 0.11 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.481 1.113 . . . . 0.0 110.288 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 169' ' ' TRP . . . . . 0.439 ' CE3' ' HG2' ' A' ' 181' ' ' MET . 73.9 m95 -107.54 111.18 23.33 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 170' ' ' TRP . . . . . 0.767 ' HB2' HD11 ' A' ' 161' ' ' ILE . 51.3 m0 -114.84 164.17 14.48 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.552 1.158 . . . . 0.0 108.063 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 171' ' ' ASN . . . . . 0.411 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -102.57 121.76 43.02 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.546 1.153 . . . . 0.0 109.304 -179.967 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 172' ' ' ALA . . . . . 0.822 ' HB2' HD12 ' A' ' 161' ' ' ILE . . . -141.91 162.3 35.83 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.49 1.119 . . . . 0.0 109.312 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.519 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 2.2 mp0 -96.48 154.41 17.29 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.476 1.11 . . . . 0.0 110.246 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 174' ' ' ASP . . . . . 0.475 ' N ' HD21 ' A' ' 151' ' ' LEU . 0.2 OUTLIER -89.13 -162.01 0.82 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.485 1.116 . . . . 0.0 109.268 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 2.4 m -79.18 5.73 11.43 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.47 1.106 . . . . 0.0 109.973 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -123.8 -5.38 8.04 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.466 1.104 . . . . 0.0 110.327 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 177' ' ' GLY . . . . . 0.501 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 97.48 -6.41 63.13 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.555 1.159 . . . . 0.0 110.969 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 178' ' ' LYS . . . . . 0.603 ' O ' HD11 ' A' ' 151' ' ' LEU . 0.9 OUTLIER -57.26 111.92 1.22 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.478 0.752 . . . . 0.0 109.292 -179.974 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 179' ' ' ARG . . . . . 0.434 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -87.02 125.57 34.18 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.46 1.1 . . . . 0.0 110.29 179.983 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 180' ' ' GLY . . . . . 0.505 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -154.75 -173.97 24.2 Favored Glycine 0 CA--C 1.531 1.035 0 O-C-N 124.46 1.1 . . . . 0.0 110.98 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 181' ' ' MET . . . . . 0.439 ' HG2' ' CE3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -96.67 128.06 43.25 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.526 0.78 . . . . 0.0 111.013 179.962 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.929 HD12 HG11 ' A' ' 187' ' ' VAL . 4.2 pt -128.38 156.65 76.56 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.448 1.093 . . . . 0.0 109.287 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 183' ' ' PRO . . . . . 0.807 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.1 Cg_endo -75.04 132.79 15.77 Favored 'Trans proline' 0 C--N 1.361 1.197 0 O-C-N 124.488 1.783 . . . . 0.0 111.003 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.825 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 39.2 t -78.38 -31.95 0.81 Allowed Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.525 1.141 . . . . 0.0 109.319 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 185' ' ' PRO . . . . . 0.825 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.99 -26.07 11.29 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.467 1.772 . . . . 0.0 110.983 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.779 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 2.9 m-85 -96.58 7.66 46.02 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.488 1.117 . . . . 0.0 110.958 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 187' ' ' VAL . . . . . 0.929 HG11 HD12 ' A' ' 182' ' ' ILE . 3.5 m -135.98 151.98 29.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 O-C-N 124.417 1.073 . . . . 0.0 109.322 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 188' ' ' GLU . . . . . 0.558 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 39.4 tt0 -101.85 153.25 20.0 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.499 1.124 . . . . 0.0 110.264 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 2.3 ptmm? . . . . . 0 C--N 1.326 -0.439 0 O-C-N 124.524 1.14 . . . . 0.0 109.272 179.995 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 135' ' ' CYS . . . . . 0.414 ' O ' ' HG3' ' A' ' 160' ' ' ARG . 3.6 m . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -150.93 163.35 38.9 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.526 1.141 . . . . 0.0 111.044 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.615 HG22 ' O ' ' A' ' 159' ' ' LEU . 13.5 m -144.58 136.21 21.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.517 1.136 . . . . 0.0 109.296 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.527 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 6.6 ttp180 -103.27 110.9 23.05 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.474 1.108 . . . . 0.0 110.299 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.543 ' HB1' ' CD1' ' A' ' 153' ' ' PHE . . . -81.37 104.64 11.96 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.451 1.095 . . . . 0.0 109.334 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.413 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 1.7 mt -89.59 22.93 2.8 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.503 1.127 . . . . 0.0 109.218 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -140.52 149.7 42.79 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.5 1.125 . . . . 0.0 111.014 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.17 128.92 34.97 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.49 1.119 . . . . 0.0 109.312 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.598 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.4 OUTLIER . . . . . 0 C--N 1.325 -0.494 0 O-C-N 124.572 1.17 . . . . 0.0 111.007 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.633 HD21 ' O ' ' A' ' 178' ' ' LYS . 6.4 tp . . . . . 0 N--CA 1.452 -0.344 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.99 171.28 18.63 Favored 'Trans proline' 0 C--N 1.36 1.138 0 O-C-N 124.465 1.771 . . . . 0.0 111.04 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.598 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 8.7 p90 -174.08 178.88 2.02 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.433 1.083 . . . . 0.0 111.008 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.62 135.94 54.16 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.53 1.144 . . . . 0.0 109.31 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 155' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.3 OUTLIER -42.9 108.07 0.1 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.523 1.139 . . . . 0.0 109.358 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 105.7 34.23 3.35 Favored Glycine 0 CA--C 1.529 0.946 0 O-C-N 124.448 1.093 . . . . 0.0 111.018 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 157' ' ' ASP . . . . . 0.417 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 17.5 t0 -109.97 176.58 5.01 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.49 0.759 . . . . 0.0 109.308 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.467 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 51.7 mt -131.67 148.25 32.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.483 1.114 . . . . 0.0 109.288 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.926 HD13 HG21 ' A' ' 182' ' ' ILE . 2.3 mt -145.01 139.94 27.81 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.512 1.133 . . . . 0.0 109.409 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.544 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 14.0 ttt-85 -86.19 97.12 10.18 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.465 1.103 . . . . 0.0 110.311 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 161' ' ' ILE . . . . . 0.54 HD11 ' HB3' ' A' ' 164' ' ' LYS . 0.0 OUTLIER -82.98 120.66 34.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.512 1.133 . . . . 0.0 109.284 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.11 -22.71 7.67 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.442 1.089 . . . . 0.0 110.373 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -122.05 137.4 54.82 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.458 1.098 . . . . 0.0 109.276 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 164' ' ' LYS . . . . . 0.54 ' HB3' HD11 ' A' ' 161' ' ' ILE . 0.0 OUTLIER -147.92 66.95 9.92 Favored Pre-proline 0 C--N 1.325 -0.459 0 O-C-N 124.455 1.097 . . . . 0.0 109.292 179.967 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.0 -38.48 1.57 Allowed 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.523 1.801 . . . . 0.0 111.036 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 166' ' ' GLU . . . . . 0.469 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 8.8 mm-40 -88.08 176.21 7.39 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.469 1.106 . . . . 0.0 110.324 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 167' ' ' GLU . . . . . 0.443 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 6.7 pt-20 -113.99 47.71 1.17 Allowed 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.524 1.14 . . . . 0.0 110.229 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.443 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 0.2 OUTLIER 174.41 -33.84 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.545 1.153 . . . . 0.0 110.351 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 169' ' ' TRP . . . . . 0.469 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 74.5 m95 -117.07 105.32 12.15 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 170' ' ' TRP . . . . . 0.748 ' O ' HD13 ' A' ' 182' ' ' ILE . 52.8 m0 -110.27 163.52 13.56 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.481 1.113 . . . . 0.0 107.997 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 171' ' ' ASN . . . . . 0.582 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -101.78 119.32 38.6 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.394 1.059 . . . . 0.0 109.287 179.985 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 172' ' ' ALA . . . . . 0.605 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -136.78 167.52 21.29 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.53 1.144 . . . . 0.0 109.292 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.722 ' HG3' ' HA2' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -98.32 159.4 14.97 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.475 1.109 . . . . 0.0 110.301 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 174' ' ' ASP . . . . . 0.678 ' N ' ' HG2' ' A' ' 173' ' ' GLU . 42.8 p-10 -95.85 -157.03 0.55 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.581 1.176 . . . . 0.0 109.309 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 38.3 t -85.66 14.38 5.83 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.567 1.167 . . . . 0.0 110.09 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -136.78 -1.96 2.18 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.546 1.154 . . . . 0.0 110.334 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 177' ' ' GLY . . . . . 0.722 ' HA2' ' HG3' ' A' ' 173' ' ' GLU . . . 100.03 -17.53 57.03 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 124.531 1.145 . . . . 0.0 111.113 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 178' ' ' LYS . . . . . 0.633 ' O ' HD21 ' A' ' 151' ' ' LEU . 5.3 mttm -49.62 108.28 0.19 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.584 0.814 . . . . 0.0 109.299 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 33.4 mtm180 -90.75 127.04 36.19 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.457 1.098 . . . . 0.0 110.305 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 180' ' ' GLY . . . . . 0.582 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -149.92 -164.13 11.57 Favored Glycine 0 CA--C 1.53 1.012 0 O-C-N 124.488 1.117 . . . . 0.0 110.978 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 181' ' ' MET . . . . . 0.473 ' O ' ' N ' ' A' ' 151' ' ' LEU . 0.0 OUTLIER -100.69 126.81 47.24 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.533 0.784 . . . . 0.0 111.021 -179.979 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.926 HG21 HD13 ' A' ' 159' ' ' LEU . 0.2 OUTLIER -126.43 150.87 71.64 Favored Pre-proline 0 C--N 1.324 -0.506 0 O-C-N 124.554 1.159 . . . . 0.0 109.324 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 183' ' ' PRO . . . . . 0.756 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.1 Cg_endo -75.1 131.34 14.07 Favored 'Trans proline' 0 C--N 1.361 1.194 0 O-C-N 124.496 1.787 . . . . 0.0 111.006 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.839 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 55.3 t -76.18 -31.21 0.96 Allowed Pre-proline 0 C--N 1.325 -0.482 0 O-C-N 124.418 1.074 . . . . 0.0 109.287 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 185' ' ' PRO . . . . . 0.839 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.95 -24.13 13.23 Favored 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.553 1.817 . . . . 0.0 111.005 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.756 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.6 m-85 -96.27 -5.02 41.2 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.463 1.102 . . . . 0.0 110.989 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 187' ' ' VAL . . . . . 0.752 HG13 ' O ' ' A' ' 183' ' ' PRO . 2.9 m -127.73 153.72 37.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.484 1.115 . . . . 0.0 109.259 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 188' ' ' GLU . . . . . 0.585 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 4.6 pt-20 -105.78 155.59 19.14 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.509 1.13 . . . . 0.0 110.287 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.468 0 O-C-N 124.483 1.114 . . . . 0.0 109.332 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' CYS . . . . . 0.652 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 1.5 p . . . . . 0 N--CA 1.452 -0.335 0 N-CA-C 108.361 -0.978 . . . . 0.0 108.361 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' TYR . . . . . 0.652 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 0.0 OUTLIER -151.12 177.4 10.23 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.469 1.106 . . . . 0.0 110.999 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.607 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 28.5 m -142.48 155.24 18.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 O-C-N 124.586 1.179 . . . . 0.0 109.289 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.479 ' HA ' ' O ' ' A' ' 157' ' ' ASP . 0.2 OUTLIER -107.84 114.35 28.23 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.466 1.104 . . . . 0.0 110.248 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.523 ' O ' ' N ' ' A' ' 156' ' ' GLY . . . -80.63 110.23 15.91 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.422 1.076 . . . . 0.0 109.263 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.411 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 4.3 mt -88.5 23.79 2.13 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.547 1.154 . . . . 0.0 109.236 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.404 ' O ' ' N ' ' A' ' 155' ' ' LYS . 23.8 t80 -140.58 168.83 18.87 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 124.485 1.116 . . . . 0.0 110.994 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -109.14 122.79 48.06 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.54 1.15 . . . . 0.0 109.325 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.557 ' O ' ' HA ' ' A' ' 152' ' ' PRO . 4.4 t80 . . . . . 0 C--N 1.326 -0.445 0 O-C-N 124.508 1.13 . . . . 0.0 111.004 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.684 ' HB3' HG23 ' A' ' 182' ' ' ILE . 13.7 tp . . . . . 0 N--CA 1.452 -0.329 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' PRO . . . . . 0.557 ' HA ' ' O ' ' A' ' 143' ' ' PHE . 18.3 Cg_endo -74.96 142.14 27.61 Favored 'Trans proline' 0 C--N 1.359 1.13 0 O-C-N 124.531 1.806 . . . . 0.0 111.048 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.475 ' CZ ' ' HB3' ' A' ' 143' ' ' PHE . 7.5 p90 -164.92 -180.0 6.12 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.505 1.128 . . . . 0.0 111.036 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 154' ' ' LYS . . . . . 0.423 ' O ' ' C ' ' A' ' 155' ' ' LYS . 1.8 ttmt -135.76 144.17 45.67 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.489 1.118 . . . . 0.0 109.277 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 155' ' ' LYS . . . . . 0.423 ' C ' ' O ' ' A' ' 154' ' ' LYS . 2.8 tmpt? -38.32 135.49 0.74 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.473 1.108 . . . . 0.0 109.331 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 76.63 31.69 53.17 Favored Glycine 0 CA--C 1.529 0.912 0 O-C-N 124.433 1.083 . . . . 0.0 111.029 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 157' ' ' ASP . . . . . 0.479 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 6.6 t70 -105.47 165.99 10.75 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.48 0.753 . . . . 0.0 109.293 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.488 ' C ' ' HG ' ' A' ' 159' ' ' LEU . 18.7 mm -121.32 147.6 25.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.51 1.131 . . . . 0.0 109.328 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.856 HD13 HG21 ' A' ' 182' ' ' ILE . 0.6 OUTLIER -145.48 133.85 21.84 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.469 1.105 . . . . 0.0 109.33 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.477 ' HB3' ' HB2' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -87.62 105.08 17.1 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.575 1.172 . . . . 0.0 110.328 -179.983 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 161' ' ' ILE . . . . . 0.565 HD13 ' C ' ' A' ' 161' ' ' ILE . 0.0 OUTLIER -83.47 129.23 37.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.567 1.167 . . . . 0.0 109.289 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 162' ' ' ARG . . . . . 0.431 ' HB3' ' OD1' ' A' ' 163' ' ' ASP . 4.7 ttt-85 -124.05 -22.11 4.9 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.513 1.133 . . . . 0.0 110.257 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 163' ' ' ASP . . . . . 0.59 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -138.26 158.3 44.56 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.489 1.118 . . . . 0.0 109.245 -179.952 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 164' ' ' LYS . . . . . 0.552 ' HB2' ' CG ' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -155.19 76.14 5.2 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.466 1.103 . . . . 0.0 109.303 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.03 -1.17 10.88 Favored 'Trans proline' 0 C--N 1.361 1.213 0 O-C-N 124.534 1.808 . . . . 0.0 110.999 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 166' ' ' GLU . . . . . 0.481 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.1 mt-10 -128.03 171.9 11.44 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.492 1.12 . . . . 0.0 110.301 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -100.24 14.99 29.06 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.53 1.144 . . . . 0.0 110.261 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.444 ' O ' ' N ' ' A' ' 184' ' ' VAL . 8.6 mt-30 -155.31 -45.73 0.08 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.449 1.093 . . . . 0.0 110.291 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 169' ' ' TRP . . . . . 0.448 ' O ' ' HE1' ' A' ' 181' ' ' MET . 91.1 m95 -98.32 103.17 15.09 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 170' ' ' TRP . . . . . 0.7 ' CD2' HG21 ' A' ' 184' ' ' VAL . 36.0 m0 -107.91 154.7 21.22 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.977 -1.119 . . . . 0.0 107.977 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 171' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 1.2 t-20 -88.05 116.17 26.04 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.514 1.134 . . . . 0.0 109.294 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 172' ' ' ALA . . . . . 0.62 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -137.37 160.24 39.64 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.511 1.132 . . . . 0.0 109.216 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.576 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 2.6 mp0 -89.17 156.31 18.87 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.496 1.123 . . . . 0.0 110.279 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 174' ' ' ASP . . . . . 0.571 ' N ' HD21 ' A' ' 151' ' ' LEU . 0.4 OUTLIER -90.73 -162.07 0.87 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.478 1.111 . . . . 0.0 109.343 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 4.1 m -80.74 9.54 6.12 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.549 1.156 . . . . 0.0 109.996 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -132.04 -5.97 3.5 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.523 1.14 . . . . 0.0 110.338 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 177' ' ' GLY . . . . . 0.502 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 103.69 -10.4 52.88 Favored Glycine 0 CA--C 1.53 0.979 0 O-C-N 124.557 1.161 . . . . 0.0 111.011 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 178' ' ' LYS . . . . . 0.578 ' O ' HD11 ' A' ' 151' ' ' LEU . 1.2 mttt -53.89 114.19 1.49 Allowed 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.478 0.752 . . . . 0.0 109.319 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 179' ' ' ARG . . . . . 0.557 ' CG ' ' CD ' ' A' ' 173' ' ' GLU . 5.6 mtm105 -88.07 126.58 35.18 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.48 1.113 . . . . 0.0 110.281 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 180' ' ' GLY . . . . . 0.501 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -155.53 -172.42 23.09 Favored Glycine 0 CA--C 1.53 0.999 0 O-C-N 124.53 1.144 . . . . 0.0 111.043 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 181' ' ' MET . . . . . 0.448 ' HE1' ' O ' ' A' ' 169' ' ' TRP . 84.5 mmm -99.94 117.87 35.16 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.506 0.768 . . . . 0.0 111.009 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.856 HG21 HD13 ' A' ' 159' ' ' LEU . 1.1 pt -117.96 151.28 48.68 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.494 1.121 . . . . 0.0 109.337 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 183' ' ' PRO . . . . . 0.778 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -74.9 131.02 13.94 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.58 1.832 . . . . 0.0 110.987 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.84 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 4.0 t -76.76 -30.72 0.85 Allowed Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.522 1.139 . . . . 0.0 109.251 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 185' ' ' PRO . . . . . 0.84 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -75.03 -22.42 14.78 Favored 'Trans proline' 0 C--N 1.36 1.137 0 O-C-N 124.503 1.791 . . . . 0.0 111.013 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.778 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 11.6 m-85 -97.67 -4.89 36.47 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.443 1.089 . . . . 0.0 111.007 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 187' ' ' VAL . . . . . 0.641 HG22 ' HA ' ' A' ' 184' ' ' VAL . 4.0 m -127.3 151.31 33.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.556 1.16 . . . . 0.0 109.343 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 188' ' ' GLU . . . . . 0.607 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 2.4 mt-10 -101.84 144.42 30.52 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.468 1.105 . . . . 0.0 110.278 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 189' ' ' LYS . . . . . 0.557 ' HA ' HG12 ' A' ' 137' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.471 0 O-C-N 124.541 1.151 . . . . 0.0 109.27 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' CYS . . . . . 0.409 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 7.5 p . . . . . 0 N--CA 1.452 -0.35 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' TYR . . . . . 0.409 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 10.5 m-85 -150.88 167.17 28.34 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.463 1.102 . . . . 0.0 111.017 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.577 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 6.2 m -142.38 133.29 24.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.522 1.139 . . . . 0.0 109.306 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.524 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 23.6 ttp85 -101.57 110.18 22.12 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.509 1.131 . . . . 0.0 110.329 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.469 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -81.46 109.27 15.77 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.465 1.103 . . . . 0.0 109.317 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.502 HD12 ' O ' ' A' ' 138' ' ' ARG . 5.2 mp -89.44 23.3 2.61 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.526 1.141 . . . . 0.0 109.347 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -140.95 165.32 27.85 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.457 1.098 . . . . 0.0 110.972 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.81 127.52 53.15 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.518 1.136 . . . . 0.0 109.286 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.644 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 64.2 t80 . . . . . 0 C--N 1.325 -0.464 0 O-C-N 124.479 1.112 . . . . 0.0 110.968 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.732 ' HB3' HG23 ' A' ' 182' ' ' ILE . 13.8 tp . . . . . 0 N--CA 1.453 -0.313 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.04 154.62 42.43 Favored 'Trans proline' 0 C--N 1.359 1.125 0 O-C-N 124.506 1.793 . . . . 0.0 111.062 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.644 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 4.8 p90 -164.69 -177.55 4.83 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.555 1.16 . . . . 0.0 111.043 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.43 138.44 51.46 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.538 1.149 . . . . 0.0 109.253 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 155' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -45.97 117.67 1.6 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.474 1.109 . . . . 0.0 109.283 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 96.48 35.42 5.45 Favored Glycine 0 CA--C 1.529 0.939 0 O-C-N 124.517 1.135 . . . . 0.0 110.985 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -113.86 173.23 6.53 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.508 0.769 . . . . 0.0 109.298 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.456 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 24.1 mt -127.62 149.85 32.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.43 1.081 . . . . 0.0 109.328 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.875 HD13 HG21 ' A' ' 182' ' ' ILE . 0.2 OUTLIER -143.33 139.46 30.1 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.563 1.164 . . . . 0.0 109.283 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.488 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 8.4 ttp180 -87.51 107.06 18.4 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.504 1.127 . . . . 0.0 110.324 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 161' ' ' ILE . . . . . 0.845 HD12 ' O ' ' A' ' 171' ' ' ASN . 10.6 tp -84.45 128.17 39.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.445 1.091 . . . . 0.0 109.325 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.9 ttt180 -128.32 -24.29 3.12 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.506 1.129 . . . . 0.0 110.313 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -127.07 151.93 47.96 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.515 1.134 . . . . 0.0 109.244 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 164' ' ' LYS . . . . . 0.547 ' HG3' ' CE2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -147.67 80.25 9.07 Favored Pre-proline 0 C--N 1.326 -0.455 0 O-C-N 124.48 1.112 . . . . 0.0 109.289 179.998 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 -45.91 0.26 Allowed 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.499 1.789 . . . . 0.0 110.99 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 166' ' ' GLU . . . . . . . . . . . . . 62.6 mm-40 -93.11 -173.2 3.19 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.484 1.115 . . . . 0.0 110.305 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -108.16 -11.39 15.27 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.471 1.107 . . . . 0.0 110.261 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -123.64 -32.52 3.33 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.533 1.146 . . . . 0.0 110.306 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -110.51 112.93 25.17 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.562 1.164 . . . . 0.0 107.977 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 170' ' ' TRP . . . . . 0.858 ' CE2' HG21 ' A' ' 184' ' ' VAL . 45.9 m0 -112.69 159.35 19.0 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.527 1.142 . . . . 0.0 107.992 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 171' ' ' ASN . . . . . 0.845 ' O ' HD12 ' A' ' 161' ' ' ILE . 1.5 t30 -94.65 115.16 27.21 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.507 1.129 . . . . 0.0 109.3 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 172' ' ' ALA . . . . . 0.768 ' HB3' ' CD1' ' A' ' 182' ' ' ILE . . . -136.58 164.86 27.21 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.521 1.138 . . . . 0.0 109.292 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.615 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 6.5 mp0 -97.77 153.85 18.0 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.518 1.136 . . . . 0.0 110.295 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 174' ' ' ASP . . . . . 0.45 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.4 OUTLIER -85.97 -161.5 0.64 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.541 1.15 . . . . 0.0 109.305 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 1.5 t -81.27 11.93 3.94 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.505 1.128 . . . . 0.0 110.057 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -133.56 -4.53 2.93 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.505 1.128 . . . . 0.0 110.226 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 177' ' ' GLY . . . . . 0.537 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 103.63 -15.3 53.11 Favored Glycine 0 CA--C 1.531 1.07 0 O-C-N 124.504 1.128 . . . . 0.0 110.994 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 178' ' ' LYS . . . . . 0.45 ' O ' HD11 ' A' ' 151' ' ' LEU . 2.2 mtpt -46.74 109.04 0.16 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.595 0.82 . . . . 0.0 109.358 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 179' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -89.21 123.5 33.5 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.533 1.146 . . . . 0.0 110.281 -179.946 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 180' ' ' GLY . . . . . 0.502 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.57 -164.08 12.57 Favored Glycine 0 CA--C 1.53 0.982 0 O-C-N 124.5 1.125 . . . . 0.0 111.0 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -103.18 123.83 47.45 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.521 0.777 . . . . 0.0 111.002 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.875 HG21 HD13 ' A' ' 159' ' ' LEU . 0.1 OUTLIER -122.7 152.19 61.66 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.506 1.129 . . . . 0.0 109.315 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 183' ' ' PRO . . . . . 0.743 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.01 129.82 12.69 Favored 'Trans proline' 0 C--N 1.358 1.065 0 O-C-N 124.571 1.827 . . . . 0.0 110.95 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.858 HG21 ' CE2' ' A' ' 170' ' ' TRP . 3.6 t -76.29 -32.24 1.07 Allowed Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.407 1.067 . . . . 0.0 109.203 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 185' ' ' PRO . . . . . 0.822 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -75.1 -24.19 12.9 Favored 'Trans proline' 0 C--N 1.359 1.095 0 O-C-N 124.519 1.8 . . . . 0.0 111.012 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.743 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 9.1 m-85 -96.54 -1.41 47.16 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.53 1.144 . . . . 0.0 111.057 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 187' ' ' VAL . . . . . 0.737 HG22 ' O ' ' A' ' 183' ' ' PRO . 9.4 m -128.57 152.36 36.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 O-C-N 124.575 1.172 . . . . 0.0 109.313 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 188' ' ' GLU . . . . . 0.577 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 2.2 tt0 -97.8 151.76 19.86 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.421 1.076 . . . . 0.0 110.404 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.514 0 O-C-N 124.552 1.157 . . . . 0.0 109.305 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' CYS . . . . . 0.437 ' O ' ' HG2' ' A' ' 160' ' ' ARG . 67.7 m . . . . . 0 N--CA 1.453 -0.318 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -156.35 167.0 31.78 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.509 1.131 . . . . 0.0 110.937 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.529 HG23 ' N ' ' A' ' 138' ' ' ARG . 0.5 OUTLIER -148.67 167.17 3.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.511 1.132 . . . . 0.0 109.282 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.529 ' N ' HG23 ' A' ' 137' ' ' VAL . 0.1 OUTLIER -128.41 117.03 20.67 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.47 1.106 . . . . 0.0 110.282 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -84.78 109.78 18.32 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.443 1.089 . . . . 0.0 109.304 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.402 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 1.4 mt -89.47 26.12 1.78 Allowed 'General case' 0 C--N 1.323 -0.55 0 O-C-N 124.544 1.153 . . . . 0.0 109.284 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.503 ' CD2' ' CD2' ' A' ' 186' ' ' TYR . 41.1 m-85 -144.3 150.43 37.86 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.489 1.118 . . . . 0.0 111.007 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -94.14 127.02 39.71 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.483 1.114 . . . . 0.0 109.286 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.592 ' CB ' ' CE1' ' A' ' 153' ' ' PHE . 5.0 t80 . . . . . 0 C--N 1.326 -0.448 0 O-C-N 124.41 1.069 . . . . 0.0 110.962 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.672 HD22 ' O ' ' A' ' 172' ' ' ALA . 14.8 tp . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.29 -0.634 . . . . 0.0 109.29 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.11 162.63 36.55 Favored 'Trans proline' 0 C--N 1.36 1.138 0 O-C-N 124.54 1.81 . . . . 0.0 110.98 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.592 ' CE1' ' CB ' ' A' ' 143' ' ' PHE . 8.2 p90 -175.48 178.89 1.55 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.513 1.133 . . . . 0.0 111.003 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 154' ' ' LYS . . . . . 0.426 ' HD3' ' N ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -123.29 143.71 49.89 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.602 1.189 . . . . 0.0 109.242 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 155' ' ' LYS . . . . . 0.426 ' N ' ' HD3' ' A' ' 154' ' ' LYS . 2.6 ttpt -53.72 114.23 1.48 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.44 1.088 . . . . 0.0 109.256 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 99.35 30.01 6.81 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.488 1.117 . . . . 0.0 111.035 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 157' ' ' ASP . . . . . 0.439 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 12.4 t70 -107.3 174.41 5.9 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.451 0.736 . . . . 0.0 109.365 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.525 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 32.7 mt -121.32 155.95 25.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 O-C-N 124.482 1.114 . . . . 0.0 109.308 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.728 HD13 HG21 ' A' ' 182' ' ' ILE . 3.2 mt -144.76 148.35 34.01 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.475 1.11 . . . . 0.0 109.289 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.53 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.3 OUTLIER -99.63 107.86 20.1 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.482 1.114 . . . . 0.0 110.291 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 161' ' ' ILE . . . . . 0.686 HG12 ' HB2' ' A' ' 172' ' ' ALA . 1.6 mm -79.83 130.5 35.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.468 1.105 . . . . 0.0 109.292 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.6 ttt-85 -128.23 -25.5 2.97 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.494 1.121 . . . . 0.0 110.309 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -141.73 158.15 44.17 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.504 1.128 . . . . 0.0 109.285 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 164' ' ' LYS . . . . . 0.558 ' HB3' ' CD1' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -142.4 77.58 17.34 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.554 1.158 . . . . 0.0 109.277 179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 -2.71 12.89 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.454 1.765 . . . . 0.0 110.981 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 166' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 169' ' ' TRP . 11.9 mt-10 -144.6 -171.76 3.67 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.503 1.127 . . . . 0.0 110.359 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -113.38 -16.84 12.4 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.466 1.104 . . . . 0.0 110.275 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.408 ' N ' ' CD ' ' A' ' 168' ' ' GLN . 4.0 mp0 -116.88 -24.59 7.58 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.491 1.12 . . . . 0.0 110.247 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 169' ' ' TRP . . . . . 0.443 ' O ' ' HE1' ' A' ' 181' ' ' MET . 85.9 m95 -125.37 105.58 9.2 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.551 1.157 . . . . 0.0 107.959 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 170' ' ' TRP . . . . . 0.567 ' CE3' HG22 ' A' ' 184' ' ' VAL . 34.4 m0 -103.19 164.36 11.68 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.503 1.127 . . . . 0.0 107.997 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 171' ' ' ASN . . . . . 0.438 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.8 OUTLIER -99.39 97.48 8.52 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.448 1.092 . . . . 0.0 109.26 -179.949 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 172' ' ' ALA . . . . . 0.686 ' HB2' HG12 ' A' ' 161' ' ' ILE . . . -124.39 166.87 15.21 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.468 1.105 . . . . 0.0 109.302 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.528 ' CG ' ' O ' ' A' ' 177' ' ' GLY . 0.8 OUTLIER -96.07 159.17 15.1 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.468 1.105 . . . . 0.0 110.298 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 174' ' ' ASP . . . . . 0.576 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.4 OUTLIER -90.28 -160.39 0.69 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.464 1.102 . . . . 0.0 109.249 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 2.5 m -81.24 8.35 9.19 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.505 1.128 . . . . 0.0 109.985 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -128.08 -5.61 5.54 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.491 1.119 . . . . 0.0 110.341 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 177' ' ' GLY . . . . . 0.528 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 101.06 -9.47 58.02 Favored Glycine 0 CA--C 1.53 0.994 0 O-C-N 124.472 1.108 . . . . 0.0 111.023 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 178' ' ' LYS . . . . . 0.468 ' O ' HD11 ' A' ' 151' ' ' LEU . 4.7 mtmt -53.74 111.8 0.8 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.469 0.746 . . . . 0.0 109.3 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 179' ' ' ARG . . . . . 0.444 ' CG ' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.61 122.31 30.35 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.476 1.11 . . . . 0.0 110.238 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 180' ' ' GLY . . . . . 0.438 ' HA3' ' HB2' ' A' ' 151' ' ' LEU . . . -155.33 -164.98 13.63 Favored Glycine 0 CA--C 1.529 0.93 0 O-C-N 124.478 1.111 . . . . 0.0 111.023 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 181' ' ' MET . . . . . 0.443 ' HE1' ' O ' ' A' ' 169' ' ' TRP . 1.1 mmt -94.55 122.87 37.58 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.488 0.758 . . . . 0.0 110.983 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.728 HG21 HD13 ' A' ' 159' ' ' LEU . 18.0 pt -116.29 141.96 28.65 Favored Pre-proline 0 C--N 1.326 -0.454 0 O-C-N 124.495 1.122 . . . . 0.0 109.294 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 183' ' ' PRO . . . . . 0.839 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.3 Cg_endo -74.99 126.64 10.1 Favored 'Trans proline' 0 C--N 1.36 1.132 0 O-C-N 124.472 1.775 . . . . 0.0 111.044 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.819 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 90.6 t -74.08 -31.21 1.24 Allowed Pre-proline 0 C--N 1.325 -0.491 0 O-C-N 124.541 1.151 . . . . 0.0 109.276 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 185' ' ' PRO . . . . . 0.819 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -75.01 -28.17 9.38 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.493 1.786 . . . . 0.0 111.023 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.643 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.9 m-85 -98.07 2.86 49.18 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.532 1.145 . . . . 0.0 110.938 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 187' ' ' VAL . . . . . 0.839 HG13 ' O ' ' A' ' 183' ' ' PRO . 2.4 m -136.12 162.46 36.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.548 1.155 . . . . 0.0 109.29 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 188' ' ' GLU . . . . . 0.407 ' O ' ' HB ' ' A' ' 137' ' ' VAL . 0.1 OUTLIER -116.35 155.3 28.7 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.505 1.128 . . . . 0.0 110.254 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.481 0 O-C-N 124.554 1.159 . . . . 0.0 109.316 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' CYS . . . . . 0.578 ' HB3' ' CD2' ' A' ' 136' ' ' TYR . 0.5 OUTLIER . . . . . 0 N--CA 1.452 -0.333 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 136' ' ' TYR . . . . . 0.578 ' CD2' ' HB3' ' A' ' 135' ' ' CYS . 0.4 OUTLIER -143.82 169.52 17.63 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.549 1.156 . . . . 0.0 110.971 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.821 HG12 ' HA ' ' A' ' 189' ' ' LYS . 33.3 m -140.3 161.83 24.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.475 1.109 . . . . 0.0 109.269 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.447 ' O ' HD13 ' A' ' 140' ' ' LEU . 30.5 ttm180 -118.35 113.69 21.8 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.563 1.165 . . . . 0.0 110.247 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.539 ' O ' ' N ' ' A' ' 156' ' ' GLY . . . -82.52 112.31 19.32 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.498 1.123 . . . . 0.0 109.282 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.639 HD22 ' H ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -87.68 21.05 2.71 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.531 1.144 . . . . 0.0 109.229 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.411 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -147.47 164.05 34.59 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.464 1.103 . . . . 0.0 110.996 179.96 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -102.78 156.79 17.4 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.542 1.151 . . . . 0.0 109.309 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.651 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 20.6 t80 . . . . . 0 C--N 1.325 -0.476 0 O-C-N 124.535 1.147 . . . . 0.0 110.969 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 1.082 HD23 HD11 ' A' ' 182' ' ' ILE . 14.5 tp . . . . . 0 N--CA 1.453 -0.324 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.03 145.5 31.4 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.481 1.779 . . . . 0.0 110.975 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.651 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 5.9 p90 -157.5 -177.67 6.76 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.526 1.141 . . . . 0.0 110.999 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.29 140.06 43.11 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.525 1.141 . . . . 0.0 109.285 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 155' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 1.0 OUTLIER -43.61 131.13 5.25 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.493 1.12 . . . . 0.0 109.352 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.539 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 78.84 39.72 19.74 Favored Glycine 0 CA--C 1.53 0.997 0 O-C-N 124.548 1.155 . . . . 0.0 111.036 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 157' ' ' ASP . . . . . 0.42 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 25.2 t70 -116.98 165.66 13.09 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.487 0.757 . . . . 0.0 109.292 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.49 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 11.2 mm -116.9 147.81 20.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.553 1.158 . . . . 0.0 109.327 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.955 HD13 HD13 ' A' ' 182' ' ' ILE . 0.9 OUTLIER -141.84 138.1 31.92 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.434 1.084 . . . . 0.0 109.34 179.972 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.517 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.0 OUTLIER -87.45 102.25 14.37 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.477 1.11 . . . . 0.0 110.352 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 161' ' ' ILE . . . . . 1.018 HD12 ' HB2' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -84.86 123.28 39.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.494 1.121 . . . . 0.0 109.279 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -122.77 -22.89 5.2 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.501 1.125 . . . . 0.0 110.273 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -131.31 152.55 50.46 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.491 1.12 . . . . 0.0 109.265 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 164' ' ' LYS . . . . . 0.575 ' CB ' ' CG ' ' A' ' 170' ' ' TRP . 3.4 pttp -160.15 66.63 2.62 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 124.519 1.137 . . . . 0.0 109.276 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -75.05 4.26 4.92 Favored 'Trans proline' 0 C--N 1.361 1.191 0 O-C-N 124.445 1.761 . . . . 0.0 110.935 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 166' ' ' GLU . . . . . 0.474 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 9.2 mt-10 -127.65 177.92 6.47 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.567 1.167 . . . . 0.0 110.272 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 167' ' ' GLU . . . . . 0.505 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 7.3 pt-20 -112.61 33.53 4.9 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.459 1.099 . . . . 0.0 110.302 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.505 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 3.4 mt-30 -175.66 -37.99 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.523 1.14 . . . . 0.0 110.309 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -108.43 100.22 9.53 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.554 1.159 . . . . 0.0 107.983 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 170' ' ' TRP . . . . . 0.814 ' HB2' HD11 ' A' ' 161' ' ' ILE . 37.3 m0 -108.15 153.75 22.71 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.518 1.136 . . . . 0.0 108.013 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 171' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 2.8 t30 -88.04 110.23 20.45 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.475 1.11 . . . . 0.0 109.27 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 172' ' ' ALA . . . . . 1.026 ' HB3' HD12 ' A' ' 182' ' ' ILE . . . -130.37 159.58 36.56 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.529 1.143 . . . . 0.0 109.385 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.557 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.8 OUTLIER -92.26 156.79 17.04 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.458 1.099 . . . . 0.0 110.292 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 174' ' ' ASP . . . . . 0.581 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.5 OUTLIER -91.08 -160.32 0.71 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.498 1.124 . . . . 0.0 109.335 179.968 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.94 8.45 8.35 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.525 1.141 . . . . 0.0 110.004 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -128.66 -5.07 5.23 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.466 1.104 . . . . 0.0 110.287 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 177' ' ' GLY . . . . . 0.521 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 100.16 -11.01 60.23 Favored Glycine 0 CA--C 1.53 0.999 0 O-C-N 124.449 1.093 . . . . 0.0 111.05 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 10.7 mttp -52.6 111.75 0.7 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.583 0.813 . . . . 0.0 109.293 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 179' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -87.19 124.28 33.12 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.523 1.14 . . . . 0.0 110.282 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 180' ' ' GLY . . . . . 0.456 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -155.13 -168.05 17.73 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.51 1.131 . . . . 0.0 110.906 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -89.19 122.13 32.17 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.441 0.73 . . . . 0.0 111.095 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 1.082 HD11 HD23 ' A' ' 151' ' ' LEU . 62.0 mt -121.29 143.07 36.56 Favored Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.476 1.11 . . . . 0.0 109.265 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 183' ' ' PRO . . . . . 0.771 ' HD2' HG23 ' A' ' 182' ' ' ILE . 18.0 Cg_endo -75.1 133.12 16.06 Favored 'Trans proline' 0 C--N 1.361 1.193 0 O-C-N 124.466 1.772 . . . . 0.0 110.928 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.828 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 42.2 t -80.09 -31.82 0.67 Allowed Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.508 1.13 . . . . 0.0 109.295 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 185' ' ' PRO . . . . . 0.828 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -75.03 -28.14 9.36 Favored 'Trans proline' 0 C--N 1.361 1.208 0 O-C-N 124.443 1.759 . . . . 0.0 110.989 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.605 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 9.7 m-85 -96.9 12.29 32.83 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.418 1.074 . . . . 0.0 111.067 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 187' ' ' VAL . . . . . 0.673 HG13 ' O ' ' A' ' 183' ' ' PRO . 1.7 m -149.55 149.97 14.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.55 1.156 . . . . 0.0 109.257 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 188' ' ' GLU . . . . . 0.503 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.6 OUTLIER -98.36 138.22 35.92 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.48 1.113 . . . . 0.0 110.318 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 189' ' ' LYS . . . . . 0.821 ' HA ' HG12 ' A' ' 137' ' ' VAL . 1.0 OUTLIER . . . . . 0 C--N 1.324 -0.531 0 O-C-N 124.513 1.133 . . . . 0.0 109.283 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' CYS . . . . . 0.401 ' O ' ' HG2' ' A' ' 160' ' ' ARG . 26.3 p . . . . . 0 N--CA 1.453 -0.312 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' TYR . . . . . 0.49 ' CE1' ' HB2' ' A' ' 160' ' ' ARG . 5.6 m-85 -155.48 171.69 19.5 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.608 1.193 . . . . 0.0 110.995 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.622 HG22 HG23 ' A' ' 161' ' ' ILE . 3.3 m -145.27 144.4 21.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.501 1.126 . . . . 0.0 109.327 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.738 ' O ' HD13 ' A' ' 140' ' ' LEU . 0.4 OUTLIER -106.31 112.91 26.13 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.543 1.152 . . . . 0.0 110.332 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.435 ' CB ' HG12 ' A' ' 187' ' ' VAL . . . -83.27 105.45 14.24 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.474 1.108 . . . . 0.0 109.276 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.738 HD13 ' O ' ' A' ' 138' ' ' ARG . 0.0 OUTLIER -88.3 26.98 1.31 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.513 1.133 . . . . 0.0 109.236 179.974 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.402 ' CA ' ' HG2' ' A' ' 155' ' ' LYS . 6.4 m-85 -144.58 157.2 44.32 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.511 1.132 . . . . 0.0 110.993 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -93.28 130.89 38.84 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.513 1.133 . . . . 0.0 109.282 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.613 ' HB2' ' CZ ' ' A' ' 153' ' ' PHE . 35.5 t80 . . . . . 0 C--N 1.325 -0.489 0 O-C-N 124.518 1.136 . . . . 0.0 110.981 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.881 HD23 ' CG2' ' A' ' 182' ' ' ILE . 12.2 tp . . . . . 0 N--CA 1.453 -0.294 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.03 150.24 37.72 Favored 'Trans proline' 0 C--N 1.361 1.191 0 O-C-N 124.503 1.791 . . . . 0.0 110.98 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.613 ' CZ ' ' HB2' ' A' ' 143' ' ' PHE . 21.1 p90 -160.45 178.45 9.55 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.51 1.131 . . . . 0.0 110.937 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 154' ' ' LYS . . . . . 0.415 ' O ' ' C ' ' A' ' 155' ' ' LYS . 1.1 ttpp -126.28 143.5 51.13 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.545 1.153 . . . . 0.0 109.319 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 155' ' ' LYS . . . . . 0.527 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.1 OUTLIER -39.27 128.21 1.77 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.429 1.08 . . . . 0.0 109.267 -180.0 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.474 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 79.6 40.8 14.27 Favored Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.578 1.174 . . . . 0.0 111.033 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 157' ' ' ASP . . . . . 0.523 ' OD1' HD21 ' A' ' 159' ' ' LEU . 5.0 t70 -111.48 162.41 15.13 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.6 0.824 . . . . 0.0 109.277 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.483 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 75.7 mt -120.39 146.69 24.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.454 1.096 . . . . 0.0 109.271 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.949 HD13 HG21 ' A' ' 182' ' ' ILE . 0.9 OUTLIER -141.53 141.85 33.56 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.538 1.149 . . . . 0.0 109.342 179.978 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.49 ' HB2' ' CE1' ' A' ' 136' ' ' TYR . 9.8 ttm-85 -93.48 102.14 14.35 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.553 1.158 . . . . 0.0 110.319 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 161' ' ' ILE . . . . . 0.838 HG22 ' HB2' ' A' ' 172' ' ' ALA . 0.7 OUTLIER -82.13 125.53 39.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 O-C-N 124.599 1.187 . . . . 0.0 109.278 -179.982 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -121.11 -22.25 6.17 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 124.446 1.091 . . . . 0.0 110.254 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -134.0 144.53 48.78 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.597 1.186 . . . . 0.0 109.268 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 164' ' ' LYS . . . . . 0.551 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -141.09 80.73 16.66 Favored Pre-proline 0 C--N 1.325 -0.483 0 O-C-N 124.503 1.127 . . . . 0.0 109.317 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.06 -50.35 0.13 Allowed 'Trans proline' 0 C--N 1.359 1.104 0 O-C-N 124.514 1.797 . . . . 0.0 110.929 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 166' ' ' GLU . . . . . 0.425 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 2.0 mt-10 -82.23 179.62 7.74 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 0.0 110.299 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -104.84 9.37 34.82 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.542 1.152 . . . . 0.0 110.284 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -146.55 -42.59 0.19 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.507 1.129 . . . . 0.0 110.279 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 169' ' ' TRP . . . . . 0.402 ' HH2' ' CZ ' ' A' ' 143' ' ' PHE . 68.2 m95 -103.61 111.39 23.85 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.487 1.117 . . . . 0.0 108.002 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 170' ' ' TRP . . . . . 0.681 ' O ' HD13 ' A' ' 182' ' ' ILE . 50.2 m0 -113.71 164.66 13.42 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.54 1.15 . . . . 0.0 107.937 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 171' ' ' ASN . . . . . 0.483 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -96.75 117.06 30.22 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.457 1.098 . . . . 0.0 109.265 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 172' ' ' ALA . . . . . 0.838 ' HB2' HG22 ' A' ' 161' ' ' ILE . . . -139.59 163.45 32.53 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.586 1.179 . . . . 0.0 109.284 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.574 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 2.7 mp0 -90.79 157.52 17.34 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.575 1.172 . . . . 0.0 110.31 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 174' ' ' ASP . . . . . 0.53 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 2.0 t0 -92.5 -160.67 0.76 Allowed 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.484 1.115 . . . . 0.0 109.364 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 43.1 t -81.13 6.68 13.05 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.484 1.115 . . . . 0.0 109.971 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -127.03 -3.64 6.37 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.523 1.139 . . . . 0.0 110.37 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 177' ' ' GLY . . . . . 0.512 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 98.88 -11.34 62.47 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.435 1.084 . . . . 0.0 111.011 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 178' ' ' LYS . . . . . 0.69 ' O ' HD11 ' A' ' 151' ' ' LEU . 21.4 mttt -51.91 115.79 1.85 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.521 0.777 . . . . 0.0 109.302 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 179' ' ' ARG . . . . . 0.497 ' HG2' ' CG ' ' A' ' 173' ' ' GLU . 0.5 OUTLIER -86.69 122.05 30.05 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.527 1.142 . . . . 0.0 110.353 179.97 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 180' ' ' GLY . . . . . 0.726 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -154.82 -166.82 15.71 Favored Glycine 0 CA--C 1.53 1.03 0 O-C-N 124.518 1.136 . . . . 0.0 110.975 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 5.3 ttm -100.4 131.84 46.11 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.533 0.784 . . . . 0.0 110.975 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.949 HG21 HD13 ' A' ' 159' ' ' LEU . 0.2 OUTLIER -126.14 145.79 53.61 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.545 1.153 . . . . 0.0 109.306 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 183' ' ' PRO . . . . . 0.767 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -74.97 123.59 8.01 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.505 1.792 . . . . 0.0 111.021 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.835 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 5.1 t -69.49 -29.87 1.95 Allowed Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.553 1.158 . . . . 0.0 109.303 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 185' ' ' PRO . . . . . 0.835 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.97 -25.23 12.11 Favored 'Trans proline' 0 C--N 1.361 1.209 0 O-C-N 124.491 1.785 . . . . 0.0 111.05 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.767 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.7 m-85 -99.92 0.12 40.59 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.461 1.101 . . . . 0.0 111.013 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 187' ' ' VAL . . . . . 0.712 HG13 ' O ' ' A' ' 183' ' ' PRO . 4.1 m -130.53 152.74 37.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.511 1.132 . . . . 0.0 109.329 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 188' ' ' GLU . . . . . 0.572 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.1 OUTLIER -105.01 166.7 10.2 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.581 1.175 . . . . 0.0 110.291 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.516 0 O-C-N 124.541 1.15 . . . . 0.0 109.295 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' CYS . . . . . 0.4 ' C ' ' CD1' ' A' ' 136' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.357 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 136' ' ' TYR . . . . . 0.528 ' CD1' ' N ' ' A' ' 136' ' ' TYR . 0.1 OUTLIER -149.72 167.13 27.32 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.437 1.086 . . . . 0.0 110.999 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.571 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 18.6 m -142.88 150.87 17.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.52 1.138 . . . . 0.0 109.299 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.548 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 17.2 ttt-85 -105.45 117.33 33.75 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.539 1.149 . . . . 0.0 110.305 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.566 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -82.08 110.59 17.45 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.535 1.147 . . . . 0.0 109.268 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.806 HD22 ' H ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -89.09 19.13 4.4 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.532 1.145 . . . . 0.0 109.302 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.458 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 9.6 m-85 -143.62 164.39 30.53 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.511 1.132 . . . . 0.0 110.926 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.53 155.79 17.1 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.433 1.083 . . . . 0.0 109.285 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.508 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 8.0 t80 . . . . . 0 C--N 1.325 -0.467 0 O-C-N 124.578 1.174 . . . . 0.0 110.978 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.881 HD22 ' O ' ' A' ' 172' ' ' ALA . 13.1 tp . . . . . 0 N--CA 1.453 -0.313 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 152' ' ' PRO . . . . . 0.505 ' HA ' ' O ' ' A' ' 143' ' ' PHE . 18.0 Cg_endo -75.07 159.02 41.59 Favored 'Trans proline' 0 C--N 1.359 1.118 0 O-C-N 124.557 1.82 . . . . 0.0 110.98 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.508 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 0.8 OUTLIER -167.69 -170.78 1.47 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.439 1.087 . . . . 0.0 110.979 -179.921 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -129.2 139.2 51.97 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.491 1.12 . . . . 0.0 109.296 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -46.5 116.93 1.43 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.563 1.165 . . . . 0.0 109.304 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 97.2 39.9 3.88 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.573 1.171 . . . . 0.0 111.041 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 157' ' ' ASP . . . . . 0.417 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 15.0 t70 -118.46 178.5 4.43 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.457 0.739 . . . . 0.0 109.316 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.502 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 10.5 mt -130.1 145.83 35.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.55 1.156 . . . . 0.0 109.338 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.536 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 0.3 OUTLIER -140.21 140.81 35.93 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.513 1.133 . . . . 0.0 109.251 179.972 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.544 ' HB3' ' HB2' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.94 101.07 13.06 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.533 1.145 . . . . 0.0 110.333 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 161' ' ' ILE . . . . . 1.014 HD12 ' HB2' ' A' ' 172' ' ' ALA . 0.3 OUTLIER -83.03 127.6 39.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.422 1.076 . . . . 0.0 109.325 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 24.3 ptt85 -127.69 -22.91 3.51 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.443 1.089 . . . . 0.0 110.302 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 163' ' ' ASP . . . . . 0.41 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 0.9 OUTLIER -121.51 144.08 48.91 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.552 1.157 . . . . 0.0 109.279 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 164' ' ' LYS . . . . . 0.577 ' HD3' ' CZ3' ' A' ' 170' ' ' TRP . 57.3 mttt -148.64 69.42 10.24 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.501 1.125 . . . . 0.0 109.299 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.96 -52.06 0.11 Allowed 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.486 1.782 . . . . 0.0 111.057 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 166' ' ' GLU . . . . . 0.462 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.3 mm-40 -80.95 178.23 8.55 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.489 1.118 . . . . 0.0 110.321 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 167' ' ' GLU . . . . . 0.504 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 8.9 mm-40 -108.25 29.77 7.03 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.488 1.118 . . . . 0.0 110.259 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.504 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 2.1 mt-30 -167.93 -39.71 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.439 1.087 . . . . 0.0 110.311 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -105.25 106.3 16.74 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 170' ' ' TRP . . . . . 0.761 ' HB2' HD11 ' A' ' 161' ' ' ILE . 51.0 m0 -112.22 162.8 15.08 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.478 1.111 . . . . 0.0 108.006 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 171' ' ' ASN . . . . . 0.508 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 1.1 t-20 -98.11 115.4 28.18 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.511 1.132 . . . . 0.0 109.326 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 172' ' ' ALA . . . . . 1.014 ' HB2' HD12 ' A' ' 161' ' ' ILE . . . -134.4 158.11 44.71 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.555 1.159 . . . . 0.0 109.291 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.544 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 1.3 mp0 -94.7 156.57 16.34 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.474 1.109 . . . . 0.0 110.272 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 174' ' ' ASP . . . . . 0.564 ' N ' HD21 ' A' ' 151' ' ' LEU . 0.5 OUTLIER -90.43 -162.17 0.87 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.522 1.139 . . . . 0.0 109.317 179.992 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.81 10.0 5.57 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.533 1.145 . . . . 0.0 109.992 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -128.08 -5.73 5.54 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.595 1.184 . . . . 0.0 110.274 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 177' ' ' GLY . . . . . 0.512 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 99.97 -11.15 60.58 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.505 1.128 . . . . 0.0 110.997 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 178' ' ' LYS . . . . . 0.541 ' O ' HD11 ' A' ' 151' ' ' LEU . 8.5 mttt -53.23 111.79 0.76 Allowed 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.536 0.786 . . . . 0.0 109.327 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 179' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.1 OUTLIER -89.75 127.36 35.94 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.479 1.112 . . . . 0.0 110.314 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 180' ' ' GLY . . . . . 0.508 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.61 -168.56 18.15 Favored Glycine 0 CA--C 1.529 0.953 0 O-C-N 124.44 1.088 . . . . 0.0 110.967 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -103.46 126.27 50.51 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.446 0.733 . . . . 0.0 111.02 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.745 HG23 ' HB3' ' A' ' 151' ' ' LEU . 2.7 pp -130.42 155.68 80.67 Favored Pre-proline 0 C--N 1.324 -0.51 0 O-C-N 124.496 1.122 . . . . 0.0 109.288 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 183' ' ' PRO . . . . . 0.803 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.0 132.68 15.69 Favored 'Trans proline' 0 C--N 1.361 1.186 0 O-C-N 124.428 1.751 . . . . 0.0 110.993 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.855 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 19.6 t -75.26 -29.63 0.89 Allowed Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 124.501 1.126 . . . . 0.0 109.346 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 185' ' ' PRO . . . . . 0.855 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.0 Cg_endo -75.05 -20.09 17.1 Favored 'Trans proline' 0 C--N 1.361 1.19 0 O-C-N 124.469 1.773 . . . . 0.0 110.94 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.803 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 6.7 m-85 -97.94 2.81 49.46 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.487 1.117 . . . . 0.0 110.993 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 187' ' ' VAL . . . . . 0.566 HG12 ' HA ' ' A' ' 139' ' ' ALA . 6.3 m -137.89 155.1 29.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.479 1.112 . . . . 0.0 109.319 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 188' ' ' GLU . . . . . 0.571 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.8 OUTLIER -105.75 144.88 31.87 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.524 1.14 . . . . 0.0 110.275 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 189' ' ' LYS . . . . . 0.476 ' HA ' HG12 ' A' ' 137' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.487 0 O-C-N 124.517 1.136 . . . . 0.0 109.286 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' CYS . . . . . 0.409 ' O ' ' HG3' ' A' ' 160' ' ' ARG . 20.1 p . . . . . 0 N--CA 1.452 -0.343 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' TYR . . . . . 0.455 ' CE1' ' HB2' ' A' ' 160' ' ' ARG . 2.1 m-85 -151.22 161.43 42.73 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.503 1.127 . . . . 0.0 110.967 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.525 ' O ' ' HA ' ' A' ' 158' ' ' ILE . 31.0 m -143.85 146.33 21.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.579 1.174 . . . . 0.0 109.331 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.48 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 5.4 ttp180 -108.64 112.34 24.63 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.492 1.12 . . . . 0.0 110.308 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.522 ' CB ' HG12 ' A' ' 187' ' ' VAL . . . -80.86 109.14 15.14 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.578 1.174 . . . . 0.0 109.348 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.428 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 3.1 mp -88.49 25.02 1.79 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.474 1.109 . . . . 0.0 109.262 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.405 ' O ' ' N ' ' A' ' 155' ' ' LYS . 20.2 t80 -139.18 168.25 20.26 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.445 1.09 . . . . 0.0 111.046 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -113.59 125.63 54.38 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.488 1.118 . . . . 0.0 109.325 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.66 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 1.9 t80 . . . . . 0 C--N 1.325 -0.486 0 O-C-N 124.562 1.164 . . . . 0.0 111.027 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.782 HD12 ' HD2' ' A' ' 152' ' ' PRO . 31.5 tp . . . . . 0 N--CA 1.453 -0.289 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' PRO . . . . . 0.782 ' HD2' HD12 ' A' ' 151' ' ' LEU . 18.1 Cg_endo -75.05 143.09 28.49 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.467 1.772 . . . . 0.0 110.966 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.66 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 16.7 p90 -157.03 173.16 17.44 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.507 1.129 . . . . 0.0 111.008 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 154' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -130.68 137.27 49.48 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.522 1.139 . . . . 0.0 109.33 179.912 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 155' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.8 OUTLIER -39.82 108.29 0.08 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.457 1.098 . . . . 0.0 109.298 179.959 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 103.07 33.72 4.21 Favored Glycine 0 CA--C 1.53 1.01 0 O-C-N 124.478 1.111 . . . . 0.0 111.002 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 157' ' ' ASP . . . . . 0.429 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 15.3 t70 -109.55 168.81 9.12 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.448 0.734 . . . . 0.0 109.296 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.525 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 9.1 mt -126.13 147.06 30.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.525 1.141 . . . . 0.0 109.296 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 1.09 HD13 HG21 ' A' ' 182' ' ' ILE . 4.2 mt -143.5 139.36 29.78 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.556 1.16 . . . . 0.0 109.326 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.518 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -88.44 105.47 17.63 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.475 1.109 . . . . 0.0 110.322 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 161' ' ' ILE . . . . . 0.868 HG22 ' HB2' ' A' ' 172' ' ' ALA . 1.1 pp -81.9 125.89 39.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.506 1.129 . . . . 0.0 109.252 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -121.67 -21.23 6.23 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.552 1.157 . . . . 0.0 110.273 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -131.84 137.69 48.18 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.528 1.142 . . . . 0.0 109.364 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 164' ' ' LYS . . . . . 0.479 ' CG ' HD13 ' A' ' 161' ' ' ILE . 0.0 OUTLIER -140.15 72.44 33.08 Favored Pre-proline 0 C--N 1.324 -0.511 0 O-C-N 124.496 1.123 . . . . 0.0 109.251 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.04 -49.33 0.15 Allowed 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.465 1.771 . . . . 0.0 111.045 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 166' ' ' GLU . . . . . 0.469 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 5.9 mm-40 -79.38 174.4 11.61 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.469 1.105 . . . . 0.0 110.35 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 167' ' ' GLU . . . . . 0.534 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 0.0 OUTLIER -105.57 32.17 4.48 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.491 1.119 . . . . 0.0 110.319 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.534 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 3.7 mt-30 -172.57 -37.47 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.444 1.09 . . . . 0.0 110.284 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 169' ' ' TRP . . . . . 0.461 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 83.1 m95 -107.38 107.52 18.46 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.451 1.094 . . . . 0.0 108.057 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 170' ' ' TRP . . . . . 0.604 ' CD2' HG21 ' A' ' 184' ' ' VAL . 51.3 m0 -113.29 158.98 19.85 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.548 1.155 . . . . 0.0 107.994 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 171' ' ' ASN . . . . . 0.614 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -94.76 118.43 31.74 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.469 1.106 . . . . 0.0 109.336 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 172' ' ' ALA . . . . . 0.868 ' HB2' HG22 ' A' ' 161' ' ' ILE . . . -132.53 166.16 22.7 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.533 1.145 . . . . 0.0 109.287 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.696 ' HG2' ' N ' ' A' ' 174' ' ' ASP . 0.0 OUTLIER -98.13 160.04 14.55 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.581 1.176 . . . . 0.0 110.302 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 174' ' ' ASP . . . . . 0.696 ' N ' ' HG2' ' A' ' 173' ' ' GLU . 38.9 p-10 -97.44 -156.26 0.53 Allowed 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.506 1.129 . . . . 0.0 109.26 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.06 13.78 7.22 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.492 1.12 . . . . 0.0 110.054 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -136.52 -0.81 2.36 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.505 1.128 . . . . 0.0 110.251 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 177' ' ' GLY . . . . . 0.663 ' HA2' ' HG3' ' A' ' 173' ' ' GLU . . . 99.27 -19.17 55.06 Favored Glycine 0 CA--C 1.529 0.948 0 O-C-N 124.448 1.092 . . . . 0.0 111.015 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 178' ' ' LYS . . . . . 0.439 ' HB2' ' CG ' ' A' ' 174' ' ' ASP . 0.1 OUTLIER -47.26 111.1 0.36 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.498 0.764 . . . . 0.0 109.313 179.986 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -93.08 126.81 38.36 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.544 1.152 . . . . 0.0 110.368 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 180' ' ' GLY . . . . . 0.614 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -149.48 -164.6 11.78 Favored Glycine 0 CA--C 1.531 1.089 0 O-C-N 124.514 1.134 . . . . 0.0 110.979 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 181' ' ' MET . . . . . 0.461 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 16.7 tpp -97.4 128.52 44.27 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.562 0.801 . . . . 0.0 111.001 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 1.09 HG21 HD13 ' A' ' 159' ' ' LEU . 1.4 pp -127.51 144.54 51.3 Favored Pre-proline 0 C--N 1.325 -0.483 0 O-C-N 124.452 1.095 . . . . 0.0 109.317 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 183' ' ' PRO . . . . . 0.745 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.05 124.29 8.48 Favored 'Trans proline' 0 C--N 1.36 1.16 0 O-C-N 124.627 1.856 . . . . 0.0 110.933 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.831 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 37.5 t -71.16 -31.31 1.91 Allowed Pre-proline 0 C--N 1.324 -0.5 0 O-C-N 124.54 1.15 . . . . 0.0 109.322 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 185' ' ' PRO . . . . . 0.831 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -75.06 -23.66 13.48 Favored 'Trans proline' 0 C--N 1.36 1.133 0 O-C-N 124.475 1.776 . . . . 0.0 111.0 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.745 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.9 m-85 -98.23 -2.5 39.55 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.517 1.136 . . . . 0.0 111.005 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 187' ' ' VAL . . . . . 0.692 HG22 ' O ' ' A' ' 183' ' ' PRO . 7.2 m -127.54 153.6 36.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 O-C-N 124.482 1.114 . . . . 0.0 109.315 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 188' ' ' GLU . . . . . 0.505 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 6.0 mm-40 -101.11 160.64 14.22 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.604 1.19 . . . . 0.0 110.295 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.486 0 O-C-N 124.516 1.135 . . . . 0.0 109.296 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' CYS . . . . . 0.657 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 13.4 p . . . . . 0 N--CA 1.452 -0.346 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' TYR . . . . . 0.657 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 0.1 OUTLIER -136.4 174.75 10.27 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.422 1.077 . . . . 0.0 110.999 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.985 HG12 ' HA ' ' A' ' 189' ' ' LYS . 21.1 m -138.49 156.91 30.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 O-C-N 124.588 1.18 . . . . 0.0 109.297 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.553 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 13.1 ttp180 -108.35 121.71 45.48 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.476 1.11 . . . . 0.0 110.318 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.516 ' C ' HD13 ' A' ' 140' ' ' LEU . . . -82.51 116.79 22.1 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.427 1.08 . . . . 0.0 109.315 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.661 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -93.33 25.8 3.22 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.477 1.111 . . . . 0.0 109.281 -179.973 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -150.65 163.54 38.26 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.511 1.132 . . . . 0.0 111.015 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.47 128.73 54.76 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.451 1.094 . . . . 0.0 109.332 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.578 ' HB2' ' CZ ' ' A' ' 153' ' ' PHE . 35.9 t80 . . . . . 0 C--N 1.325 -0.458 0 O-C-N 124.452 1.095 . . . . 0.0 110.947 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.792 HD22 ' O ' ' A' ' 172' ' ' ALA . 12.4 tp . . . . . 0 N--CA 1.453 -0.283 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 152' ' ' PRO . . . . . 0.412 ' O ' ' OD1' ' A' ' 174' ' ' ASP . 18.3 Cg_endo -74.96 165.17 31.91 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.497 1.788 . . . . 0.0 110.949 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.578 ' CZ ' ' HB2' ' A' ' 143' ' ' PHE . 7.7 p90 -170.52 -174.82 1.73 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.493 1.121 . . . . 0.0 110.93 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 154' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 157' ' ' ASP . 0.0 OUTLIER -133.67 147.29 51.4 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.493 1.121 . . . . 0.0 109.259 -179.937 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 155' ' ' LYS . . . . . 0.484 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -51.82 120.01 4.84 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.582 1.176 . . . . 0.0 109.253 179.966 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.475 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 86.08 41.07 7.23 Favored Glycine 0 CA--C 1.53 1.019 0 O-C-N 124.512 1.133 . . . . 0.0 110.979 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 157' ' ' ASP . . . . . 0.484 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 15.1 t70 -114.06 174.3 6.01 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.512 0.772 . . . . 0.0 109.31 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.768 ' O ' HD23 ' A' ' 159' ' ' LEU . 7.3 mm -121.82 154.85 26.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 O-C-N 124.47 1.106 . . . . 0.0 109.337 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.768 HD23 ' O ' ' A' ' 158' ' ' ILE . 6.2 mt -146.96 137.73 23.79 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.508 1.13 . . . . 0.0 109.302 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.584 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 5.0 ttm180 -87.06 109.02 19.13 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.56 1.162 . . . . 0.0 110.324 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 161' ' ' ILE . . . . . 0.495 ' CD1' ' HB2' ' A' ' 172' ' ' ALA . 0.5 OUTLIER -79.99 125.38 38.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.563 1.165 . . . . 0.0 109.261 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -118.86 -25.03 6.41 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.516 1.135 . . . . 0.0 110.345 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -147.59 153.68 39.72 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.421 1.076 . . . . 0.0 109.227 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 164' ' ' LYS . . . . . 0.562 ' HB2' ' CD2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -155.49 68.96 5.29 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.509 1.13 . . . . 0.0 109.268 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.95 -42.08 0.58 Allowed 'Trans proline' 0 C--N 1.359 1.103 0 O-C-N 124.535 1.808 . . . . 0.0 111.02 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 166' ' ' GLU . . . . . 0.491 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 10.7 mp0 -82.3 176.36 9.52 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.489 1.118 . . . . 0.0 110.321 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -114.94 48.98 1.08 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.478 1.112 . . . . 0.0 110.324 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 171.96 -35.15 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.552 1.158 . . . . 0.0 110.255 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 169' ' ' TRP . . . . . 0.514 ' CE3' ' HG2' ' A' ' 181' ' ' MET . 61.2 m95 -116.71 99.7 7.31 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.468 1.105 . . . . 0.0 108.028 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 170' ' ' TRP . . . . . 0.717 ' CE2' HG21 ' A' ' 184' ' ' VAL . 51.0 m0 -105.34 166.42 10.43 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 171' ' ' ASN . . . . . 0.427 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.6 OUTLIER -103.51 108.85 20.29 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.48 1.112 . . . . 0.0 109.308 179.994 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 172' ' ' ALA . . . . . 0.792 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -134.82 166.24 23.42 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.488 1.118 . . . . 0.0 109.295 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.554 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.8 OUTLIER -90.48 155.94 18.55 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.479 1.112 . . . . 0.0 110.32 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 174' ' ' ASP . . . . . 0.428 ' HA ' HD22 ' A' ' 159' ' ' LEU . 0.2 OUTLIER -88.71 -161.88 0.8 Allowed 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.478 1.111 . . . . 0.0 109.293 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 40.7 t -79.68 8.01 7.4 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.536 1.148 . . . . 0.0 110.023 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -129.37 -4.52 4.86 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.489 1.118 . . . . 0.0 110.346 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 177' ' ' GLY . . . . . 0.53 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 101.49 -11.64 58.14 Favored Glycine 0 CA--C 1.53 1.019 0 O-C-N 124.508 1.13 . . . . 0.0 111.014 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 178' ' ' LYS . . . . . 0.601 ' O ' HD11 ' A' ' 151' ' ' LEU . 4.3 mttm -52.58 113.43 1.06 Allowed 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.458 0.74 . . . . 0.0 109.28 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 179' ' ' ARG . . . . . 0.463 ' CG ' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.72 121.26 28.98 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.509 1.131 . . . . 0.0 110.316 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 180' ' ' GLY . . . . . 0.562 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -155.15 -164.23 12.85 Favored Glycine 0 CA--C 1.531 1.032 0 O-C-N 124.475 1.11 . . . . 0.0 111.009 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 181' ' ' MET . . . . . 0.514 ' HG2' ' CE3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -96.45 124.32 40.4 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.535 0.785 . . . . 0.0 110.996 -179.985 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.79 HG22 ' HB3' ' A' ' 151' ' ' LEU . 0.2 OUTLIER -122.09 148.7 52.43 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.56 1.162 . . . . 0.0 109.32 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 183' ' ' PRO . . . . . 0.811 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.3 Cg_endo -75.04 129.38 12.25 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.503 1.791 . . . . 0.0 110.979 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.829 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 79.9 t -75.43 -31.91 1.14 Allowed Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.477 1.11 . . . . 0.0 109.243 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 185' ' ' PRO . . . . . 0.829 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.2 Cg_endo -75.06 -24.77 12.41 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.508 1.794 . . . . 0.0 110.964 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.776 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 5.4 m-85 -98.52 1.67 46.81 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.55 1.156 . . . . 0.0 110.992 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 187' ' ' VAL . . . . . 0.811 HG13 ' O ' ' A' ' 183' ' ' PRO . 2.5 m -135.06 145.82 31.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.438 1.086 . . . . 0.0 109.32 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 188' ' ' GLU . . . . . 0.567 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.5 OUTLIER -104.1 140.63 37.52 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.481 1.113 . . . . 0.0 110.256 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 189' ' ' LYS . . . . . 0.985 ' HA ' HG12 ' A' ' 137' ' ' VAL . 1.3 tmtm? . . . . . 0 C--N 1.326 -0.443 0 O-C-N 124.505 1.128 . . . . 0.0 109.308 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' CYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 160' ' ' ARG . 99.3 m . . . . . 0 N--CA 1.453 -0.316 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' TYR . . . . . 0.494 ' CE1' ' HD2' ' A' ' 160' ' ' ARG . 6.2 m-85 -152.9 167.55 28.73 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.509 1.131 . . . . 0.0 111.021 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.773 HG22 ' O ' ' A' ' 159' ' ' LEU . 16.6 m -142.93 137.26 26.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 O-C-N 124.496 1.122 . . . . 0.0 109.348 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.69 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 9.5 ttm180 -100.78 106.78 18.22 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.523 1.139 . . . . 0.0 110.269 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.779 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -80.36 104.47 10.93 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.486 1.116 . . . . 0.0 109.324 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.613 HD12 ' O ' ' A' ' 138' ' ' ARG . 6.5 mp -90.02 28.86 1.3 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.487 1.117 . . . . 0.0 109.36 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.475 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 34.0 m-85 -144.22 145.21 31.92 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.436 1.085 . . . . 0.0 111.011 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.09 131.62 35.86 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.452 1.095 . . . . 0.0 109.322 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.486 ' O ' ' CB ' ' A' ' 152' ' ' PRO . 2.5 t80 . . . . . 0 C--N 1.326 -0.456 0 O-C-N 124.521 1.138 . . . . 0.0 111.005 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.785 HD21 ' O ' ' A' ' 178' ' ' LYS . 8.0 tp . . . . . 0 N--CA 1.453 -0.301 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 152' ' ' PRO . . . . . 0.486 ' CB ' ' O ' ' A' ' 143' ' ' PHE . 18.0 Cg_endo -75.06 169.23 23.05 Favored 'Trans proline' 0 C--N 1.36 1.146 0 O-C-N 124.507 1.793 . . . . 0.0 110.915 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.475 ' CE1' ' O ' ' A' ' 141' ' ' PHE . 0.8 OUTLIER -172.87 -170.82 0.7 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.488 1.118 . . . . 0.0 110.949 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 154' ' ' LYS . . . . . 0.462 ' O ' ' HG3' ' A' ' 154' ' ' LYS . 0.0 OUTLIER -125.78 140.07 52.99 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.454 1.096 . . . . 0.0 109.296 179.972 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 155' ' ' LYS . . . . . 0.522 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 1.3 tmmm? -45.85 117.02 1.35 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.507 1.129 . . . . 0.0 109.287 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.454 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 93.33 29.72 9.94 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.523 1.139 . . . . 0.0 110.99 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -100.55 169.36 9.12 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.519 0.776 . . . . 0.0 109.311 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.493 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 9.1 mt -122.24 147.06 26.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.556 1.16 . . . . 0.0 109.31 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.773 ' O ' HG22 ' A' ' 137' ' ' VAL . 0.2 OUTLIER -141.02 136.89 32.54 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.547 1.154 . . . . 0.0 109.316 179.978 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.494 ' HD2' ' CE1' ' A' ' 136' ' ' TYR . 0.2 OUTLIER -88.12 111.02 21.12 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.601 1.188 . . . . 0.0 110.309 179.96 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 161' ' ' ILE . . . . . 1.045 HD12 ' HB2' ' A' ' 172' ' ' ALA . 0.5 OUTLIER -80.48 125.21 39.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.551 1.157 . . . . 0.0 109.36 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -116.74 -26.51 6.95 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.532 1.145 . . . . 0.0 110.3 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 163' ' ' ASP . . . . . 0.465 ' OD2' ' CB ' ' A' ' 171' ' ' ASN . 0.0 OUTLIER -149.11 157.3 43.27 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.461 1.101 . . . . 0.0 109.353 -179.978 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 164' ' ' LYS . . . . . 0.54 ' HG3' ' CE2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -145.88 92.15 5.46 Favored Pre-proline 0 C--N 1.325 -0.46 0 O-C-N 124.464 1.102 . . . . 0.0 109.278 179.994 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.03 -49.71 0.14 Allowed 'Trans proline' 0 C--N 1.361 1.201 0 O-C-N 124.478 1.778 . . . . 0.0 111.061 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 166' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' A' ' 169' ' ' TRP . 12.5 mt-10 -88.92 -177.53 5.5 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.596 1.185 . . . . 0.0 110.306 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -106.52 -9.78 16.49 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.507 1.13 . . . . 0.0 110.315 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -120.29 -27.66 5.19 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.539 1.15 . . . . 0.0 110.29 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 169' ' ' TRP . . . . . 0.474 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 59.7 m95 -121.65 117.75 27.46 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.543 1.152 . . . . 0.0 107.95 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 170' ' ' TRP . . . . . 0.862 ' CE2' HG21 ' A' ' 184' ' ' VAL . 33.9 m0 -114.2 165.08 13.04 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.519 1.137 . . . . 0.0 107.947 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 171' ' ' ASN . . . . . 0.467 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.4 OUTLIER -100.37 115.2 29.45 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.493 1.121 . . . . 0.0 109.295 -179.98 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 172' ' ' ALA . . . . . 1.045 ' HB2' HD12 ' A' ' 161' ' ' ILE . . . -136.79 168.44 19.53 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.521 1.138 . . . . 0.0 109.238 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.693 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.8 OUTLIER -97.38 154.57 17.37 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.483 1.114 . . . . 0.0 110.305 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 174' ' ' ASP . . . . . 0.546 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.1 OUTLIER -88.29 -163.97 1.05 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.551 1.157 . . . . 0.0 109.325 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 23.2 t -77.9 9.46 3.56 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.482 1.114 . . . . 0.0 109.982 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -128.66 -5.66 5.19 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.495 1.122 . . . . 0.0 110.276 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 177' ' ' GLY . . . . . 0.539 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 99.9 -11.31 60.7 Favored Glycine 0 CA--C 1.53 1.028 0 O-C-N 124.445 1.091 . . . . 0.0 110.94 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 178' ' ' LYS . . . . . 0.785 ' O ' HD21 ' A' ' 151' ' ' LEU . 0.8 OUTLIER -53.39 112.47 0.9 Allowed 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.505 0.768 . . . . 0.0 109.306 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 179' ' ' ARG . . . . . 0.45 ' HG2' ' CD ' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.59 124.61 33.07 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.499 1.124 . . . . 0.0 110.322 -179.988 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 180' ' ' GLY . . . . . 0.705 ' HA3' HD13 ' A' ' 151' ' ' LEU . . . -155.73 -165.44 14.39 Favored Glycine 0 CA--C 1.53 0.971 0 O-C-N 124.473 1.108 . . . . 0.0 111.019 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 181' ' ' MET . . . . . 0.474 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -99.64 131.29 45.73 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.479 0.753 . . . . 0.0 111.003 179.99 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.752 HG21 HD13 ' A' ' 159' ' ' LEU . 2.2 pp -132.62 148.88 71.35 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.466 1.104 . . . . 0.0 109.312 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 183' ' ' PRO . . . . . 0.743 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.0 129.71 12.59 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.488 1.783 . . . . 0.0 111.045 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.862 HG21 ' CE2' ' A' ' 170' ' ' TRP . 54.6 t -74.5 -31.53 1.23 Allowed Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.49 1.119 . . . . 0.0 109.319 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 185' ' ' PRO . . . . . 0.834 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.93 -17.43 19.75 Favored 'Trans proline' 0 C--N 1.36 1.172 0 O-C-N 124.509 1.794 . . . . 0.0 111.06 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.743 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 5.2 m-85 -98.33 -12.61 21.33 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.46 1.1 . . . . 0.0 111.019 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 187' ' ' VAL . . . . . 0.779 HG12 ' HA ' ' A' ' 139' ' ' ALA . 2.3 m -126.97 157.01 38.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.503 1.127 . . . . 0.0 109.385 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 188' ' ' GLU . . . . . 0.47 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 3.4 pt-20 -98.13 161.8 13.53 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.44 1.087 . . . . 0.0 110.297 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.471 0 O-C-N 124.51 1.131 . . . . 0.0 109.249 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 85.6 m . . . . . 0 N--CA 1.453 -0.317 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 136' ' ' TYR . . . . . 0.428 ' HA ' ' O ' ' A' ' 159' ' ' LEU . 14.6 m-85 -129.81 177.31 7.35 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.509 1.131 . . . . 0.0 110.963 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.516 HG23 ' N ' ' A' ' 138' ' ' ARG . 1.4 m -149.79 166.77 2.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.402 1.064 . . . . 0.0 109.284 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.516 ' N ' HG23 ' A' ' 137' ' ' VAL . 2.3 ttt-85 -128.15 116.27 19.68 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.463 1.102 . . . . 0.0 110.235 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.496 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -83.87 107.25 16.15 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.528 1.142 . . . . 0.0 109.283 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.515 ' C ' ' HG2' ' A' ' 155' ' ' LYS . 1.1 mp -88.54 26.52 1.45 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.59 1.181 . . . . 0.0 109.356 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.601 ' CD1' ' HA ' ' A' ' 186' ' ' TYR . 84.2 m-85 -153.4 146.61 24.7 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.444 1.09 . . . . 0.0 110.993 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.89 153.79 34.38 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.54 1.15 . . . . 0.0 109.304 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.639 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.512 0 O-C-N 124.527 1.142 . . . . 0.0 111.044 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.886 HD22 ' O ' ' A' ' 172' ' ' ALA . 15.5 tp . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.0 167.26 27.45 Favored 'Trans proline' 0 C--N 1.361 1.189 0 O-C-N 124.529 1.805 . . . . 0.0 111.056 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.639 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 4.7 p90 -178.05 -178.77 0.69 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.525 1.14 . . . . 0.0 110.983 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.47 142.44 47.15 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.492 1.12 . . . . 0.0 109.302 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 155' ' ' LYS . . . . . 0.515 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -46.0 119.34 2.22 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.504 1.127 . . . . 0.0 109.288 179.962 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.455 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 88.57 40.74 6.27 Favored Glycine 0 CA--C 1.53 0.999 0 O-C-N 124.541 1.151 . . . . 0.0 111.027 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 157' ' ' ASP . . . . . 0.451 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 37.0 t70 -111.14 167.8 9.99 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.481 0.754 . . . . 0.0 109.297 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.499 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 2.3 mp -116.68 149.93 18.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.505 1.128 . . . . 0.0 109.303 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.654 HD13 ' CG2' ' A' ' 182' ' ' ILE . 1.0 OUTLIER -141.74 146.01 35.5 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.494 1.121 . . . . 0.0 109.276 179.943 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.468 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.9 OUTLIER -93.68 101.77 13.92 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.478 1.111 . . . . 0.0 110.3 179.968 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 161' ' ' ILE . . . . . 0.555 HD11 ' HB3' ' A' ' 170' ' ' TRP . 9.4 tp -79.23 128.47 38.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.488 1.118 . . . . 0.0 109.343 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.21 -26.18 3.69 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.525 1.14 . . . . 0.0 110.254 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 163' ' ' ASP . . . . . 0.406 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 45.9 m-20 -137.39 140.91 41.67 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.485 1.116 . . . . 0.0 109.295 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 164' ' ' LYS . . . . . 0.591 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -146.79 69.34 12.11 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.542 1.151 . . . . 0.0 109.378 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 165' ' ' PRO . . . . . 0.404 ' HG2' ' OE1' ' A' ' 166' ' ' GLU . 18.4 Cg_endo -75.0 -44.08 0.36 Allowed 'Trans proline' 0 C--N 1.359 1.104 0 O-C-N 124.499 1.789 . . . . 0.0 111.037 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 166' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 169' ' ' TRP . 6.6 mp0 -81.03 171.02 15.49 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.503 1.127 . . . . 0.0 110.315 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 167' ' ' GLU . . . . . 0.425 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 12.5 pm0 -112.41 52.39 0.77 Allowed 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.459 1.099 . . . . 0.0 110.261 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.51 ' O ' HG23 ' A' ' 184' ' ' VAL . 0.1 OUTLIER 169.75 -31.68 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.517 1.136 . . . . 0.0 110.316 179.937 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 169' ' ' TRP . . . . . 0.452 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 73.3 m95 -125.52 101.4 6.91 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.562 1.164 . . . . 0.0 107.967 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 170' ' ' TRP . . . . . 0.83 ' CE2' HG21 ' A' ' 184' ' ' VAL . 10.2 m0 -106.86 174.71 5.77 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.534 1.146 . . . . 0.0 107.982 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 171' ' ' ASN . . . . . 0.46 ' O ' HD12 ' A' ' 161' ' ' ILE . 0.7 OUTLIER -109.06 113.48 26.39 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 124.522 1.139 . . . . 0.0 109.282 -179.998 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 172' ' ' ALA . . . . . 0.886 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -136.55 164.01 29.19 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.534 1.146 . . . . 0.0 109.373 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.581 ' O ' ' HB3' ' A' ' 159' ' ' LEU . 7.5 mp0 -89.32 153.38 20.92 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.466 1.104 . . . . 0.0 110.345 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 174' ' ' ASP . . . . . 0.518 ' N ' HD21 ' A' ' 151' ' ' LEU . 0.5 OUTLIER -88.1 -159.74 0.57 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.521 1.138 . . . . 0.0 109.353 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 94.4 p -81.71 9.85 7.12 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.472 1.108 . . . . 0.0 109.995 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -131.11 -5.34 3.89 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.511 1.132 . . . . 0.0 110.239 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 177' ' ' GLY . . . . . 0.512 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 100.96 -11.16 58.87 Favored Glycine 0 CA--C 1.532 1.094 0 O-C-N 124.547 1.154 . . . . 0.0 110.966 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 178' ' ' LYS . . . . . 0.534 ' O ' HD11 ' A' ' 151' ' ' LEU . 3.3 mttp -54.5 114.69 1.77 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.511 0.771 . . . . 0.0 109.234 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 179' ' ' ARG . . . . . 0.54 ' CG ' ' CD ' ' A' ' 173' ' ' GLU . 1.1 mtm180 -86.45 123.86 32.14 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.464 1.102 . . . . 0.0 110.279 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 180' ' ' GLY . . . . . 0.439 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.91 -169.16 19.2 Favored Glycine 0 CA--C 1.531 1.035 0 O-C-N 124.475 1.109 . . . . 0.0 111.022 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 181' ' ' MET . . . . . 0.452 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.1 OUTLIER -88.24 119.12 28.34 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.519 0.776 . . . . 0.0 111.044 179.971 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.685 HG12 ' HB3' ' A' ' 172' ' ' ALA . 1.6 pp -108.86 133.74 20.58 Favored Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.515 1.135 . . . . 0.0 109.318 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 183' ' ' PRO . . . . . 0.845 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.2 Cg_endo -75.05 126.37 9.9 Favored 'Trans proline' 0 C--N 1.359 1.114 0 O-C-N 124.45 1.763 . . . . 0.0 110.952 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.838 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 60.5 t -71.71 -29.76 1.39 Allowed Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 124.445 1.09 . . . . 0.0 109.238 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 185' ' ' PRO . . . . . 0.838 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -74.99 -29.43 8.25 Favored 'Trans proline' 0 C--N 1.359 1.13 0 O-C-N 124.461 1.769 . . . . 0.0 110.994 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.7 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 5.5 m-85 -100.33 -0.67 37.92 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.531 1.144 . . . . 0.0 110.966 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 187' ' ' VAL . . . . . 0.845 HG13 ' O ' ' A' ' 183' ' ' PRO . 1.4 m -137.11 160.73 36.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.51 1.131 . . . . 0.0 109.327 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 188' ' ' GLU . . . . . 0.465 ' O ' ' HB ' ' A' ' 137' ' ' VAL . 6.9 tp10 -116.76 149.94 39.1 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.538 1.148 . . . . 0.0 110.25 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.477 0 O-C-N 124.463 1.102 . . . . 0.0 109.284 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' CYS . . . . . 0.677 ' O ' ' CD1' ' A' ' 136' ' ' TYR . 3.6 p . . . . . 0 N--CA 1.453 -0.322 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' TYR . . . . . 0.677 ' CD1' ' O ' ' A' ' 135' ' ' CYS . 8.8 m-85 -149.38 179.98 7.52 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.419 1.074 . . . . 0.0 111.045 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.493 HG11 HG13 ' A' ' 161' ' ' ILE . 24.0 m -144.06 143.87 23.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 124.427 1.079 . . . . 0.0 109.307 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.606 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 28.0 ttm-85 -104.26 111.46 24.08 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.476 1.11 . . . . 0.0 110.306 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.759 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -79.63 107.25 12.25 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.526 1.142 . . . . 0.0 109.336 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.46 ' O ' ' HE2' ' A' ' 155' ' ' LYS . 7.4 mp -89.89 29.53 1.18 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.521 1.138 . . . . 0.0 109.278 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.606 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 42.7 m-85 -148.28 151.7 35.87 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.446 1.092 . . . . 0.0 111.011 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -93.82 133.17 37.5 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.558 1.161 . . . . 0.0 109.273 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.621 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 12.0 t80 . . . . . 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 0.0 111.027 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.96 HD23 HD11 ' A' ' 182' ' ' ILE . 10.5 tp . . . . . 0 N--CA 1.453 -0.286 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 152' ' ' PRO . . . . . 0.538 ' HA ' ' O ' ' A' ' 143' ' ' PHE . 18.4 Cg_endo -75.01 166.07 29.96 Favored 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.398 1.736 . . . . 0.0 111.018 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.621 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 3.5 p90 -166.18 -177.18 4.01 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.525 1.14 . . . . 0.0 111.015 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 154' ' ' LYS . . . . . 0.578 ' O ' ' C ' ' A' ' 155' ' ' LYS . 2.0 ttmt -133.82 129.79 37.02 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.476 1.11 . . . . 0.0 109.301 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 155' ' ' LYS . . . . . 0.578 ' C ' ' O ' ' A' ' 154' ' ' LYS . 12.5 ttmt -25.33 123.37 0.06 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.579 1.174 . . . . 0.0 109.373 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 74.36 49.94 10.96 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 124.49 1.119 . . . . 0.0 110.988 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 157' ' ' ASP . . . . . 0.452 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 28.8 t0 -113.41 165.2 12.69 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.516 0.774 . . . . 0.0 109.355 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.571 HD11 ' NH1' ' A' ' 138' ' ' ARG . 1.3 mp -118.36 148.63 21.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.47 1.106 . . . . 0.0 109.298 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.857 HD13 HD13 ' A' ' 182' ' ' ILE . 1.3 mt -147.14 138.78 24.17 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.527 1.142 . . . . 0.0 109.307 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.56 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.8 OUTLIER -87.63 106.2 17.86 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.572 1.17 . . . . 0.0 110.272 -179.95 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 161' ' ' ILE . . . . . 0.873 ' CD1' ' HB2' ' A' ' 172' ' ' ALA . 2.2 mm -82.98 125.98 40.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.486 1.116 . . . . 0.0 109.268 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 10.5 ttt180 -127.62 -26.21 3.02 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.524 1.14 . . . . 0.0 110.277 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 163' ' ' ASP . . . . . 0.491 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -126.65 140.52 52.35 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.55 1.156 . . . . 0.0 109.344 179.981 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 164' ' ' LYS . . . . . 0.5 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 1.7 mtmt -146.32 63.4 8.82 Favored Pre-proline 0 C--N 1.324 -0.502 0 O-C-N 124.487 1.117 . . . . 0.0 109.312 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 165' ' ' PRO . . . . . 0.43 ' HD3' ' N ' ' A' ' 164' ' ' LYS . 18.5 Cg_endo -74.98 6.96 3.07 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.491 1.785 . . . . 0.0 110.995 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 166' ' ' GLU . . . . . 0.467 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 5.5 mm-40 -135.66 176.04 9.04 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.557 1.16 . . . . 0.0 110.282 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 167' ' ' GLU . . . . . 0.539 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 4.2 mm-40 -113.73 35.79 3.92 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.539 1.149 . . . . 0.0 110.244 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.539 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 0.4 OUTLIER -174.93 -37.84 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.48 1.112 . . . . 0.0 110.361 179.974 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 169' ' ' TRP . . . . . 0.45 ' O ' ' HB2' ' A' ' 166' ' ' GLU . 76.6 m95 -113.56 104.77 12.59 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 170' ' ' TRP . . . . . 0.698 ' CE2' HG21 ' A' ' 184' ' ' VAL . 38.7 m0 -111.2 159.91 17.45 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 171' ' ' ASN . . . . . 0.534 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 1.0 OUTLIER -96.91 114.3 25.91 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.43 1.081 . . . . 0.0 109.296 179.969 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 172' ' ' ALA . . . . . 1.04 ' HB3' HD12 ' A' ' 182' ' ' ILE . . . -128.64 167.69 16.83 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.506 1.128 . . . . 0.0 109.29 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.529 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 2.0 mp0 -97.48 157.28 16.09 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.48 1.112 . . . . 0.0 110.38 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 174' ' ' ASP . . . . . 0.453 ' OD1' ' N ' ' A' ' 177' ' ' GLY . 46.2 p-10 -95.14 -159.92 0.75 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.478 1.111 . . . . 0.0 109.291 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 44.6 t -81.32 12.29 3.71 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.562 1.163 . . . . 0.0 109.97 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -132.31 -3.72 3.44 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.443 1.09 . . . . 0.0 110.346 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 177' ' ' GLY . . . . . 0.518 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 97.29 -12.25 65.17 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.494 1.122 . . . . 0.0 111.003 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 178' ' ' LYS . . . . . 0.45 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 0.1 OUTLIER -54.78 115.17 2.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.492 0.76 . . . . 0.0 109.306 -179.965 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 179' ' ' ARG . . . . . 0.435 ' HG2' ' CD ' ' A' ' 173' ' ' GLU . 0.3 OUTLIER -88.72 127.78 35.6 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.487 1.117 . . . . 0.0 110.286 -179.973 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 180' ' ' GLY . . . . . 0.534 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -153.48 -171.77 21.0 Favored Glycine 0 CA--C 1.529 0.946 0 O-C-N 124.441 1.088 . . . . 0.0 111.019 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 181' ' ' MET . . . . . 0.445 ' O ' ' N ' ' A' ' 151' ' ' LEU . 0.0 OUTLIER -86.4 135.34 33.53 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.492 0.76 . . . . 0.0 111.039 179.939 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 1.04 HD12 ' HB3' ' A' ' 172' ' ' ALA . 30.4 mt -134.09 137.67 28.77 Favored Pre-proline 0 C--N 1.325 -0.466 0 O-C-N 124.422 1.076 . . . . 0.0 109.315 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 183' ' ' PRO . . . . . 0.73 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.1 Cg_endo -75.03 121.87 6.84 Favored 'Trans proline' 0 C--N 1.36 1.152 0 O-C-N 124.508 1.794 . . . . 0.0 111.027 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.84 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 24.6 t -69.5 -29.32 1.75 Allowed Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.536 1.147 . . . . 0.0 109.26 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 185' ' ' PRO . . . . . 0.84 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.98 -23.68 13.6 Favored 'Trans proline' 0 C--N 1.359 1.09 0 O-C-N 124.538 1.81 . . . . 0.0 111.012 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.73 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.6 m-85 -99.42 -3.12 34.46 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.521 1.138 . . . . 0.0 111.0 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 187' ' ' VAL . . . . . 0.759 HG12 ' HA ' ' A' ' 139' ' ' ALA . 5.2 m -130.34 162.41 38.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.542 1.151 . . . . 0.0 109.265 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 188' ' ' GLU . . . . . 0.484 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 1.0 OUTLIER -110.67 158.2 18.87 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.583 1.177 . . . . 0.0 110.286 179.993 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.512 0 O-C-N 124.505 1.128 . . . . 0.0 109.274 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' CYS . . . . . 0.43 ' O ' ' CD1' ' A' ' 136' ' ' TYR . 8.9 t . . . . . 0 N--CA 1.453 -0.296 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' TYR . . . . . 0.43 ' CD1' ' O ' ' A' ' 135' ' ' CYS . 36.3 m-85 -150.99 164.0 37.41 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.405 1.066 . . . . 0.0 111.062 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.754 HG12 ' HA ' ' A' ' 189' ' ' LYS . 15.4 m -138.61 165.72 24.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.573 1.171 . . . . 0.0 109.332 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.598 ' HA ' HD13 ' A' ' 158' ' ' ILE . 16.1 ttp180 -124.04 112.93 17.74 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.475 1.109 . . . . 0.0 110.321 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.554 ' O ' ' N ' ' A' ' 156' ' ' GLY . . . -83.36 103.93 13.12 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.498 1.123 . . . . 0.0 109.305 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.407 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 0.7 OUTLIER -88.87 27.82 1.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.449 1.093 . . . . 0.0 109.41 179.93 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.456 ' CD1' ' HA ' ' A' ' 186' ' ' TYR . 58.1 m-85 -147.86 151.3 35.69 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.497 1.123 . . . . 0.0 110.98 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -88.9 126.21 35.28 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.536 1.148 . . . . 0.0 109.317 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.626 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 3.0 t80 . . . . . 0 C--N 1.324 -0.51 0 O-C-N 124.445 1.09 . . . . 0.0 111.007 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.753 HD23 ' CG2' ' A' ' 182' ' ' ILE . 15.8 tp . . . . . 0 N--CA 1.452 -0.342 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.03 162.34 37.22 Favored 'Trans proline' 0 C--N 1.36 1.168 0 O-C-N 124.465 1.771 . . . . 0.0 110.984 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.626 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 17.9 p90 -178.69 177.32 0.89 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.478 1.111 . . . . 0.0 111.01 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.57 140.7 49.48 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.512 1.132 . . . . 0.0 109.311 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 155' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.1 OUTLIER -45.28 131.01 8.18 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.527 1.142 . . . . 0.0 109.313 179.887 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 85.85 22.71 48.63 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 124.441 1.088 . . . . 0.0 111.002 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 157' ' ' ASP . . . . . 0.407 ' O ' HD13 ' A' ' 158' ' ' ILE . 30.9 t70 -99.07 167.9 10.42 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.504 0.767 . . . . 0.0 109.269 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.598 HD13 ' HA ' ' A' ' 138' ' ' ARG . 51.5 mm -120.72 146.89 24.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.567 1.167 . . . . 0.0 109.306 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.632 HD13 ' CG2' ' A' ' 182' ' ' ILE . 0.9 OUTLIER -136.92 138.45 40.66 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.432 1.082 . . . . 0.0 109.347 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.42 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 5.0 mtm180 -87.67 96.41 10.42 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.513 1.133 . . . . 0.0 110.311 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 161' ' ' ILE . . . . . 0.853 HD11 ' HD2' ' A' ' 164' ' ' LYS . 0.0 OUTLIER -84.44 125.85 40.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.431 1.082 . . . . 0.0 109.296 -179.951 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 162' ' ' ARG . . . . . 0.453 ' CG ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -119.04 -21.76 7.54 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.58 1.175 . . . . 0.0 110.322 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 163' ' ' ASP . . . . . 0.634 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -136.6 149.87 48.26 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.472 1.107 . . . . 0.0 109.307 -179.993 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 164' ' ' LYS . . . . . 0.853 ' HD2' HD11 ' A' ' 161' ' ' ILE . 0.0 OUTLIER -155.48 74.17 5.35 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.488 1.118 . . . . 0.0 109.312 179.981 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 -38.34 1.64 Allowed 'Trans proline' 0 C--N 1.359 1.108 0 O-C-N 124.51 1.795 . . . . 0.0 111.086 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 166' ' ' GLU . . . . . 0.446 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.5 mm-40 -85.69 171.49 11.59 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.545 1.153 . . . . 0.0 110.271 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -110.49 50.42 0.81 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.589 1.181 . . . . 0.0 110.336 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 170.66 -32.19 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.435 1.085 . . . . 0.0 110.259 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -120.65 100.54 7.18 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.514 1.133 . . . . 0.0 107.974 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 170' ' ' TRP . . . . . 0.686 ' CE2' HG21 ' A' ' 184' ' ' VAL . 40.8 m0 -105.8 164.26 12.07 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.492 1.12 . . . . 0.0 107.991 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 171' ' ' ASN . . . . . 0.449 ' HB3' ' OD1' ' A' ' 163' ' ' ASP . 1.6 m-20 -98.91 114.08 26.52 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.441 1.088 . . . . 0.0 109.343 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 172' ' ' ALA . . . . . 0.654 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -139.0 166.31 24.83 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.466 1.103 . . . . 0.0 109.288 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.558 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 2.1 mp0 -95.8 157.45 15.89 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.493 1.121 . . . . 0.0 110.369 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 174' ' ' ASP . . . . . 0.517 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.1 OUTLIER -89.84 -163.46 1.01 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.515 1.135 . . . . 0.0 109.32 -179.993 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 60.8 p -80.31 9.65 5.53 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.489 1.118 . . . . 0.0 110.024 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -131.08 -4.92 3.91 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.522 1.139 . . . . 0.0 110.31 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 177' ' ' GLY . . . . . 0.509 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 103.14 -11.45 55.39 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 124.53 1.144 . . . . 0.0 111.008 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 178' ' ' LYS . . . . . 0.627 ' O ' HD11 ' A' ' 151' ' ' LEU . 2.6 mttt -52.51 111.7 0.69 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.483 0.755 . . . . 0.0 109.286 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 179' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 179' ' ' ARG . 0.1 OUTLIER -88.79 123.51 33.26 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.451 1.094 . . . . 0.0 110.291 -179.981 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 180' ' ' GLY . . . . . 0.446 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -155.57 -161.8 10.88 Favored Glycine 0 CA--C 1.531 1.034 0 O-C-N 124.535 1.147 . . . . 0.0 110.991 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.9 mmt -93.73 116.11 28.58 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.506 0.768 . . . . 0.0 110.956 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.884 HD13 HG21 ' A' ' 187' ' ' VAL . 2.2 pp -103.48 132.28 21.24 Favored Pre-proline 0 C--N 1.324 -0.518 0 O-C-N 124.551 1.157 . . . . 0.0 109.259 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 183' ' ' PRO . . . . . 0.834 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.6 Cg_endo -74.99 123.39 7.85 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.521 1.801 . . . . 0.0 111.025 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.838 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 69.7 t -71.36 -30.57 1.65 Allowed Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.464 1.102 . . . . 0.0 109.261 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 185' ' ' PRO . . . . . 0.838 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.99 -28.22 9.36 Favored 'Trans proline' 0 C--N 1.36 1.143 0 O-C-N 124.547 1.814 . . . . 0.0 110.988 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.618 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.8 m-85 -99.47 -5.07 30.01 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.47 1.106 . . . . 0.0 110.921 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 187' ' ' VAL . . . . . 0.884 HG21 HD13 ' A' ' 182' ' ' ILE . 1.5 m -132.13 162.96 38.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.492 1.12 . . . . 0.0 109.269 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 188' ' ' GLU . . . . . 0.471 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 3.8 tt0 -111.82 147.97 34.59 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.5 1.125 . . . . 0.0 110.32 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 189' ' ' LYS . . . . . 0.754 ' HA ' HG12 ' A' ' 137' ' ' VAL . 3.4 ptpp? . . . . . 0 C--N 1.324 -0.52 0 O-C-N 124.533 1.145 . . . . 0.0 109.284 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' CYS . . . . . 0.637 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 20.4 p . . . . . 0 N--CA 1.452 -0.364 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' TYR . . . . . 0.637 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 27.1 m-85 -149.8 157.32 43.09 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.561 1.163 . . . . 0.0 111.0 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.595 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 21.9 m -136.65 137.59 47.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.568 1.168 . . . . 0.0 109.234 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.59 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 7.1 ttt180 -101.51 111.01 23.12 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.444 1.09 . . . . 0.0 110.285 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.599 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -80.55 110.77 16.34 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.453 1.096 . . . . 0.0 109.349 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.663 HD13 ' H ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -88.23 19.01 3.94 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.526 1.141 . . . . 0.0 109.296 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -141.7 172.2 13.01 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.541 1.15 . . . . 0.0 110.979 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -109.93 156.08 20.9 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.492 1.12 . . . . 0.0 109.283 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.585 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 65.3 t80 . . . . . 0 C--N 1.326 -0.45 0 O-C-N 124.572 1.17 . . . . 0.0 110.985 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.578 HD22 ' O ' ' A' ' 172' ' ' ALA . 24.8 tp . . . . . 0 N--CA 1.452 -0.335 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 152' ' ' PRO . . . . . 0.462 ' HA ' ' O ' ' A' ' 143' ' ' PHE . 18.3 Cg_endo -75.02 157.84 42.47 Favored 'Trans proline' 0 C--N 1.359 1.122 0 O-C-N 124.527 1.804 . . . . 0.0 110.952 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.585 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 25.8 p90 -166.43 -175.53 3.26 Favored 'General case' 0 C--N 1.327 -0.412 0 O-C-N 124.449 1.093 . . . . 0.0 110.95 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 154' ' ' LYS . . . . . 0.52 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -138.55 132.3 30.91 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.574 1.171 . . . . 0.0 109.326 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 155' ' ' LYS . . . . . 0.52 ' C ' ' O ' ' A' ' 154' ' ' LYS . 5.8 ttmt -31.15 130.76 0.11 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.526 1.141 . . . . 0.0 109.252 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 72.85 42.24 46.43 Favored Glycine 0 CA--C 1.53 1.005 0 O-C-N 124.496 1.123 . . . . 0.0 111.033 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 157' ' ' ASP . . . . . 0.716 ' C ' HD12 ' A' ' 158' ' ' ILE . 15.5 t70 -111.21 167.49 10.24 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.502 0.766 . . . . 0.0 109.305 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.716 HD12 ' C ' ' A' ' 157' ' ' ASP . 1.8 mp -122.81 146.16 28.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 O-C-N 124.499 1.124 . . . . 0.0 109.23 -179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.651 ' CD1' HD13 ' A' ' 182' ' ' ILE . 0.6 OUTLIER -142.07 138.69 31.92 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.481 1.113 . . . . 0.0 109.323 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.464 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.3 OUTLIER -91.49 105.07 17.49 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.522 1.139 . . . . 0.0 110.281 -179.976 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 161' ' ' ILE . . . . . 0.808 HD11 ' HG2' ' A' ' 164' ' ' LYS . 0.0 OUTLIER -85.79 126.48 40.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.469 1.105 . . . . 0.0 109.324 179.983 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.08 -25.92 6.08 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.52 1.137 . . . . 0.0 110.327 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 163' ' ' ASP . . . . . 0.605 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -137.23 157.4 46.74 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.532 1.145 . . . . 0.0 109.28 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 164' ' ' LYS . . . . . 0.808 ' HG2' HD11 ' A' ' 161' ' ' ILE . 5.5 mttt -142.66 78.82 15.67 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.526 1.141 . . . . 0.0 109.268 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.06 10.1 1.84 Allowed 'Trans proline' 0 C--N 1.36 1.141 0 O-C-N 124.528 1.804 . . . . 0.0 110.984 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 166' ' ' GLU . . . . . 0.402 ' H ' ' C ' ' A' ' 164' ' ' LYS . 26.1 mt-10 -151.06 174.39 13.23 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.545 1.153 . . . . 0.0 110.261 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -99.07 7.98 45.38 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.505 1.128 . . . . 0.0 110.287 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.508 ' O ' ' N ' ' A' ' 184' ' ' VAL . 57.5 mt-30 -147.99 -45.11 0.16 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.582 1.176 . . . . 0.0 110.34 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -98.45 96.89 8.31 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 170' ' ' TRP . . . . . 0.975 ' CE2' HG21 ' A' ' 184' ' ' VAL . 31.5 m0 -102.06 154.82 18.62 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.521 1.138 . . . . 0.0 107.964 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 171' ' ' ASN . . . . . 0.448 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -88.2 111.13 21.29 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.463 1.102 . . . . 0.0 109.325 179.933 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 172' ' ' ALA . . . . . 0.578 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -134.92 166.65 22.52 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.487 1.117 . . . . 0.0 109.251 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.57 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.6 OUTLIER -96.31 155.48 16.75 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.554 1.159 . . . . 0.0 110.291 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 174' ' ' ASP . . . . . 0.492 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.7 OUTLIER -94.57 -162.08 0.91 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.442 1.089 . . . . 0.0 109.263 -179.984 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 38.1 m -79.33 7.23 8.21 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.476 1.11 . . . . 0.0 109.978 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 176' ' ' GLU . . . . . 0.418 ' HB2' ' HG2' ' A' ' 178' ' ' LYS . 2.6 mt-10 -125.72 -4.92 7.02 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.548 1.155 . . . . 0.0 110.291 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 177' ' ' GLY . . . . . 0.508 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 96.7 -12.0 66.22 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.5 1.125 . . . . 0.0 111.032 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 178' ' ' LYS . . . . . 0.481 ' O ' HD11 ' A' ' 151' ' ' LEU . 0.1 OUTLIER -57.48 114.9 2.43 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.467 0.745 . . . . 0.0 109.29 -179.954 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 179' ' ' ARG . . . . . 0.452 ' HG3' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -88.94 127.34 35.65 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.52 1.137 . . . . 0.0 110.307 -179.992 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 180' ' ' GLY . . . . . 0.448 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -153.42 -169.74 18.81 Favored Glycine 0 CA--C 1.53 0.998 0 O-C-N 124.422 1.077 . . . . 0.0 111.001 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.9 mmt -93.55 116.38 28.89 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 124.47 0.747 . . . . 0.0 111.04 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.651 HD13 ' CD1' ' A' ' 159' ' ' LEU . 1.3 tp -117.12 141.37 28.37 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.492 1.12 . . . . 0.0 109.255 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 183' ' ' PRO . . . . . 0.755 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.07 128.92 11.81 Favored 'Trans proline' 0 C--N 1.361 1.186 0 O-C-N 124.492 1.786 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.975 HG21 ' CE2' ' A' ' 170' ' ' TRP . 10.4 t -72.75 -28.8 1.06 Allowed Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.472 1.108 . . . . 0.0 109.277 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 185' ' ' PRO . . . . . 0.854 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -75.02 -17.56 19.39 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.473 1.775 . . . . 0.0 110.989 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.755 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 9.9 m-85 -100.78 -6.63 24.63 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.524 1.14 . . . . 0.0 111.021 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 187' ' ' VAL . . . . . 0.599 HG12 ' HA ' ' A' ' 139' ' ' ALA . 2.6 m -133.98 157.68 42.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.568 1.168 . . . . 0.0 109.292 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 188' ' ' GLU . . . . . 0.595 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 1.3 tm-20 -98.78 152.62 19.49 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.508 1.13 . . . . 0.0 110.293 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 9.3 mtmm . . . . . 0 C--N 1.324 -0.502 0 O-C-N 124.573 1.17 . . . . 0.0 109.273 -179.974 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.452 -0.334 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 136' ' ' TYR . . . . . 0.425 ' HA ' ' O ' ' A' ' 159' ' ' LEU . 89.0 m-85 -138.54 178.73 6.93 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.448 1.093 . . . . 0.0 111.015 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.659 HG23 HD12 ' A' ' 159' ' ' LEU . 33.5 m -145.33 139.1 21.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.571 1.169 . . . . 0.0 109.271 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.644 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 12.2 ttm180 -101.35 114.84 29.2 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.442 1.089 . . . . 0.0 110.285 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.49 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -82.86 109.72 17.24 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.476 1.11 . . . . 0.0 109.279 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.804 HD22 ' H ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -89.92 23.97 2.58 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.511 1.132 . . . . 0.0 109.28 179.995 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.42 ' CA ' ' HG2' ' A' ' 155' ' ' LYS . 39.8 m-85 -143.82 155.47 44.14 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.48 1.113 . . . . 0.0 111.002 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.31 126.48 40.65 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.545 1.153 . . . . 0.0 109.339 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.578 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.6 OUTLIER . . . . . 0 C--N 1.326 -0.453 0 O-C-N 124.485 1.115 . . . . 0.0 110.981 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.801 ' HB3' HG23 ' A' ' 182' ' ' ILE . 7.7 tp . . . . . 0 N--CA 1.453 -0.296 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.99 -178.18 3.98 Favored 'Trans proline' 0 C--N 1.359 1.089 0 O-C-N 124.551 1.816 . . . . 0.0 111.012 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.578 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 1.6 p90 173.19 -177.89 0.07 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.53 1.144 . . . . 0.0 111.024 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 154' ' ' LYS . . . . . 0.416 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.4 OUTLIER -119.93 138.45 53.44 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.515 1.134 . . . . 0.0 109.301 179.98 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 155' ' ' LYS . . . . . 0.515 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.1 OUTLIER -39.06 123.94 1.39 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.469 1.106 . . . . 0.0 109.291 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.478 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 83.98 38.61 10.11 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.522 1.139 . . . . 0.0 110.999 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 157' ' ' ASP . . . . . 0.425 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 17.0 t70 -108.52 169.04 8.9 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.521 0.777 . . . . 0.0 109.301 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.49 ' C ' ' HG ' ' A' ' 159' ' ' LEU . 8.4 mm -122.22 149.41 25.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 O-C-N 124.472 1.107 . . . . 0.0 109.346 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.778 HD13 HG21 ' A' ' 182' ' ' ILE . 0.2 OUTLIER -143.78 141.21 30.31 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.543 1.152 . . . . 0.0 109.314 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.535 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.1 OUTLIER -86.66 96.73 10.23 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.456 1.098 . . . . 0.0 110.278 -179.97 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 161' ' ' ILE . . . . . 0.86 HD11 ' HB2' ' A' ' 170' ' ' TRP . 0.2 OUTLIER -82.71 125.61 39.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.41 1.069 . . . . 0.0 109.281 179.995 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -124.39 -22.06 4.78 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.476 1.11 . . . . 0.0 110.306 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 163' ' ' ASP . . . . . 0.481 ' C ' ' HG3' ' A' ' 164' ' ' LYS . 71.2 m-20 -125.46 125.31 43.12 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.52 1.137 . . . . 0.0 109.365 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 164' ' ' LYS . . . . . 0.602 ' HE3' HG21 ' A' ' 161' ' ' ILE . 2.2 mtpt -136.47 63.08 46.53 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.559 1.162 . . . . 0.0 109.277 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 165' ' ' PRO . . . . . 0.442 ' HD3' ' N ' ' A' ' 164' ' ' LYS . 18.2 Cg_endo -75.03 -50.89 0.12 Allowed 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.508 1.794 . . . . 0.0 110.967 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 166' ' ' GLU . . . . . 0.511 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 0.6 OUTLIER -73.2 177.32 5.17 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.49 1.119 . . . . 0.0 110.359 179.979 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -117.81 47.57 1.53 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.566 1.166 . . . . 0.0 110.292 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 174.87 -32.56 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.491 1.119 . . . . 0.0 110.3 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 169' ' ' TRP . . . . . 0.579 ' CE3' ' HG2' ' A' ' 181' ' ' MET . 70.0 m95 -119.1 104.92 10.9 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.493 1.121 . . . . 0.0 108.01 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 170' ' ' TRP . . . . . 0.86 ' HB2' HD11 ' A' ' 161' ' ' ILE . 53.9 m0 -110.63 154.56 23.62 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 171' ' ' ASN . . . . . 0.504 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 2.6 t30 -95.26 117.86 31.01 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.434 1.084 . . . . 0.0 109.326 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 172' ' ' ALA . . . . . 0.794 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -141.03 161.42 37.9 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.476 1.11 . . . . 0.0 109.28 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.613 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.8 OUTLIER -90.54 155.63 18.75 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.45 1.094 . . . . 0.0 110.326 -179.966 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 174' ' ' ASP . . . . . 0.651 ' N ' HD21 ' A' ' 151' ' ' LEU . 0.4 OUTLIER -90.08 -161.41 0.79 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.449 1.093 . . . . 0.0 109.308 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 5.6 t -81.21 12.7 3.3 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.507 1.129 . . . . 0.0 109.994 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -132.23 -6.26 3.41 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.567 1.167 . . . . 0.0 110.318 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 177' ' ' GLY . . . . . 0.521 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 101.62 -12.98 58.15 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.476 1.11 . . . . 0.0 111.007 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 178' ' ' LYS . . . . . 0.588 ' O ' HD11 ' A' ' 151' ' ' LEU . 2.7 mtmt -52.75 113.28 1.03 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.545 0.791 . . . . 0.0 109.322 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 179' ' ' ARG . . . . . 0.466 ' CG ' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -89.24 125.02 34.91 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 124.531 1.145 . . . . 0.0 110.327 -179.979 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 180' ' ' GLY . . . . . 0.504 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.42 -165.96 14.5 Favored Glycine 0 CA--C 1.53 1.021 0 O-C-N 124.529 1.143 . . . . 0.0 110.954 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 181' ' ' MET . . . . . 0.579 ' HG2' ' CE3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -101.88 125.85 48.64 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.529 0.782 . . . . 0.0 111.004 179.976 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.843 ' O ' HD12 ' A' ' 182' ' ' ILE . 2.2 pp -121.89 149.3 53.34 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.54 1.15 . . . . 0.0 109.292 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 183' ' ' PRO . . . . . 0.894 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -74.95 125.87 9.63 Favored 'Trans proline' 0 C--N 1.359 1.124 0 O-C-N 124.591 1.837 . . . . 0.0 110.966 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.852 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 55.4 t -68.98 -29.43 1.91 Allowed Pre-proline 0 C--N 1.326 -0.436 0 O-C-N 124.492 1.12 . . . . 0.0 109.265 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 185' ' ' PRO . . . . . 0.852 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -75.04 -24.28 12.9 Favored 'Trans proline' 0 C--N 1.359 1.079 0 O-C-N 124.542 1.812 . . . . 0.0 110.995 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.894 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.0 m-85 -99.58 -0.18 40.97 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.525 1.141 . . . . 0.0 110.965 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 187' ' ' VAL . . . . . 0.65 HG22 ' O ' ' A' ' 183' ' ' PRO . 4.2 m -134.03 154.96 38.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 O-C-N 124.464 1.102 . . . . 0.0 109.313 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 188' ' ' GLU . . . . . 0.539 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.2 OUTLIER -106.11 159.53 16.01 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 0.0 110.275 -179.991 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.418 0 O-C-N 124.509 1.13 . . . . 0.0 109.32 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 10.4 p . . . . . 0 N--CA 1.453 -0.319 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 136' ' ' TYR . . . . . 0.418 ' CE1' ' HB2' ' A' ' 160' ' ' ARG . 43.0 m-85 -155.88 165.52 36.22 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.515 1.135 . . . . 0.0 111.013 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 159' ' ' LEU . 19.8 m -142.86 147.02 21.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.58 1.175 . . . . 0.0 109.27 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.719 ' O ' HD13 ' A' ' 140' ' ' LEU . 0.1 OUTLIER -103.08 111.55 23.96 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.523 1.139 . . . . 0.0 110.285 -179.981 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.57 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -82.12 104.39 12.42 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.501 1.126 . . . . 0.0 109.336 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.719 HD13 ' O ' ' A' ' 138' ' ' ARG . 0.0 OUTLIER -88.74 24.27 2.07 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.564 1.165 . . . . 0.0 109.33 -179.998 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.497 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 9.6 m-85 -146.93 145.86 29.93 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.485 1.116 . . . . 0.0 110.989 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.6 152.26 22.75 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.57 1.169 . . . . 0.0 109.285 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.57 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.3 OUTLIER . . . . . 0 C--N 1.325 -0.469 0 O-C-N 124.434 1.084 . . . . 0.0 110.959 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.841 ' O ' HG22 ' A' ' 182' ' ' ILE . 8.8 tp . . . . . 0 N--CA 1.453 -0.29 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 152' ' ' PRO . . . . . 0.424 ' CB ' ' O ' ' A' ' 143' ' ' PHE . 18.2 Cg_endo -75.08 179.03 6.51 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.491 1.785 . . . . 0.0 111.035 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.57 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 0.4 OUTLIER -177.58 -171.81 0.33 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.43 1.081 . . . . 0.0 111.033 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.82 139.96 53.44 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.545 1.153 . . . . 0.0 109.287 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 155' ' ' LYS . . . . . 0.494 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -44.26 115.53 0.86 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.543 1.152 . . . . 0.0 109.312 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.443 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 93.35 43.73 3.93 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 124.605 1.191 . . . . 0.0 111.025 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -115.53 170.94 8.05 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.458 0.74 . . . . 0.0 109.295 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 158' ' ' ILE . . . . . 0.529 HD13 ' HA ' ' A' ' 138' ' ' ARG . 48.8 mm -120.66 144.99 27.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.529 1.143 . . . . 0.0 109.376 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.648 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 0.5 OUTLIER -140.88 133.74 29.03 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.497 1.123 . . . . 0.0 109.286 -179.91 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.481 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 8.5 ttp85 -89.83 106.85 18.75 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.484 1.115 . . . . 0.0 110.298 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 161' ' ' ILE . . . . . 0.711 ' C ' HD12 ' A' ' 161' ' ' ILE . 0.5 OUTLIER -83.42 127.8 39.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 124.468 1.105 . . . . 0.0 109.259 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.47 -20.59 6.01 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 124.498 1.124 . . . . 0.0 110.275 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 163' ' ' ASP . . . . . 0.447 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 3.7 m-20 -135.63 148.76 49.11 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.517 1.135 . . . . 0.0 109.343 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 164' ' ' LYS . . . . . 0.569 ' HG3' ' CE2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -145.68 76.36 12.92 Favored Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.36 1.038 . . . . 0.0 109.334 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -74.89 -46.95 0.22 Allowed 'Trans proline' 0 C--N 1.36 1.183 0 O-C-N 124.504 1.792 . . . . 0.0 111.049 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 166' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -91.17 173.87 7.7 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.416 1.072 . . . . 0.0 110.278 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 167' ' ' GLU . . . . . 0.458 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 1.6 mm-40 -104.04 36.43 2.35 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.453 1.096 . . . . 0.0 110.358 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 184' ' ' VAL . 3.3 mt-30 -173.09 -39.06 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.58 1.175 . . . . 0.0 110.312 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 169' ' ' TRP . . . . . 0.483 ' CZ3' ' HD3' ' A' ' 183' ' ' PRO . 85.6 m95 -109.66 98.6 7.92 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.527 1.142 . . . . 0.0 107.994 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 170' ' ' TRP . . . . . 0.986 ' CE2' HG21 ' A' ' 184' ' ' VAL . 20.7 m0 -105.01 160.04 15.34 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.5 1.125 . . . . 0.0 108.041 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 171' ' ' ASN . . . . . 0.57 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -92.02 112.16 23.99 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.53 1.144 . . . . 0.0 109.283 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 172' ' ' ALA . . . . . 0.635 ' HB2' HG22 ' A' ' 161' ' ' ILE . . . -135.0 164.17 28.23 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.575 1.172 . . . . 0.0 109.283 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.648 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 18.6 mp0 -95.02 157.87 15.71 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.481 1.113 . . . . 0.0 110.229 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 174' ' ' ASP . . . . . 0.808 ' CG ' HD11 ' A' ' 151' ' ' LEU . 0.4 OUTLIER -90.21 -158.89 0.56 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.564 1.165 . . . . 0.0 109.295 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 24.6 m -83.34 10.67 8.1 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.539 1.15 . . . . 0.0 109.958 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -133.61 -5.23 2.89 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.553 1.158 . . . . 0.0 110.294 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 177' ' ' GLY . . . . . 0.527 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 106.58 -17.59 39.29 Favored Glycine 0 CA--C 1.53 1.031 0 O-C-N 124.502 1.126 . . . . 0.0 110.983 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 178' ' ' LYS . . . . . 0.514 ' O ' HD22 ' A' ' 151' ' ' LEU . 0.6 OUTLIER -42.87 109.43 0.14 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.495 0.762 . . . . 0.0 109.336 179.956 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 179' ' ' ARG . . . . . 0.472 ' HG2' ' OE2' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -91.3 123.19 34.55 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.494 1.121 . . . . 0.0 110.278 -179.986 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 180' ' ' GLY . . . . . 0.57 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -157.25 -162.89 11.93 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.5 1.125 . . . . 0.0 110.998 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 41.5 mtp -104.78 120.75 42.12 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.446 0.733 . . . . 0.0 110.999 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.841 HG22 ' O ' ' A' ' 151' ' ' LEU . 2.5 pp -120.88 150.89 53.93 Favored Pre-proline 0 C--N 1.325 -0.47 0 O-C-N 124.489 1.118 . . . . 0.0 109.369 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 183' ' ' PRO . . . . . 0.775 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.02 131.27 14.07 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.451 1.764 . . . . 0.0 110.995 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.986 HG21 ' CE2' ' A' ' 170' ' ' TRP . 53.9 t -74.43 -28.98 0.9 Allowed Pre-proline 0 C--N 1.324 -0.521 0 O-C-N 124.509 1.131 . . . . 0.0 109.272 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 185' ' ' PRO . . . . . 0.868 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.2 Cg_endo -74.99 -19.25 18.05 Favored 'Trans proline' 0 C--N 1.361 1.191 0 O-C-N 124.442 1.759 . . . . 0.0 111.026 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.775 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 8.5 m-85 -98.57 -1.36 41.22 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.532 1.145 . . . . 0.0 110.997 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 187' ' ' VAL . . . . . 0.57 HG12 ' HA ' ' A' ' 139' ' ' ALA . 7.5 m -134.68 156.37 39.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 124.534 1.146 . . . . 0.0 109.26 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 188' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 1.5 pp20? -108.55 168.12 9.55 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.489 1.118 . . . . 0.0 110.274 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 189' ' ' LYS . . . . . 0.417 ' O ' ' OE2' ' A' ' 188' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.475 0 O-C-N 124.555 1.159 . . . . 0.0 109.244 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.452 -0.329 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 136' ' ' TYR . . . . . 0.558 ' CE2' ' HB2' ' A' ' 160' ' ' ARG . 80.2 m-85 -152.71 169.23 23.24 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.541 1.15 . . . . 0.0 110.996 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.567 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 26.8 m -145.54 148.41 17.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.487 1.117 . . . . 0.0 109.306 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.504 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 5.6 ttp180 -104.34 111.47 24.12 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.514 1.134 . . . . 0.0 110.314 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.483 ' CB ' HG12 ' A' ' 187' ' ' VAL . . . -80.18 107.05 12.66 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.508 1.13 . . . . 0.0 109.34 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.404 ' O ' ' HG2' ' A' ' 155' ' ' LYS . 1.1 mt -88.33 21.8 2.72 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.5 1.125 . . . . 0.0 109.287 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.507 ' CD1' ' HA ' ' A' ' 186' ' ' TYR . 72.3 m-85 -141.55 138.86 32.99 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.487 1.117 . . . . 0.0 111.01 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.28 153.46 25.85 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.469 1.105 . . . . 0.0 109.319 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.618 ' CZ ' ' OD2' ' A' ' 150' ' ' ASP . 4.7 t80 -177.16 102.85 0.05 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.505 1.128 . . . . 0.0 110.991 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -134.66 101.85 5.08 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.47 1.106 . . . . 0.0 109.265 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -157.4 -128.53 1.05 Allowed Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.435 1.084 . . . . 0.0 111.017 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 171.32 84.65 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.488 0.758 . . . . 0.0 109.311 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -109.77 -75.08 0.63 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.498 1.124 . . . . 0.0 109.303 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -109.86 35.07 3.51 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.473 1.108 . . . . 0.0 110.327 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 65.88 17.72 10.9 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.47 1.106 . . . . 0.0 110.344 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.618 ' OD2' ' CZ ' ' A' ' 143' ' ' PHE . 3.8 t0 -58.15 134.8 56.79 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.455 1.097 . . . . 0.0 109.292 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.762 HD23 ' CG1' ' A' ' 182' ' ' ILE . 34.7 tp -66.55 111.86 7.91 Favored Pre-proline 0 C--N 1.326 -0.45 0 O-C-N 124.485 1.116 . . . . 0.0 109.273 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' PRO . . . . . 0.596 ' HD2' HD12 ' A' ' 151' ' ' LEU . 18.4 Cg_endo -75.03 170.2 20.93 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.535 1.808 . . . . 0.0 111.029 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.597 ' CE1' ' HB3' ' A' ' 143' ' ' PHE . 0.7 OUTLIER -173.83 -175.59 1.1 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.502 1.126 . . . . 0.0 110.966 -179.996 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 154' ' ' LYS . . . . . 0.439 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -131.56 135.87 47.36 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.505 1.128 . . . . 0.0 109.313 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 155' ' ' LYS . . . . . 0.439 ' C ' ' O ' ' A' ' 154' ' ' LYS . 0.0 OUTLIER -37.54 110.88 0.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.511 1.132 . . . . 0.0 109.353 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 94.79 42.41 3.86 Favored Glycine 0 CA--C 1.529 0.955 0 O-C-N 124.496 1.122 . . . . 0.0 110.999 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' ASP . . . . . 0.431 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 17.6 t70 -111.68 165.88 11.65 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.496 0.762 . . . . 0.0 109.339 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.465 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 4.9 mp -119.89 140.16 44.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.504 1.128 . . . . 0.0 109.338 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.742 HD13 HD12 ' A' ' 182' ' ' ILE . 0.8 OUTLIER -137.07 134.64 36.72 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.5 1.125 . . . . 0.0 109.297 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.558 ' HB2' ' CE2' ' A' ' 136' ' ' TYR . 10.0 ttm180 -87.1 104.07 15.99 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.507 1.129 . . . . 0.0 110.28 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.795 HG22 ' HB2' ' A' ' 172' ' ' ALA . 0.8 OUTLIER -84.62 125.93 40.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.44 1.088 . . . . 0.0 109.286 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 5.9 ptt180 -121.43 -24.94 5.28 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.45 1.094 . . . . 0.0 110.279 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' ASP . . . . . 0.446 ' HB2' ' CB ' ' A' ' 171' ' ' ASN . 79.2 m-20 -126.4 131.82 51.66 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.471 1.107 . . . . 0.0 109.261 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.548 ' CG ' HD13 ' A' ' 161' ' ' ILE . 0.0 OUTLIER -133.46 69.62 76.96 Favored Pre-proline 0 C--N 1.325 -0.466 0 O-C-N 124.473 1.108 . . . . 0.0 109.248 179.998 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.02 -52.15 0.11 Allowed 'Trans proline' 0 C--N 1.359 1.12 0 O-C-N 124.512 1.796 . . . . 0.0 111.002 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 166' ' ' GLU . . . . . 0.444 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 4.1 mm-40 -76.73 175.1 9.71 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.478 1.111 . . . . 0.0 110.267 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 167' ' ' GLU . . . . . 0.522 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 3.3 pt-20 -106.56 31.69 5.05 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.467 1.104 . . . . 0.0 110.321 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.522 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 3.1 mt-30 -172.35 -40.17 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.475 1.11 . . . . 0.0 110.316 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -106.04 104.57 14.3 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 0.0 107.981 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 170' ' ' TRP . . . . . 0.704 ' CE2' HG21 ' A' ' 184' ' ' VAL . 50.1 m0 -109.45 154.6 22.4 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.527 1.142 . . . . 0.0 107.988 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.468 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 1.0 OUTLIER -88.25 111.06 21.24 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.503 1.127 . . . . 0.0 109.355 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 172' ' ' ALA . . . . . 0.795 ' HB2' HG22 ' A' ' 161' ' ' ILE . . . -127.51 167.34 16.43 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.492 1.12 . . . . 0.0 109.292 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.51 ' CG ' ' O ' ' A' ' 177' ' ' GLY . 6.9 mp0 -101.39 156.28 17.55 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.473 1.108 . . . . 0.0 110.287 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 174' ' ' ASP . . . . . 0.654 ' HB3' HD11 ' A' ' 151' ' ' LEU . 45.2 p-10 -93.85 -160.19 0.75 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.444 1.09 . . . . 0.0 109.316 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 45.0 t -80.92 11.46 3.97 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.478 1.111 . . . . 0.0 109.996 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -132.22 -2.25 3.56 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.435 1.084 . . . . 0.0 110.337 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.51 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 96.01 -12.28 67.12 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.462 1.102 . . . . 0.0 110.985 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 178' ' ' LYS . . . . . 0.478 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 2.9 mtpp -52.67 113.25 1.01 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.474 0.749 . . . . 0.0 109.303 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 179' ' ' ARG . . . . . 0.441 ' HG2' ' CD ' ' A' ' 173' ' ' GLU . 0.5 OUTLIER -87.89 126.26 34.94 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.485 1.116 . . . . 0.0 110.304 -179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.468 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -152.72 -169.3 17.83 Favored Glycine 0 CA--C 1.53 1.002 0 O-C-N 124.522 1.139 . . . . 0.0 110.993 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 181' ' ' MET . . . . . 0.425 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 1.4 mmt -86.78 126.03 34.33 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.528 0.781 . . . . 0.0 111.024 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.762 ' CG1' HD23 ' A' ' 151' ' ' LEU . 18.1 mm -121.5 134.56 24.58 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.475 1.109 . . . . 0.0 109.313 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 183' ' ' PRO . . . . . 0.683 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.2 Cg_endo -75.01 121.13 6.38 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.543 1.812 . . . . 0.0 111.025 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.835 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 9.8 t -69.66 -30.28 2.04 Favored Pre-proline 0 C--N 1.325 -0.475 0 O-C-N 124.51 1.131 . . . . 0.0 109.299 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 185' ' ' PRO . . . . . 0.835 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -75.03 -23.96 13.24 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.527 1.804 . . . . 0.0 111.003 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.681 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.5 m-85 -100.32 -5.02 28.02 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.545 1.153 . . . . 0.0 110.989 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 187' ' ' VAL . . . . . 0.701 HG11 ' CG2' ' A' ' 182' ' ' ILE . 3.3 m -128.49 152.63 36.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.539 1.149 . . . . 0.0 109.273 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 188' ' ' GLU . . . . . 0.567 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.0 OUTLIER -107.98 166.08 10.98 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.491 1.119 . . . . 0.0 110.322 179.992 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.18 117.09 29.33 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.491 1.12 . . . . 0.0 109.325 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -110.01 -65.93 1.11 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.488 1.118 . . . . 0.0 110.996 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 191' ' ' GLY . . . . . 0.449 ' C ' ' H ' ' A' ' 136' ' ' TYR . . . . . . . . 0 CA--C 1.53 1.026 0 O-C-N 124.484 1.115 . . . . 0.0 111.052 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' CYS . . . . . 0.553 ' HB3' ' CE2' ' A' ' 136' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' TYR . . . . . 0.553 ' CE2' ' HB3' ' A' ' 135' ' ' CYS . 68.1 m-85 -151.3 173.9 13.94 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.475 1.109 . . . . 0.0 111.035 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.522 ' HB ' ' CG2' ' A' ' 187' ' ' VAL . 4.2 m -147.67 149.55 15.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 O-C-N 124.492 1.12 . . . . 0.0 109.302 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.83 HH21 HD21 ' A' ' 140' ' ' LEU . 16.4 ttp180 -105.25 107.49 18.5 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.501 1.126 . . . . 0.0 110.316 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.482 ' CB ' HG12 ' A' ' 187' ' ' VAL . . . -80.92 103.95 11.1 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.47 1.106 . . . . 0.0 109.371 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.83 HD21 HH21 ' A' ' 138' ' ' ARG . 2.9 mp -88.89 22.99 2.49 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.527 1.142 . . . . 0.0 109.332 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.429 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 36.4 m-85 -144.01 145.2 32.05 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.514 1.134 . . . . 0.0 111.009 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ASP . . . . . 0.402 ' N ' ' HB2' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -87.63 152.66 21.99 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.563 1.164 . . . . 0.0 109.328 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.603 ' HB3' ' CZ ' ' A' ' 153' ' ' PHE . 5.8 t80 -179.89 153.78 0.54 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.469 1.105 . . . . 0.0 111.013 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ASN . . . . . 0.453 ' O ' ' HB3' ' A' ' 152' ' ' PRO . 0.8 OUTLIER -111.41 -46.55 3.27 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.523 1.139 . . . . 0.0 109.332 179.965 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 98.91 137.14 9.66 Favored Glycine 0 CA--C 1.528 0.892 0 O-C-N 124.476 1.11 . . . . 0.0 111.007 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -138.02 51.44 1.88 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.471 0.748 . . . . 0.0 109.281 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 83.7 m-20 -128.3 -177.39 4.14 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.46 1.1 . . . . 0.0 109.269 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -92.12 28.99 1.72 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.51 1.131 . . . . 0.0 110.275 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 171.37 38.31 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.484 1.115 . . . . 0.0 110.307 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -86.75 175.0 8.46 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.571 1.169 . . . . 0.0 109.329 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.66 HD22 ' O ' ' A' ' 172' ' ' ALA . 11.6 tp -139.18 111.71 7.91 Favored Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.542 1.151 . . . . 0.0 109.344 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 152' ' ' PRO . . . . . 0.453 ' HB3' ' O ' ' A' ' 144' ' ' ASN . 18.2 Cg_endo -75.08 133.62 16.69 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.417 1.746 . . . . 0.0 110.967 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.603 ' CZ ' ' HB3' ' A' ' 143' ' ' PHE . 4.8 p90 -150.8 -179.05 6.95 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 0.0 111.023 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -130.94 147.16 52.54 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.447 1.092 . . . . 0.0 109.238 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' LYS . . . . . 0.412 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -56.34 118.12 4.46 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.538 1.149 . . . . 0.0 109.365 179.941 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 99.72 35.57 4.56 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.472 1.108 . . . . 0.0 110.984 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -120.61 170.29 9.56 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.522 0.778 . . . . 0.0 109.286 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.486 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 5.2 mt -119.46 148.23 22.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 O-C-N 124.553 1.158 . . . . 0.0 109.268 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.644 HD23 ' HA ' ' A' ' 174' ' ' ASP . 0.4 OUTLIER -139.79 136.69 34.33 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.496 1.123 . . . . 0.0 109.28 -179.976 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.445 ' HB3' ' HB2' ' A' ' 173' ' ' GLU . 6.1 ttt-85 -87.69 100.96 13.21 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.554 1.159 . . . . 0.0 110.275 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.916 HD11 ' HG2' ' A' ' 164' ' ' LYS . 0.0 OUTLIER -86.1 130.55 36.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.566 1.166 . . . . 0.0 109.322 179.946 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -129.19 -24.49 2.85 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.5 1.125 . . . . 0.0 110.32 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 163' ' ' ASP . . . . . 0.427 ' HB2' ' CB ' ' A' ' 171' ' ' ASN . 8.7 m-20 -124.78 147.97 48.39 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.406 1.066 . . . . 0.0 109.305 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.916 ' HG2' HD11 ' A' ' 161' ' ' ILE . 10.9 mtmm -144.0 71.32 16.71 Favored Pre-proline 0 C--N 1.324 -0.508 0 O-C-N 124.535 1.147 . . . . 0.0 109.272 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -75.01 4.97 4.27 Favored 'Trans proline' 0 C--N 1.36 1.172 0 O-C-N 124.453 1.765 . . . . 0.0 111.05 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 166' ' ' GLU . . . . . 0.468 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 26.3 mm-40 -141.46 172.75 12.25 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.469 1.106 . . . . 0.0 110.316 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -100.07 16.38 24.25 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.521 1.138 . . . . 0.0 110.318 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -157.84 -43.19 0.06 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.53 1.144 . . . . 0.0 110.26 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 169' ' ' TRP . . . . . 0.502 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 90.0 m95 -100.18 101.03 11.96 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 170' ' ' TRP . . . . . 0.779 ' CE2' HG21 ' A' ' 184' ' ' VAL . 28.8 m0 -107.96 154.45 21.61 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.545 1.153 . . . . 0.0 108.026 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.449 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.5 OUTLIER -87.77 111.79 21.73 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.471 1.107 . . . . 0.0 109.264 -179.921 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 172' ' ' ALA . . . . . 0.66 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -132.81 163.7 28.49 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.556 1.16 . . . . 0.0 109.286 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.494 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.6 OUTLIER -95.98 158.88 15.25 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.493 1.12 . . . . 0.0 110.288 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 174' ' ' ASP . . . . . 0.644 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.2 OUTLIER -94.58 -166.18 1.43 Allowed 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.512 1.133 . . . . 0.0 109.261 -179.898 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.91 5.64 6.2 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.529 1.143 . . . . 0.0 110.042 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -124.64 -5.31 7.59 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.444 1.09 . . . . 0.0 110.264 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.488 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 98.34 -7.48 61.94 Favored Glycine 0 CA--C 1.53 0.979 0 O-C-N 124.429 1.081 . . . . 0.0 110.99 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 178' ' ' LYS . . . . . 0.635 ' O ' HD11 ' A' ' 151' ' ' LEU . 5.4 mtmt -56.76 112.77 1.4 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.481 0.753 . . . . 0.0 109.322 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 179' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.1 OUTLIER -87.8 123.37 32.52 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.49 1.119 . . . . 0.0 110.322 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.604 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -155.46 -162.93 11.66 Favored Glycine 0 CA--C 1.531 1.072 0 O-C-N 124.514 1.134 . . . . 0.0 110.959 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 181' ' ' MET . . . . . 0.502 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.2 OUTLIER -88.25 130.65 35.04 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.606 0.827 . . . . 0.0 111.005 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.639 HD12 HD13 ' A' ' 159' ' ' LEU . 23.0 mm -126.92 131.83 24.05 Favored Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 124.53 1.144 . . . . 0.0 109.255 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 183' ' ' PRO . . . . . 0.751 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.3 Cg_endo -75.02 123.19 7.69 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.485 1.782 . . . . 0.0 110.944 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.827 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 14.0 t -71.93 -31.08 1.64 Allowed Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.496 1.123 . . . . 0.0 109.331 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 185' ' ' PRO . . . . . 0.827 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.96 -21.01 16.38 Favored 'Trans proline' 0 C--N 1.36 1.145 0 O-C-N 124.508 1.794 . . . . 0.0 111.057 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.685 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.9 m-85 -97.72 -21.47 16.97 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.481 1.113 . . . . 0.0 110.984 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 187' ' ' VAL . . . . . 0.751 HG13 ' O ' ' A' ' 183' ' ' PRO . 1.4 m -116.35 157.93 17.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.474 1.109 . . . . 0.0 109.371 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 188' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.2 OUTLIER -102.24 163.61 12.14 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.428 1.08 . . . . 0.0 110.331 179.968 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 189' ' ' LYS . . . . . 0.61 ' NZ ' HG22 ' A' ' 184' ' ' VAL . 0.0 OUTLIER -88.88 111.33 21.95 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.573 1.17 . . . . 0.0 109.3 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -96.4 -39.98 9.33 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.545 1.153 . . . . 0.0 111.006 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.947 0 O-C-N 124.489 1.118 . . . . 0.0 111.018 -179.976 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 27.0 p . . . . . 0 N--CA 1.452 -0.343 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 136' ' ' TYR . . . . . 0.576 ' CE1' ' HB2' ' A' ' 160' ' ' ARG . 12.7 m-85 -130.21 164.64 24.07 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.489 1.118 . . . . 0.0 111.044 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.756 HG21 ' CG2' ' A' ' 187' ' ' VAL . 0.5 OUTLIER -147.69 165.06 6.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.547 1.154 . . . . 0.0 109.274 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.5 ' N ' HG23 ' A' ' 137' ' ' VAL . 2.5 ttm180 -125.49 118.68 26.31 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.498 1.124 . . . . 0.0 110.324 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.475 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -84.03 113.33 20.94 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.493 1.121 . . . . 0.0 109.287 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.8 mt -87.14 20.28 2.78 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.565 1.165 . . . . 0.0 109.329 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.446 ' CD2' ' CD2' ' A' ' 186' ' ' TYR . 17.8 t80 -142.8 166.78 23.72 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 124.467 1.105 . . . . 0.0 110.958 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -106.78 154.7 20.61 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.484 1.115 . . . . 0.0 109.321 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.603 ' CE1' ' OD1' ' A' ' 150' ' ' ASP . 11.0 t80 -178.55 102.3 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.495 1.122 . . . . 0.0 111.037 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ASN . . . . . 0.401 ' HA ' ' HB3' ' A' ' 152' ' ' PRO . 10.8 p-10 -132.64 114.92 14.77 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.428 1.08 . . . . 0.0 109.302 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 129.05 79.36 0.23 Allowed Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.529 1.143 . . . . 0.0 111.008 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' ASN . . . . . 0.432 ' O ' ' N ' ' A' ' 148' ' ' GLU . 3.5 m-80 172.64 -72.41 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.461 0.742 . . . . 0.0 109.281 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ASP . . . . . 0.437 ' O ' ' N ' ' A' ' 150' ' ' ASP . 0.7 OUTLIER 62.73 -81.7 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.49 1.119 . . . . 0.0 109.303 179.995 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.432 ' N ' ' O ' ' A' ' 146' ' ' ASN . 0.3 OUTLIER -49.6 -24.8 2.35 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.515 1.134 . . . . 0.0 110.23 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 149' ' ' GLU . . . . . 0.431 ' O ' ' HB3' ' A' ' 150' ' ' ASP . 1.5 tt0 -93.27 -24.49 18.14 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.567 1.167 . . . . 0.0 110.294 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.603 ' OD1' ' CE1' ' A' ' 143' ' ' PHE . 2.2 p30 170.38 143.53 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.451 1.095 . . . . 0.0 109.286 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.504 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 13.0 tp -61.03 124.61 80.91 Favored Pre-proline 0 C--N 1.325 -0.463 0 O-C-N 124.508 1.13 . . . . 0.0 109.307 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 152' ' ' PRO . . . . . 0.452 ' CB ' ' O ' ' A' ' 143' ' ' PHE . 18.3 Cg_endo -74.92 169.53 22.41 Favored 'Trans proline' 0 C--N 1.36 1.151 0 O-C-N 124.558 1.82 . . . . 0.0 111.039 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.465 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 2.0 p90 -174.86 173.13 2.79 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.522 1.139 . . . . 0.0 110.99 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 154' ' ' LYS . . . . . 0.495 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -123.39 127.3 48.27 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.529 1.143 . . . . 0.0 109.301 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 155' ' ' LYS . . . . . 0.495 ' C ' ' O ' ' A' ' 154' ' ' LYS . 0.9 OUTLIER -32.58 107.51 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.544 0 O-C-N 124.542 1.151 . . . . 0.0 109.298 -179.975 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 99.79 39.5 3.36 Favored Glycine 0 CA--C 1.53 0.988 0 O-C-N 124.453 1.096 . . . . 0.0 110.975 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' ASP . . . . . 0.477 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 22.2 t70 -111.9 172.05 7.13 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.454 0.737 . . . . 0.0 109.32 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.742 HD13 ' O ' ' A' ' 137' ' ' VAL . 6.1 mm -123.64 149.31 27.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.502 1.126 . . . . 0.0 109.294 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.953 HD13 HG21 ' A' ' 182' ' ' ILE . 3.1 mt -145.86 140.07 26.78 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.456 1.098 . . . . 0.0 109.311 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.576 ' HB2' ' CE1' ' A' ' 136' ' ' TYR . 1.9 ttt180 -88.64 102.17 14.7 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.514 1.134 . . . . 0.0 110.302 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.998 HD12 ' HB2' ' A' ' 172' ' ' ALA . 0.1 OUTLIER -83.12 124.13 39.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.535 1.147 . . . . 0.0 109.287 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -118.91 -25.11 6.37 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.545 1.153 . . . . 0.0 110.335 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 163' ' ' ASP . . . . . 0.455 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 1.4 m-20 -131.74 157.77 42.92 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.53 1.144 . . . . 0.0 109.236 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.518 ' HB2' ' CG ' ' A' ' 170' ' ' TRP . 0.7 OUTLIER -165.13 65.29 1.1 Allowed Pre-proline 0 C--N 1.326 -0.432 0 O-C-N 124.497 1.123 . . . . 0.0 109.289 -179.956 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 6.46 3.37 Favored 'Trans proline' 0 C--N 1.359 1.131 0 O-C-N 124.473 1.775 . . . . 0.0 110.992 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 166' ' ' GLU . . . . . 0.446 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 6.5 mm-40 -131.21 171.04 13.76 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.457 1.098 . . . . 0.0 110.279 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 167' ' ' GLU . . . . . 0.518 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 2.5 mt-10 -112.56 48.07 1.03 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.448 1.092 . . . . 0.0 110.277 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.518 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 1.3 mt-30 173.64 -32.12 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.487 1.117 . . . . 0.0 110.281 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 169' ' ' TRP . . . . . 0.436 ' O ' ' HB2' ' A' ' 166' ' ' GLU . 76.3 m95 -123.27 103.26 8.41 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.524 1.14 . . . . 0.0 107.994 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 170' ' ' TRP . . . . . 0.972 ' HB2' HD11 ' A' ' 161' ' ' ILE . 30.0 m0 -108.68 169.68 8.51 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.48 1.112 . . . . 0.0 108.002 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.512 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -104.96 115.87 31.0 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.5 1.125 . . . . 0.0 109.236 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 172' ' ' ALA . . . . . 0.998 ' HB2' HD12 ' A' ' 161' ' ' ILE . . . -133.88 167.97 19.6 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.485 1.116 . . . . 0.0 109.307 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.538 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 4.0 mp0 -100.44 158.67 15.73 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.533 1.146 . . . . 0.0 110.297 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 174' ' ' ASP . . . . . 0.496 ' OD1' ' N ' ' A' ' 177' ' ' GLY . 44.2 p-10 -94.55 -161.25 0.84 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.574 1.171 . . . . 0.0 109.298 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.73 14.06 2.85 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.528 1.143 . . . . 0.0 109.97 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -133.47 -5.34 2.94 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.474 1.109 . . . . 0.0 110.297 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.51 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 99.85 -12.72 60.91 Favored Glycine 0 CA--C 1.531 1.039 0 O-C-N 124.477 1.111 . . . . 0.0 110.921 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 178' ' ' LYS . . . . . 0.433 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 2.8 mttm -53.78 112.75 0.99 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.506 0.768 . . . . 0.0 109.298 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 179' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -88.51 128.08 35.54 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.402 1.064 . . . . 0.0 110.356 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.512 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -152.73 -167.87 16.03 Favored Glycine 0 CA--C 1.529 0.966 0 O-C-N 124.454 1.096 . . . . 0.0 111.039 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -96.75 118.91 34.22 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.522 0.778 . . . . 0.0 111.06 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.953 HG21 HD13 ' A' ' 159' ' ' LEU . 4.8 pt -112.77 141.39 25.32 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.505 1.128 . . . . 0.0 109.333 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 183' ' ' PRO . . . . . 0.775 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.1 Cg_endo -75.01 126.74 10.16 Favored 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.48 1.779 . . . . 0.0 111.058 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.828 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 48.8 t -71.98 -30.61 1.52 Allowed Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.498 1.124 . . . . 0.0 109.248 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 185' ' ' PRO . . . . . 0.828 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.94 -26.69 10.81 Favored 'Trans proline' 0 C--N 1.36 1.16 0 O-C-N 124.459 1.768 . . . . 0.0 111.005 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.775 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 7.2 m-85 -98.76 2.46 46.95 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.451 1.094 . . . . 0.0 110.986 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 187' ' ' VAL . . . . . 0.756 ' CG2' HG21 ' A' ' 137' ' ' VAL . 2.0 m -140.02 160.25 26.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 124.453 1.096 . . . . 0.0 109.365 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 188' ' ' GLU . . . . . 0.412 ' O ' ' HB ' ' A' ' 137' ' ' VAL . 0.9 OUTLIER -111.45 149.08 31.79 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.544 1.152 . . . . 0.0 110.249 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.75 107.7 18.77 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.553 1.158 . . . . 0.0 109.274 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -102.55 -23.4 13.89 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.459 1.099 . . . . 0.0 111.067 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 191' ' ' GLY . . . . . 0.448 ' C ' ' H ' ' A' ' 136' ' ' TYR . . . . . . . . 0 CA--C 1.53 0.98 0 O-C-N 124.439 1.087 . . . . 0.0 111.01 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' CYS . . . . . 0.491 ' HB3' ' CE2' ' A' ' 136' ' ' TYR . 1.3 m . . . . . 0 N--CA 1.453 -0.313 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' TYR . . . . . 0.558 ' CE1' ' HD2' ' A' ' 160' ' ' ARG . 34.6 m-85 -150.58 177.62 9.86 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.514 1.134 . . . . 0.0 111.007 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.877 HG21 HD11 ' A' ' 182' ' ' ILE . 9.9 m -143.85 141.04 25.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.479 1.112 . . . . 0.0 109.302 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.633 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 14.0 ttp180 -99.65 112.28 24.52 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.551 1.157 . . . . 0.0 110.291 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.489 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -80.07 112.37 17.31 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.579 1.174 . . . . 0.0 109.309 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.65 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.1 OUTLIER -91.15 22.9 3.51 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.586 1.179 . . . . 0.0 109.312 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.486 ' CG ' ' CD2' ' A' ' 186' ' ' TYR . 55.3 m-85 -147.36 156.24 42.72 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.549 1.156 . . . . 0.0 110.926 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.67 128.59 45.0 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.582 1.176 . . . . 0.0 109.27 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.622 ' HB3' ' CZ ' ' A' ' 153' ' ' PHE . 0.8 OUTLIER -164.15 123.35 1.95 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.468 1.105 . . . . 0.0 111.011 179.972 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ASN . . . . . 0.463 ' HA ' ' HA ' ' A' ' 152' ' ' PRO . 0.9 OUTLIER -89.82 -58.11 2.63 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.527 1.142 . . . . 0.0 109.302 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 162.64 125.03 0.74 Allowed Glycine 0 CA--C 1.531 1.071 0 O-C-N 124.444 1.09 . . . . 0.0 110.974 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' ASN . . . . . 0.576 ' OD1' ' CZ ' ' A' ' 143' ' ' PHE . 41.4 p30 -178.2 36.86 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.567 0.804 . . . . 0.0 109.25 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -135.51 -72.58 0.46 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.491 1.119 . . . . 0.0 109.31 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -140.54 39.31 1.87 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.517 1.136 . . . . 0.0 110.312 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 74.49 20.61 2.46 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.467 1.104 . . . . 0.0 110.321 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.475 ' OD2' ' CD2' ' A' ' 143' ' ' PHE . 2.0 p-10 -45.27 163.44 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.404 1.065 . . . . 0.0 109.259 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.64 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 14.6 tp -80.9 132.6 56.79 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.554 1.159 . . . . 0.0 109.352 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 152' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 144' ' ' ASN . 18.2 Cg_endo -75.03 135.11 18.6 Favored 'Trans proline' 0 C--N 1.36 1.171 0 O-C-N 124.508 1.794 . . . . 0.0 111.04 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.622 ' CZ ' ' HB3' ' A' ' 143' ' ' PHE . 4.8 p90 -157.25 -178.59 7.47 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.469 1.105 . . . . 0.0 110.947 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.93 142.7 50.86 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.501 1.126 . . . . 0.0 109.273 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 4.7 ttpt -48.67 118.83 2.73 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.452 1.095 . . . . 0.0 109.29 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 91.82 42.99 4.6 Favored Glycine 0 CA--C 1.529 0.953 0 O-C-N 124.446 1.091 . . . . 0.0 110.981 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 157' ' ' ASP . . . . . 0.451 ' C ' HD12 ' A' ' 158' ' ' ILE . 17.8 t70 -121.91 171.11 9.16 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.468 0.746 . . . . 0.0 109.271 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.583 ' O ' HD23 ' A' ' 159' ' ' LEU . 2.8 mp -119.62 147.97 22.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.523 1.14 . . . . 0.0 109.279 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.906 HD12 HD13 ' A' ' 182' ' ' ILE . 3.4 mt -143.5 139.9 30.04 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.443 1.089 . . . . 0.0 109.237 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.558 ' HD2' ' CE1' ' A' ' 136' ' ' TYR . 8.3 ttt180 -84.59 101.37 12.06 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.564 1.165 . . . . 0.0 110.265 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.822 HD12 ' HB2' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -82.91 122.67 37.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 O-C-N 124.511 1.132 . . . . 0.0 109.244 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.24 -26.73 5.81 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.54 1.15 . . . . 0.0 110.293 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.14 154.17 39.0 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.537 1.148 . . . . 0.0 109.32 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.474 ' HB2' ' CE2' ' A' ' 170' ' ' TRP . 5.6 ptpp? -165.85 71.14 1.26 Allowed Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.544 1.152 . . . . 0.0 109.253 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.09 -38.38 1.57 Allowed 'Trans proline' 0 C--N 1.36 1.164 0 O-C-N 124.463 1.77 . . . . 0.0 110.946 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 166' ' ' GLU . . . . . 0.44 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.3 mt-10 -85.58 -177.65 6.47 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.492 1.12 . . . . 0.0 110.277 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -114.1 17.33 17.82 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.416 1.073 . . . . 0.0 110.233 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.453 ' O ' ' N ' ' A' ' 184' ' ' VAL . 33.5 mt-30 -152.13 -40.05 0.11 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.481 1.113 . . . . 0.0 110.288 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 169' ' ' TRP . . . . . 0.449 ' CZ3' ' HB3' ' A' ' 150' ' ' ASP . 73.9 m95 -107.54 111.18 23.33 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 170' ' ' TRP . . . . . 0.767 ' HB2' HD11 ' A' ' 161' ' ' ILE . 51.3 m0 -114.84 164.17 14.48 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.552 1.158 . . . . 0.0 108.063 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.411 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -102.57 121.76 43.02 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.546 1.153 . . . . 0.0 109.304 -179.967 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 172' ' ' ALA . . . . . 0.822 ' HB2' HD12 ' A' ' 161' ' ' ILE . . . -141.91 162.3 35.83 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.49 1.119 . . . . 0.0 109.312 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.519 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 2.2 mp0 -96.48 154.41 17.29 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.476 1.11 . . . . 0.0 110.246 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 174' ' ' ASP . . . . . 0.475 ' N ' HD21 ' A' ' 151' ' ' LEU . 0.2 OUTLIER -89.13 -162.01 0.82 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.485 1.116 . . . . 0.0 109.268 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 2.4 m -79.18 5.73 11.43 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.47 1.106 . . . . 0.0 109.973 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -123.8 -5.38 8.04 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.466 1.104 . . . . 0.0 110.327 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.501 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 97.48 -6.41 63.13 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.555 1.159 . . . . 0.0 110.969 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 178' ' ' LYS . . . . . 0.603 ' O ' HD11 ' A' ' 151' ' ' LEU . 0.9 OUTLIER -57.26 111.92 1.22 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.478 0.752 . . . . 0.0 109.292 -179.974 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 179' ' ' ARG . . . . . 0.434 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -87.02 125.57 34.18 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.46 1.1 . . . . 0.0 110.29 179.983 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.505 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -154.75 -173.97 24.2 Favored Glycine 0 CA--C 1.531 1.035 0 O-C-N 124.46 1.1 . . . . 0.0 110.98 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 181' ' ' MET . . . . . 0.45 ' O ' ' CB ' ' A' ' 150' ' ' ASP . 0.0 OUTLIER -96.67 128.06 43.25 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.526 0.78 . . . . 0.0 111.013 179.962 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.929 HD12 HG11 ' A' ' 187' ' ' VAL . 4.2 pt -128.38 156.65 76.56 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.448 1.093 . . . . 0.0 109.287 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 183' ' ' PRO . . . . . 0.807 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.1 Cg_endo -75.04 132.79 15.77 Favored 'Trans proline' 0 C--N 1.361 1.197 0 O-C-N 124.488 1.783 . . . . 0.0 111.003 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.825 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 39.2 t -78.38 -31.95 0.81 Allowed Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.525 1.141 . . . . 0.0 109.319 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 185' ' ' PRO . . . . . 0.825 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.99 -26.07 11.29 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.467 1.772 . . . . 0.0 110.983 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.779 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 2.9 m-85 -96.58 7.66 46.02 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.488 1.117 . . . . 0.0 110.958 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 187' ' ' VAL . . . . . 0.929 HG11 HD12 ' A' ' 182' ' ' ILE . 3.5 m -135.98 151.98 29.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 O-C-N 124.417 1.073 . . . . 0.0 109.322 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 188' ' ' GLU . . . . . 0.558 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 39.4 tt0 -101.85 153.25 20.0 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.499 1.124 . . . . 0.0 110.264 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 2.3 ptmm? -89.58 111.06 21.89 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.524 1.14 . . . . 0.0 109.272 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -154.56 104.94 2.59 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.444 1.09 . . . . 0.0 111.0 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.967 0 O-C-N 124.494 1.121 . . . . 0.0 111.009 -179.98 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 135' ' ' CYS . . . . . 0.414 ' O ' ' HG3' ' A' ' 160' ' ' ARG . 3.6 m . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -150.93 163.35 38.9 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.526 1.141 . . . . 0.0 111.044 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.615 HG22 ' O ' ' A' ' 159' ' ' LEU . 13.5 m -144.58 136.21 21.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.517 1.136 . . . . 0.0 109.296 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.527 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 6.6 ttp180 -103.27 110.9 23.05 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.474 1.108 . . . . 0.0 110.299 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.543 ' HB1' ' CD1' ' A' ' 153' ' ' PHE . . . -81.37 104.64 11.96 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.451 1.095 . . . . 0.0 109.334 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.413 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 1.7 mt -89.59 22.93 2.8 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.503 1.127 . . . . 0.0 109.218 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -140.52 149.7 42.79 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.5 1.125 . . . . 0.0 111.014 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.17 128.92 34.97 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.49 1.119 . . . . 0.0 109.312 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.598 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.4 OUTLIER -143.36 138.63 29.57 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.572 1.17 . . . . 0.0 111.007 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ASN . . . . . 0.456 ' C ' ' HB3' ' A' ' 152' ' ' PRO . 2.3 t-20 -115.95 -32.73 5.32 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.463 1.102 . . . . 0.0 109.347 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 158.71 127.18 0.91 Allowed Glycine 0 CA--C 1.531 1.059 0 O-C-N 124.529 1.143 . . . . 0.0 111.011 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' ASN . . . . . 0.514 ' O ' ' ND2' ' A' ' 146' ' ' ASN . 0.2 OUTLIER -135.98 6.73 3.15 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.565 0.803 . . . . 0.0 109.292 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ASP . . . . . 0.534 ' O ' ' CB ' ' A' ' 148' ' ' GLU . 0.2 OUTLIER -133.87 -18.82 2.08 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.53 1.144 . . . . 0.0 109.234 -179.989 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.534 ' CB ' ' O ' ' A' ' 147' ' ' ASP . 1.2 pt-20 88.84 -22.56 0.12 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.42 1.075 . . . . 0.0 110.305 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -125.61 4.89 7.52 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.515 1.135 . . . . 0.0 110.374 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.416 ' HB2' ' O ' ' A' ' 181' ' ' MET . 17.1 p-10 -79.27 159.68 27.16 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 124.437 1.086 . . . . 0.0 109.248 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.633 HD21 ' O ' ' A' ' 178' ' ' LYS . 6.4 tp -91.96 113.75 59.95 Favored Pre-proline 0 C--N 1.326 -0.423 0 O-C-N 124.441 1.088 . . . . 0.0 109.309 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' PRO . . . . . 0.456 ' HB3' ' C ' ' A' ' 144' ' ' ASN . 18.3 Cg_endo -74.99 171.28 18.63 Favored 'Trans proline' 0 C--N 1.36 1.138 0 O-C-N 124.465 1.771 . . . . 0.0 111.04 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.598 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 8.7 p90 -174.08 178.88 2.02 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.433 1.083 . . . . 0.0 111.008 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.62 135.94 54.16 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.53 1.144 . . . . 0.0 109.31 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 155' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.3 OUTLIER -42.9 108.07 0.1 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.523 1.139 . . . . 0.0 109.358 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 105.7 34.23 3.35 Favored Glycine 0 CA--C 1.529 0.946 0 O-C-N 124.448 1.093 . . . . 0.0 111.018 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' ASP . . . . . 0.417 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 17.5 t0 -109.97 176.58 5.01 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.49 0.759 . . . . 0.0 109.308 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.467 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 51.7 mt -131.67 148.25 32.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.483 1.114 . . . . 0.0 109.288 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.926 HD13 HG21 ' A' ' 182' ' ' ILE . 2.3 mt -145.01 139.94 27.81 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.512 1.133 . . . . 0.0 109.409 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.544 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 14.0 ttt-85 -86.19 97.12 10.18 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.465 1.103 . . . . 0.0 110.311 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.54 HD11 ' HB3' ' A' ' 164' ' ' LYS . 0.0 OUTLIER -82.98 120.66 34.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.512 1.133 . . . . 0.0 109.284 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.11 -22.71 7.67 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.442 1.089 . . . . 0.0 110.373 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -122.05 137.4 54.82 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.458 1.098 . . . . 0.0 109.276 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.54 ' HB3' HD11 ' A' ' 161' ' ' ILE . 0.0 OUTLIER -147.92 66.95 9.92 Favored Pre-proline 0 C--N 1.325 -0.459 0 O-C-N 124.455 1.097 . . . . 0.0 109.292 179.967 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.0 -38.48 1.57 Allowed 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.523 1.801 . . . . 0.0 111.036 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' GLU . . . . . 0.469 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 8.8 mm-40 -88.08 176.21 7.39 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.469 1.106 . . . . 0.0 110.324 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 167' ' ' GLU . . . . . 0.443 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 6.7 pt-20 -113.99 47.71 1.17 Allowed 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.524 1.14 . . . . 0.0 110.229 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.443 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 0.2 OUTLIER 174.41 -33.84 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.545 1.153 . . . . 0.0 110.351 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 169' ' ' TRP . . . . . 0.469 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 74.5 m95 -117.07 105.32 12.15 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 170' ' ' TRP . . . . . 0.748 ' O ' HD13 ' A' ' 182' ' ' ILE . 52.8 m0 -110.27 163.52 13.56 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.481 1.113 . . . . 0.0 107.997 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.582 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -101.78 119.32 38.6 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.394 1.059 . . . . 0.0 109.287 179.985 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 172' ' ' ALA . . . . . 0.605 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -136.78 167.52 21.29 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.53 1.144 . . . . 0.0 109.292 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.722 ' HG3' ' HA2' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -98.32 159.4 14.97 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.475 1.109 . . . . 0.0 110.301 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 174' ' ' ASP . . . . . 0.678 ' N ' ' HG2' ' A' ' 173' ' ' GLU . 42.8 p-10 -95.85 -157.03 0.55 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.581 1.176 . . . . 0.0 109.309 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 38.3 t -85.66 14.38 5.83 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.567 1.167 . . . . 0.0 110.09 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -136.78 -1.96 2.18 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.546 1.154 . . . . 0.0 110.334 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.722 ' HA2' ' HG3' ' A' ' 173' ' ' GLU . . . 100.03 -17.53 57.03 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 124.531 1.145 . . . . 0.0 111.113 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 178' ' ' LYS . . . . . 0.633 ' O ' HD21 ' A' ' 151' ' ' LEU . 5.3 mttm -49.62 108.28 0.19 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.584 0.814 . . . . 0.0 109.299 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 33.4 mtm180 -90.75 127.04 36.19 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.457 1.098 . . . . 0.0 110.305 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.582 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -149.92 -164.13 11.57 Favored Glycine 0 CA--C 1.53 1.012 0 O-C-N 124.488 1.117 . . . . 0.0 110.978 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 181' ' ' MET . . . . . 0.469 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -100.69 126.81 47.24 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.533 0.784 . . . . 0.0 111.021 -179.979 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.926 HG21 HD13 ' A' ' 159' ' ' LEU . 0.2 OUTLIER -126.43 150.87 71.64 Favored Pre-proline 0 C--N 1.324 -0.506 0 O-C-N 124.554 1.159 . . . . 0.0 109.324 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 183' ' ' PRO . . . . . 0.756 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.1 Cg_endo -75.1 131.34 14.07 Favored 'Trans proline' 0 C--N 1.361 1.194 0 O-C-N 124.496 1.787 . . . . 0.0 111.006 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.839 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 55.3 t -76.18 -31.21 0.96 Allowed Pre-proline 0 C--N 1.325 -0.482 0 O-C-N 124.418 1.074 . . . . 0.0 109.287 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 185' ' ' PRO . . . . . 0.839 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.95 -24.13 13.23 Favored 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.553 1.817 . . . . 0.0 111.005 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.756 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.6 m-85 -96.27 -5.02 41.2 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.463 1.102 . . . . 0.0 110.989 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 187' ' ' VAL . . . . . 0.752 HG13 ' O ' ' A' ' 183' ' ' PRO . 2.9 m -127.73 153.72 37.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.484 1.115 . . . . 0.0 109.259 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 188' ' ' GLU . . . . . 0.585 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 4.6 pt-20 -105.78 155.59 19.14 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.509 1.13 . . . . 0.0 110.287 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.25 110.0 19.89 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.483 1.114 . . . . 0.0 109.332 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -96.42 -64.7 1.02 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.471 1.107 . . . . 0.0 111.046 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.039 0 O-C-N 124.51 1.131 . . . . 0.0 110.98 -179.985 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 135' ' ' CYS . . . . . 0.652 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 1.5 p . . . . . 0 N--CA 1.452 -0.335 0 N-CA-C 108.361 -0.978 . . . . 0.0 108.361 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' TYR . . . . . 0.652 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 0.0 OUTLIER -151.12 177.4 10.23 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.469 1.106 . . . . 0.0 110.999 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.607 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 28.5 m -142.48 155.24 18.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 O-C-N 124.586 1.179 . . . . 0.0 109.289 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.479 ' HA ' ' O ' ' A' ' 157' ' ' ASP . 0.2 OUTLIER -107.84 114.35 28.23 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.466 1.104 . . . . 0.0 110.248 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.523 ' O ' ' N ' ' A' ' 156' ' ' GLY . . . -80.63 110.23 15.91 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.422 1.076 . . . . 0.0 109.263 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.411 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 4.3 mt -88.5 23.79 2.13 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.547 1.154 . . . . 0.0 109.236 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.404 ' O ' ' N ' ' A' ' 155' ' ' LYS . 23.8 t80 -140.58 168.83 18.87 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 124.485 1.116 . . . . 0.0 110.994 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -109.14 122.79 48.06 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.54 1.15 . . . . 0.0 109.325 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.557 ' O ' ' HA ' ' A' ' 152' ' ' PRO . 4.4 t80 -152.84 97.65 2.24 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.508 1.13 . . . . 0.0 111.004 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ASN . . . . . 0.456 ' ND2' ' O ' ' A' ' 153' ' ' PHE . 9.7 m-80 -131.71 114.75 15.14 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.503 1.127 . . . . 0.0 109.303 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 81.75 103.7 0.38 Allowed Glycine 0 CA--C 1.53 1.009 0 O-C-N 124.442 1.089 . . . . 0.0 110.999 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' ASN . . . . . 0.447 ' OD1' ' CZ ' ' A' ' 143' ' ' PHE . 0.4 OUTLIER -151.65 -56.04 0.14 Allowed 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.517 0.775 . . . . 0.0 109.312 179.985 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ASP . . . . . 0.414 ' OD1' ' ND2' ' A' ' 146' ' ' ASN . 0.0 OUTLIER -149.69 160.35 43.6 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.543 1.152 . . . . 0.0 109.292 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -79.48 40.37 0.43 Allowed 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.465 1.103 . . . . 0.0 110.273 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' GLU . . . . . 0.413 ' H ' ' C ' ' A' ' 147' ' ' ASP . 8.2 pt-20 -146.76 -31.05 0.35 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.532 1.145 . . . . 0.0 110.33 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.426 ' OD2' ' CE2' ' A' ' 143' ' ' PHE . 9.6 p-10 -85.25 151.08 24.34 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.44 1.087 . . . . 0.0 109.299 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.684 ' HB3' HG23 ' A' ' 182' ' ' ILE . 13.7 tp -96.04 128.34 37.54 Favored Pre-proline 0 C--N 1.324 -0.506 0 O-C-N 124.459 1.099 . . . . 0.0 109.318 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 152' ' ' PRO . . . . . 0.557 ' HA ' ' O ' ' A' ' 143' ' ' PHE . 18.3 Cg_endo -74.96 142.14 27.61 Favored 'Trans proline' 0 C--N 1.359 1.13 0 O-C-N 124.531 1.806 . . . . 0.0 111.048 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.475 ' CZ ' ' HB3' ' A' ' 143' ' ' PHE . 7.5 p90 -164.92 -180.0 6.12 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.505 1.128 . . . . 0.0 111.036 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 154' ' ' LYS . . . . . 0.423 ' O ' ' C ' ' A' ' 155' ' ' LYS . 1.8 ttmt -135.76 144.17 45.67 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.489 1.118 . . . . 0.0 109.277 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 155' ' ' LYS . . . . . 0.423 ' C ' ' O ' ' A' ' 154' ' ' LYS . 2.8 tmpt? -38.32 135.49 0.74 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.473 1.108 . . . . 0.0 109.331 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 76.63 31.69 53.17 Favored Glycine 0 CA--C 1.529 0.912 0 O-C-N 124.433 1.083 . . . . 0.0 111.029 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 157' ' ' ASP . . . . . 0.479 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 6.6 t70 -105.47 165.99 10.75 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.48 0.753 . . . . 0.0 109.293 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.488 ' C ' ' HG ' ' A' ' 159' ' ' LEU . 18.7 mm -121.32 147.6 25.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.51 1.131 . . . . 0.0 109.328 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.856 HD13 HG21 ' A' ' 182' ' ' ILE . 0.6 OUTLIER -145.48 133.85 21.84 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.469 1.105 . . . . 0.0 109.33 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.477 ' HB3' ' HB2' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -87.62 105.08 17.1 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.575 1.172 . . . . 0.0 110.328 -179.983 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.565 HD13 ' C ' ' A' ' 161' ' ' ILE . 0.0 OUTLIER -83.47 129.23 37.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.567 1.167 . . . . 0.0 109.289 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 162' ' ' ARG . . . . . 0.431 ' HB3' ' OD1' ' A' ' 163' ' ' ASP . 4.7 ttt-85 -124.05 -22.11 4.9 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.513 1.133 . . . . 0.0 110.257 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 163' ' ' ASP . . . . . 0.59 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -138.26 158.3 44.56 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.489 1.118 . . . . 0.0 109.245 -179.952 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.552 ' HB2' ' CG ' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -155.19 76.14 5.2 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.466 1.103 . . . . 0.0 109.303 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.03 -1.17 10.88 Favored 'Trans proline' 0 C--N 1.361 1.213 0 O-C-N 124.534 1.808 . . . . 0.0 110.999 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 166' ' ' GLU . . . . . 0.481 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.1 mt-10 -128.03 171.9 11.44 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.492 1.12 . . . . 0.0 110.301 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -100.24 14.99 29.06 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.53 1.144 . . . . 0.0 110.261 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.444 ' O ' ' N ' ' A' ' 184' ' ' VAL . 8.6 mt-30 -155.31 -45.73 0.08 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.449 1.093 . . . . 0.0 110.291 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 169' ' ' TRP . . . . . 0.448 ' O ' ' HE1' ' A' ' 181' ' ' MET . 91.1 m95 -98.32 103.17 15.09 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 170' ' ' TRP . . . . . 0.7 ' CD2' HG21 ' A' ' 184' ' ' VAL . 36.0 m0 -107.91 154.7 21.22 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.977 -1.119 . . . . 0.0 107.977 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 1.2 t-20 -88.05 116.17 26.04 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.514 1.134 . . . . 0.0 109.294 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 172' ' ' ALA . . . . . 0.62 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -137.37 160.24 39.64 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.511 1.132 . . . . 0.0 109.216 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.576 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 2.6 mp0 -89.17 156.31 18.87 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.496 1.123 . . . . 0.0 110.279 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 174' ' ' ASP . . . . . 0.571 ' N ' HD21 ' A' ' 151' ' ' LEU . 0.4 OUTLIER -90.73 -162.07 0.87 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.478 1.111 . . . . 0.0 109.343 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 4.1 m -80.74 9.54 6.12 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.549 1.156 . . . . 0.0 109.996 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -132.04 -5.97 3.5 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.523 1.14 . . . . 0.0 110.338 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.502 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 103.69 -10.4 52.88 Favored Glycine 0 CA--C 1.53 0.979 0 O-C-N 124.557 1.161 . . . . 0.0 111.011 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 178' ' ' LYS . . . . . 0.578 ' O ' HD11 ' A' ' 151' ' ' LEU . 1.2 mttt -53.89 114.19 1.49 Allowed 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.478 0.752 . . . . 0.0 109.319 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 179' ' ' ARG . . . . . 0.557 ' CG ' ' CD ' ' A' ' 173' ' ' GLU . 5.6 mtm105 -88.07 126.58 35.18 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.48 1.113 . . . . 0.0 110.281 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.501 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -155.53 -172.42 23.09 Favored Glycine 0 CA--C 1.53 0.999 0 O-C-N 124.53 1.144 . . . . 0.0 111.043 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 181' ' ' MET . . . . . 0.448 ' HE1' ' O ' ' A' ' 169' ' ' TRP . 84.5 mmm -99.94 117.87 35.16 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.506 0.768 . . . . 0.0 111.009 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.856 HG21 HD13 ' A' ' 159' ' ' LEU . 1.1 pt -117.96 151.28 48.68 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.494 1.121 . . . . 0.0 109.337 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 183' ' ' PRO . . . . . 0.778 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -74.9 131.02 13.94 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.58 1.832 . . . . 0.0 110.987 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.84 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 4.0 t -76.76 -30.72 0.85 Allowed Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.522 1.139 . . . . 0.0 109.251 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 185' ' ' PRO . . . . . 0.84 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -75.03 -22.42 14.78 Favored 'Trans proline' 0 C--N 1.36 1.137 0 O-C-N 124.503 1.791 . . . . 0.0 111.013 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.778 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 11.6 m-85 -97.67 -4.89 36.47 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.443 1.089 . . . . 0.0 111.007 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 187' ' ' VAL . . . . . 0.641 HG22 ' HA ' ' A' ' 184' ' ' VAL . 4.0 m -127.3 151.31 33.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.556 1.16 . . . . 0.0 109.343 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 188' ' ' GLU . . . . . 0.607 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 2.4 mt-10 -101.84 144.42 30.52 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.468 1.105 . . . . 0.0 110.278 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 189' ' ' LYS . . . . . 0.557 ' HA ' HG12 ' A' ' 137' ' ' VAL . 0.0 OUTLIER -87.24 109.0 19.19 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.541 1.151 . . . . 0.0 109.27 179.977 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 190' ' ' TYR . . . . . 0.6 ' HB3' ' CD1' ' A' ' 136' ' ' TYR . 2.2 t80 -100.54 -25.92 14.02 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.51 1.131 . . . . 0.0 111.002 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 191' ' ' GLY . . . . . 0.623 ' O ' ' CE1' ' A' ' 136' ' ' TYR . . . . . . . . 0 CA--C 1.53 1.007 0 O-C-N 124.41 1.069 . . . . 0.0 111.018 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' CYS . . . . . 0.409 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 7.5 p . . . . . 0 N--CA 1.452 -0.35 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' TYR . . . . . 0.409 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 10.5 m-85 -150.88 167.17 28.34 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.463 1.102 . . . . 0.0 111.017 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.577 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 6.2 m -142.38 133.29 24.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.522 1.139 . . . . 0.0 109.306 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.524 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 23.6 ttp85 -101.57 110.18 22.12 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.509 1.131 . . . . 0.0 110.329 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.469 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -81.46 109.27 15.77 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.465 1.103 . . . . 0.0 109.317 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.502 HD12 ' O ' ' A' ' 138' ' ' ARG . 5.2 mp -89.44 23.3 2.61 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.526 1.141 . . . . 0.0 109.347 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -140.95 165.32 27.85 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.457 1.098 . . . . 0.0 110.972 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.81 127.52 53.15 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.518 1.136 . . . . 0.0 109.286 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.644 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 64.2 t80 -140.3 131.18 26.01 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.479 1.112 . . . . 0.0 110.968 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -138.88 126.73 22.23 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.56 1.163 . . . . 0.0 109.295 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' GLY . . . . . 0.458 ' O ' ' ND2' ' A' ' 146' ' ' ASN . . . -146.81 -131.61 2.22 Favored Glycine 0 CA--C 1.529 0.942 0 O-C-N 124.457 1.098 . . . . 0.0 111.006 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 146' ' ' ASN . . . . . 0.458 ' ND2' ' O ' ' A' ' 145' ' ' GLY . 3.9 p30 160.48 74.85 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.399 0.705 . . . . 0.0 109.316 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ASP . . . . . 0.492 ' C ' ' H ' ' A' ' 149' ' ' GLU . 9.9 t70 -144.53 154.92 43.39 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.473 1.108 . . . . 0.0 109.305 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -77.65 25.19 0.2 Allowed 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.541 1.151 . . . . 0.0 110.332 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' GLU . . . . . 0.492 ' H ' ' C ' ' A' ' 147' ' ' ASP . 4.5 mt-10 -153.64 18.71 0.53 Allowed 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.469 1.106 . . . . 0.0 110.328 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.468 ' OD2' ' CB ' ' A' ' 147' ' ' ASP . 24.4 p30 -139.38 153.49 47.67 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.445 1.091 . . . . 0.0 109.239 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.732 ' HB3' HG23 ' A' ' 182' ' ' ILE . 13.8 tp -131.26 112.22 15.56 Favored Pre-proline 0 C--N 1.326 -0.451 0 O-C-N 124.449 1.093 . . . . 0.0 109.262 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.04 154.62 42.43 Favored 'Trans proline' 0 C--N 1.359 1.125 0 O-C-N 124.506 1.793 . . . . 0.0 111.062 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.644 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 4.8 p90 -164.69 -177.55 4.83 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.555 1.16 . . . . 0.0 111.043 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.43 138.44 51.46 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.538 1.149 . . . . 0.0 109.253 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 155' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -45.97 117.67 1.6 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.474 1.109 . . . . 0.0 109.283 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 96.48 35.42 5.45 Favored Glycine 0 CA--C 1.529 0.939 0 O-C-N 124.517 1.135 . . . . 0.0 110.985 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -113.86 173.23 6.53 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.508 0.769 . . . . 0.0 109.298 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.456 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 24.1 mt -127.62 149.85 32.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.43 1.081 . . . . 0.0 109.328 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.875 HD13 HG21 ' A' ' 182' ' ' ILE . 0.2 OUTLIER -143.33 139.46 30.1 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.563 1.164 . . . . 0.0 109.283 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.488 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 8.4 ttp180 -87.51 107.06 18.4 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.504 1.127 . . . . 0.0 110.324 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.845 HD12 ' O ' ' A' ' 171' ' ' ASN . 10.6 tp -84.45 128.17 39.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.445 1.091 . . . . 0.0 109.325 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.9 ttt180 -128.32 -24.29 3.12 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.506 1.129 . . . . 0.0 110.313 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -127.07 151.93 47.96 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.515 1.134 . . . . 0.0 109.244 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.547 ' HG3' ' CE2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -147.67 80.25 9.07 Favored Pre-proline 0 C--N 1.326 -0.455 0 O-C-N 124.48 1.112 . . . . 0.0 109.289 179.998 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 -45.91 0.26 Allowed 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.499 1.789 . . . . 0.0 110.99 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' GLU . . . . . . . . . . . . . 62.6 mm-40 -93.11 -173.2 3.19 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.484 1.115 . . . . 0.0 110.305 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -108.16 -11.39 15.27 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.471 1.107 . . . . 0.0 110.261 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -123.64 -32.52 3.33 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.533 1.146 . . . . 0.0 110.306 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -110.51 112.93 25.17 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.562 1.164 . . . . 0.0 107.977 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 170' ' ' TRP . . . . . 0.858 ' CE2' HG21 ' A' ' 184' ' ' VAL . 45.9 m0 -112.69 159.35 19.0 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.527 1.142 . . . . 0.0 107.992 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.845 ' O ' HD12 ' A' ' 161' ' ' ILE . 1.5 t30 -94.65 115.16 27.21 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.507 1.129 . . . . 0.0 109.3 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 172' ' ' ALA . . . . . 0.768 ' HB3' ' CD1' ' A' ' 182' ' ' ILE . . . -136.58 164.86 27.21 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.521 1.138 . . . . 0.0 109.292 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.615 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 6.5 mp0 -97.77 153.85 18.0 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.518 1.136 . . . . 0.0 110.295 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 174' ' ' ASP . . . . . 0.45 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.4 OUTLIER -85.97 -161.5 0.64 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.541 1.15 . . . . 0.0 109.305 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 1.5 t -81.27 11.93 3.94 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.505 1.128 . . . . 0.0 110.057 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -133.56 -4.53 2.93 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.505 1.128 . . . . 0.0 110.226 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.537 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 103.63 -15.3 53.11 Favored Glycine 0 CA--C 1.531 1.07 0 O-C-N 124.504 1.128 . . . . 0.0 110.994 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 178' ' ' LYS . . . . . 0.45 ' O ' HD11 ' A' ' 151' ' ' LEU . 2.2 mtpt -46.74 109.04 0.16 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.595 0.82 . . . . 0.0 109.358 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 179' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -89.21 123.5 33.5 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.533 1.146 . . . . 0.0 110.281 -179.946 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.502 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.57 -164.08 12.57 Favored Glycine 0 CA--C 1.53 0.982 0 O-C-N 124.5 1.125 . . . . 0.0 111.0 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 181' ' ' MET . . . . . 0.403 ' HB2' ' O ' ' A' ' 149' ' ' GLU . 1.0 OUTLIER -103.18 123.83 47.45 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.521 0.777 . . . . 0.0 111.002 179.971 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.875 HG21 HD13 ' A' ' 159' ' ' LEU . 0.1 OUTLIER -122.7 152.19 61.66 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.506 1.129 . . . . 0.0 109.315 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 183' ' ' PRO . . . . . 0.743 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.01 129.82 12.69 Favored 'Trans proline' 0 C--N 1.358 1.065 0 O-C-N 124.571 1.827 . . . . 0.0 110.95 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.858 HG21 ' CE2' ' A' ' 170' ' ' TRP . 3.6 t -76.29 -32.24 1.07 Allowed Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.407 1.067 . . . . 0.0 109.203 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 185' ' ' PRO . . . . . 0.822 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -75.1 -24.19 12.9 Favored 'Trans proline' 0 C--N 1.359 1.095 0 O-C-N 124.519 1.8 . . . . 0.0 111.012 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.743 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 9.1 m-85 -96.54 -1.41 47.16 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.53 1.144 . . . . 0.0 111.057 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 187' ' ' VAL . . . . . 0.737 HG22 ' O ' ' A' ' 183' ' ' PRO . 9.4 m -128.57 152.36 36.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 O-C-N 124.575 1.172 . . . . 0.0 109.313 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 188' ' ' GLU . . . . . 0.577 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 2.2 tt0 -97.8 151.76 19.86 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.421 1.076 . . . . 0.0 110.404 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.47 106.22 17.83 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.552 1.157 . . . . 0.0 109.305 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -85.36 -52.18 6.05 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.494 1.121 . . . . 0.0 110.992 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.005 0 O-C-N 124.565 1.166 . . . . 0.0 111.003 179.975 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 135' ' ' CYS . . . . . 0.437 ' O ' ' HG2' ' A' ' 160' ' ' ARG . 67.7 m . . . . . 0 N--CA 1.453 -0.318 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' TYR . . . . . 0.413 ' N ' ' C ' ' A' ' 191' ' ' GLY . 41.5 m-85 -156.35 167.0 31.78 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.509 1.131 . . . . 0.0 110.937 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.529 HG23 ' N ' ' A' ' 138' ' ' ARG . 0.5 OUTLIER -148.67 167.17 3.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.511 1.132 . . . . 0.0 109.282 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.529 ' N ' HG23 ' A' ' 137' ' ' VAL . 0.1 OUTLIER -128.41 117.03 20.67 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.47 1.106 . . . . 0.0 110.282 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -84.78 109.78 18.32 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.443 1.089 . . . . 0.0 109.304 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.402 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 1.4 mt -89.47 26.12 1.78 Allowed 'General case' 0 C--N 1.323 -0.55 0 O-C-N 124.544 1.153 . . . . 0.0 109.284 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.503 ' CD2' ' CD2' ' A' ' 186' ' ' TYR . 41.1 m-85 -144.3 150.43 37.86 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.489 1.118 . . . . 0.0 111.007 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -94.14 127.02 39.71 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.483 1.114 . . . . 0.0 109.286 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.592 ' CB ' ' CE1' ' A' ' 153' ' ' PHE . 5.0 t80 -142.81 130.66 21.61 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.41 1.069 . . . . 0.0 110.962 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -139.14 88.04 2.25 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.456 1.098 . . . . 0.0 109.329 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' GLY . . . . . 0.507 ' O ' ' CB ' ' A' ' 146' ' ' ASN . . . -116.19 -130.92 4.68 Favored Glycine 0 CA--C 1.53 1.024 0 O-C-N 124.468 1.105 . . . . 0.0 110.987 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 146' ' ' ASN . . . . . 0.507 ' CB ' ' O ' ' A' ' 145' ' ' GLY . 4.6 m-20 154.12 82.89 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.482 0.754 . . . . 0.0 109.274 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -132.98 163.31 29.48 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.481 1.113 . . . . 0.0 109.326 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -62.89 -13.26 32.07 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.502 1.126 . . . . 0.0 110.241 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' GLU . . . . . 0.426 ' O ' ' HB2' ' A' ' 181' ' ' MET . 17.4 mt-10 -141.27 49.09 1.65 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.564 1.165 . . . . 0.0 110.314 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.408 ' OD1' ' CZ ' ' A' ' 143' ' ' PHE . 1.4 t0 -147.07 149.69 33.56 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.439 1.087 . . . . 0.0 109.277 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.672 HD22 ' O ' ' A' ' 172' ' ' ALA . 14.8 tp -134.44 118.2 13.62 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.522 1.139 . . . . 0.0 109.29 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.11 162.63 36.55 Favored 'Trans proline' 0 C--N 1.36 1.138 0 O-C-N 124.54 1.81 . . . . 0.0 110.98 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.592 ' CE1' ' CB ' ' A' ' 143' ' ' PHE . 8.2 p90 -175.48 178.89 1.55 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.513 1.133 . . . . 0.0 111.003 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 154' ' ' LYS . . . . . 0.426 ' HD3' ' N ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -123.29 143.71 49.89 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.602 1.189 . . . . 0.0 109.242 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 155' ' ' LYS . . . . . 0.426 ' N ' ' HD3' ' A' ' 154' ' ' LYS . 2.6 ttpt -53.72 114.23 1.48 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.44 1.088 . . . . 0.0 109.256 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 99.35 30.01 6.81 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.488 1.117 . . . . 0.0 111.035 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' ASP . . . . . 0.439 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 12.4 t70 -107.3 174.41 5.9 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.451 0.736 . . . . 0.0 109.365 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.525 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 32.7 mt -121.32 155.95 25.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 O-C-N 124.482 1.114 . . . . 0.0 109.308 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.728 HD13 HG21 ' A' ' 182' ' ' ILE . 3.2 mt -144.76 148.35 34.01 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.475 1.11 . . . . 0.0 109.289 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.53 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.3 OUTLIER -99.63 107.86 20.1 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.482 1.114 . . . . 0.0 110.291 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.686 HG12 ' HB2' ' A' ' 172' ' ' ALA . 1.6 mm -79.83 130.5 35.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.468 1.105 . . . . 0.0 109.292 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.6 ttt-85 -128.23 -25.5 2.97 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.494 1.121 . . . . 0.0 110.309 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -141.73 158.15 44.17 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.504 1.128 . . . . 0.0 109.285 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.558 ' HB3' ' CD1' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -142.4 77.58 17.34 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.554 1.158 . . . . 0.0 109.277 179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 -2.71 12.89 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.454 1.765 . . . . 0.0 110.981 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 169' ' ' TRP . 11.9 mt-10 -144.6 -171.76 3.67 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.503 1.127 . . . . 0.0 110.359 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -113.38 -16.84 12.4 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.466 1.104 . . . . 0.0 110.275 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.408 ' N ' ' CD ' ' A' ' 168' ' ' GLN . 4.0 mp0 -116.88 -24.59 7.58 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.491 1.12 . . . . 0.0 110.247 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 169' ' ' TRP . . . . . 0.443 ' O ' ' HE1' ' A' ' 181' ' ' MET . 85.9 m95 -125.37 105.58 9.2 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.551 1.157 . . . . 0.0 107.959 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 170' ' ' TRP . . . . . 0.567 ' CE3' HG22 ' A' ' 184' ' ' VAL . 34.4 m0 -103.19 164.36 11.68 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.503 1.127 . . . . 0.0 107.997 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.438 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.8 OUTLIER -99.39 97.48 8.52 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.448 1.092 . . . . 0.0 109.26 -179.949 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 172' ' ' ALA . . . . . 0.686 ' HB2' HG12 ' A' ' 161' ' ' ILE . . . -124.39 166.87 15.21 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.468 1.105 . . . . 0.0 109.302 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.528 ' CG ' ' O ' ' A' ' 177' ' ' GLY . 0.8 OUTLIER -96.07 159.17 15.1 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.468 1.105 . . . . 0.0 110.298 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 174' ' ' ASP . . . . . 0.576 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.4 OUTLIER -90.28 -160.39 0.69 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.464 1.102 . . . . 0.0 109.249 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 2.5 m -81.24 8.35 9.19 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.505 1.128 . . . . 0.0 109.985 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -128.08 -5.61 5.54 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.491 1.119 . . . . 0.0 110.341 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.528 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 101.06 -9.47 58.02 Favored Glycine 0 CA--C 1.53 0.994 0 O-C-N 124.472 1.108 . . . . 0.0 111.023 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 178' ' ' LYS . . . . . 0.468 ' O ' HD11 ' A' ' 151' ' ' LEU . 4.7 mtmt -53.74 111.8 0.8 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.469 0.746 . . . . 0.0 109.3 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 179' ' ' ARG . . . . . 0.444 ' CG ' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.61 122.31 30.35 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.476 1.11 . . . . 0.0 110.238 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.438 ' HA3' ' HB2' ' A' ' 151' ' ' LEU . . . -155.33 -164.98 13.63 Favored Glycine 0 CA--C 1.529 0.93 0 O-C-N 124.478 1.111 . . . . 0.0 111.023 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 181' ' ' MET . . . . . 0.443 ' HE1' ' O ' ' A' ' 169' ' ' TRP . 1.1 mmt -94.55 122.87 37.58 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.488 0.758 . . . . 0.0 110.983 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.728 HG21 HD13 ' A' ' 159' ' ' LEU . 18.0 pt -116.29 141.96 28.65 Favored Pre-proline 0 C--N 1.326 -0.454 0 O-C-N 124.495 1.122 . . . . 0.0 109.294 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 183' ' ' PRO . . . . . 0.839 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.3 Cg_endo -74.99 126.64 10.1 Favored 'Trans proline' 0 C--N 1.36 1.132 0 O-C-N 124.472 1.775 . . . . 0.0 111.044 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.819 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 90.6 t -74.08 -31.21 1.24 Allowed Pre-proline 0 C--N 1.325 -0.491 0 O-C-N 124.541 1.151 . . . . 0.0 109.276 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 185' ' ' PRO . . . . . 0.819 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -75.01 -28.17 9.38 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.493 1.786 . . . . 0.0 111.023 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.643 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.9 m-85 -98.07 2.86 49.18 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.532 1.145 . . . . 0.0 110.938 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 187' ' ' VAL . . . . . 0.839 HG13 ' O ' ' A' ' 183' ' ' PRO . 2.4 m -136.12 162.46 36.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.548 1.155 . . . . 0.0 109.29 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 188' ' ' GLU . . . . . 0.407 ' O ' ' HB ' ' A' ' 137' ' ' VAL . 0.1 OUTLIER -116.35 155.3 28.7 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.505 1.128 . . . . 0.0 110.254 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.77 110.77 20.72 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.554 1.159 . . . . 0.0 109.316 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -93.82 -47.46 6.74 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.52 1.138 . . . . 0.0 110.99 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 191' ' ' GLY . . . . . 0.413 ' C ' ' N ' ' A' ' 136' ' ' TYR . . . . . . . . 0 CA--C 1.53 1.02 0 O-C-N 124.494 1.121 . . . . 0.0 111.055 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' CYS . . . . . 0.578 ' HB3' ' CD2' ' A' ' 136' ' ' TYR . 0.5 OUTLIER . . . . . 0 N--CA 1.452 -0.333 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' TYR . . . . . 0.578 ' CD2' ' HB3' ' A' ' 135' ' ' CYS . 0.4 OUTLIER -143.82 169.52 17.63 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.549 1.156 . . . . 0.0 110.971 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.821 HG12 ' HA ' ' A' ' 189' ' ' LYS . 33.3 m -140.3 161.83 24.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.475 1.109 . . . . 0.0 109.269 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.447 ' O ' HD13 ' A' ' 140' ' ' LEU . 30.5 ttm180 -118.35 113.69 21.8 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.563 1.165 . . . . 0.0 110.247 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.539 ' O ' ' N ' ' A' ' 156' ' ' GLY . . . -82.52 112.31 19.32 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.498 1.123 . . . . 0.0 109.282 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.639 HD22 ' H ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -87.68 21.05 2.71 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.531 1.144 . . . . 0.0 109.229 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.411 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -147.47 164.05 34.59 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.464 1.103 . . . . 0.0 110.996 179.96 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -102.78 156.79 17.4 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.542 1.151 . . . . 0.0 109.309 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.651 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 20.6 t80 -177.5 139.57 0.25 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.535 1.147 . . . . 0.0 110.969 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ASN . . . . . 0.438 ' HA ' ' HB3' ' A' ' 152' ' ' PRO . 3.8 p-10 -112.07 -52.23 2.8 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.584 1.177 . . . . 0.0 109.327 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' GLY . . . . . 0.537 ' O ' ' CB ' ' A' ' 146' ' ' ASN . . . 77.47 -76.4 1.69 Allowed Glycine 0 CA--C 1.53 0.985 0 O-C-N 124.563 1.164 . . . . 0.0 111.023 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' ASN . . . . . 0.552 ' O ' ' CB ' ' A' ' 147' ' ' ASP . 3.8 m-20 152.76 -17.07 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.475 0.75 . . . . 0.0 109.275 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ASP . . . . . 0.552 ' CB ' ' O ' ' A' ' 146' ' ' ASN . 0.6 OUTLIER 86.67 -162.89 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.555 1.159 . . . . 0.0 109.34 -179.93 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.446 ' C ' ' O ' ' A' ' 147' ' ' ASP . 8.0 tt0 35.2 38.56 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.566 1.166 . . . . 0.0 110.318 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 168.3 -25.68 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.457 1.098 . . . . 0.0 110.343 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.419 ' O ' ' HA ' ' A' ' 147' ' ' ASP . 2.8 m-20 -146.54 167.77 22.88 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.469 1.105 . . . . 0.0 109.313 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 1.082 HD23 HD11 ' A' ' 182' ' ' ILE . 14.5 tp -112.65 118.39 45.18 Favored Pre-proline 0 C--N 1.325 -0.459 0 O-C-N 124.527 1.142 . . . . 0.0 109.318 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 152' ' ' PRO . . . . . 0.44 ' HG3' ' OD1' ' A' ' 147' ' ' ASP . 18.3 Cg_endo -75.03 145.5 31.4 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.481 1.779 . . . . 0.0 110.975 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.651 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 5.9 p90 -157.5 -177.67 6.76 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.526 1.141 . . . . 0.0 110.999 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.29 140.06 43.11 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.525 1.141 . . . . 0.0 109.285 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 155' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 1.0 OUTLIER -43.61 131.13 5.25 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.493 1.12 . . . . 0.0 109.352 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.539 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 78.84 39.72 19.74 Favored Glycine 0 CA--C 1.53 0.997 0 O-C-N 124.548 1.155 . . . . 0.0 111.036 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 157' ' ' ASP . . . . . 0.42 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 25.2 t70 -116.98 165.66 13.09 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.487 0.757 . . . . 0.0 109.292 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.49 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 11.2 mm -116.9 147.81 20.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.553 1.158 . . . . 0.0 109.327 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.955 HD13 HD13 ' A' ' 182' ' ' ILE . 0.9 OUTLIER -141.84 138.1 31.92 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.434 1.084 . . . . 0.0 109.34 179.972 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.517 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.0 OUTLIER -87.45 102.25 14.37 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.477 1.11 . . . . 0.0 110.352 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 1.018 HD12 ' HB2' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -84.86 123.28 39.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.494 1.121 . . . . 0.0 109.279 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -122.77 -22.89 5.2 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.501 1.125 . . . . 0.0 110.273 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -131.31 152.55 50.46 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.491 1.12 . . . . 0.0 109.265 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.575 ' CB ' ' CG ' ' A' ' 170' ' ' TRP . 3.4 pttp -160.15 66.63 2.62 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 124.519 1.137 . . . . 0.0 109.276 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -75.05 4.26 4.92 Favored 'Trans proline' 0 C--N 1.361 1.191 0 O-C-N 124.445 1.761 . . . . 0.0 110.935 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' GLU . . . . . 0.474 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 9.2 mt-10 -127.65 177.92 6.47 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.567 1.167 . . . . 0.0 110.272 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 167' ' ' GLU . . . . . 0.505 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 7.3 pt-20 -112.61 33.53 4.9 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.459 1.099 . . . . 0.0 110.302 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.505 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 3.4 mt-30 -175.66 -37.99 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.523 1.14 . . . . 0.0 110.309 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -108.43 100.22 9.53 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.554 1.159 . . . . 0.0 107.983 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 170' ' ' TRP . . . . . 0.814 ' HB2' HD11 ' A' ' 161' ' ' ILE . 37.3 m0 -108.15 153.75 22.71 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.518 1.136 . . . . 0.0 108.013 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 2.8 t30 -88.04 110.23 20.45 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.475 1.11 . . . . 0.0 109.27 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 172' ' ' ALA . . . . . 1.026 ' HB3' HD12 ' A' ' 182' ' ' ILE . . . -130.37 159.58 36.56 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.529 1.143 . . . . 0.0 109.385 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.557 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.8 OUTLIER -92.26 156.79 17.04 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.458 1.099 . . . . 0.0 110.292 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 174' ' ' ASP . . . . . 0.581 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.5 OUTLIER -91.08 -160.32 0.71 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.498 1.124 . . . . 0.0 109.335 179.968 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.94 8.45 8.35 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.525 1.141 . . . . 0.0 110.004 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -128.66 -5.07 5.23 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.466 1.104 . . . . 0.0 110.287 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.521 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 100.16 -11.01 60.23 Favored Glycine 0 CA--C 1.53 0.999 0 O-C-N 124.449 1.093 . . . . 0.0 111.05 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 10.7 mttp -52.6 111.75 0.7 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.583 0.813 . . . . 0.0 109.293 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 179' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -87.19 124.28 33.12 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.523 1.14 . . . . 0.0 110.282 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.456 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -155.13 -168.05 17.73 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.51 1.131 . . . . 0.0 110.906 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -89.19 122.13 32.17 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.441 0.73 . . . . 0.0 111.095 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 1.082 HD11 HD23 ' A' ' 151' ' ' LEU . 62.0 mt -121.29 143.07 36.56 Favored Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.476 1.11 . . . . 0.0 109.265 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 183' ' ' PRO . . . . . 0.771 ' HD2' HG23 ' A' ' 182' ' ' ILE . 18.0 Cg_endo -75.1 133.12 16.06 Favored 'Trans proline' 0 C--N 1.361 1.193 0 O-C-N 124.466 1.772 . . . . 0.0 110.928 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.828 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 42.2 t -80.09 -31.82 0.67 Allowed Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.508 1.13 . . . . 0.0 109.295 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 185' ' ' PRO . . . . . 0.828 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -75.03 -28.14 9.36 Favored 'Trans proline' 0 C--N 1.361 1.208 0 O-C-N 124.443 1.759 . . . . 0.0 110.989 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.605 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 9.7 m-85 -96.9 12.29 32.83 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.418 1.074 . . . . 0.0 111.067 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 187' ' ' VAL . . . . . 0.673 HG13 ' O ' ' A' ' 183' ' ' PRO . 1.7 m -149.55 149.97 14.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.55 1.156 . . . . 0.0 109.257 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 188' ' ' GLU . . . . . 0.503 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.6 OUTLIER -98.36 138.22 35.92 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.48 1.113 . . . . 0.0 110.318 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 189' ' ' LYS . . . . . 0.821 ' HA ' HG12 ' A' ' 137' ' ' VAL . 1.0 OUTLIER -86.65 103.64 15.32 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.513 1.133 . . . . 0.0 109.283 -179.969 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 190' ' ' TYR . . . . . 0.457 ' HB3' ' CD1' ' A' ' 136' ' ' TYR . 1.2 t80 -87.72 -36.61 17.27 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.526 1.141 . . . . 0.0 110.979 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.024 0 O-C-N 124.514 1.134 . . . . 0.0 111.02 179.951 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 135' ' ' CYS . . . . . 0.401 ' O ' ' HG2' ' A' ' 160' ' ' ARG . 26.3 p . . . . . 0 N--CA 1.453 -0.312 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' TYR . . . . . 0.49 ' CE1' ' HB2' ' A' ' 160' ' ' ARG . 5.6 m-85 -155.48 171.69 19.5 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.608 1.193 . . . . 0.0 110.995 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.622 HG22 HG23 ' A' ' 161' ' ' ILE . 3.3 m -145.27 144.4 21.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.501 1.126 . . . . 0.0 109.327 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.738 ' O ' HD13 ' A' ' 140' ' ' LEU . 0.4 OUTLIER -106.31 112.91 26.13 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.543 1.152 . . . . 0.0 110.332 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.435 ' CB ' HG12 ' A' ' 187' ' ' VAL . . . -83.27 105.45 14.24 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.474 1.108 . . . . 0.0 109.276 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.738 HD13 ' O ' ' A' ' 138' ' ' ARG . 0.0 OUTLIER -88.3 26.98 1.31 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.513 1.133 . . . . 0.0 109.236 179.974 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.402 ' CA ' ' HG2' ' A' ' 155' ' ' LYS . 6.4 m-85 -144.58 157.2 44.32 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.511 1.132 . . . . 0.0 110.993 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -93.28 130.89 38.84 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.513 1.133 . . . . 0.0 109.282 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.613 ' HB2' ' CZ ' ' A' ' 153' ' ' PHE . 35.5 t80 -142.26 133.36 26.04 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.518 1.136 . . . . 0.0 110.981 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ASN . . . . . 0.421 ' HA ' ' HB3' ' A' ' 152' ' ' PRO . 53.6 t-20 -159.15 109.5 1.99 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.545 1.153 . . . . 0.0 109.243 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 87.67 135.11 4.62 Favored Glycine 0 CA--C 1.53 0.984 0 O-C-N 124.492 1.12 . . . . 0.0 111.0 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' ASN . . . . . 0.505 ' HB2' ' CZ ' ' A' ' 143' ' ' PHE . 2.7 t30 -179.4 -52.56 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.471 0.748 . . . . 0.0 109.267 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ASP . . . . . 0.449 ' CG ' ' HB3' ' A' ' 150' ' ' ASP . 0.0 OUTLIER -149.32 -175.19 4.89 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.506 1.129 . . . . 0.0 109.35 -179.95 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -83.54 -25.85 30.63 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.485 1.116 . . . . 0.0 110.312 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -110.83 23.49 14.11 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.442 1.089 . . . . 0.0 110.302 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.449 ' HB3' ' CG ' ' A' ' 147' ' ' ASP . 0.0 OUTLIER -85.73 151.5 23.8 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.533 1.146 . . . . 0.0 109.294 179.947 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.881 HD23 ' CG2' ' A' ' 182' ' ' ILE . 12.2 tp -110.8 101.76 50.37 Favored Pre-proline 0 C--N 1.326 -0.446 0 O-C-N 124.526 1.141 . . . . 0.0 109.272 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 152' ' ' PRO . . . . . 0.421 ' HB3' ' HA ' ' A' ' 144' ' ' ASN . 18.1 Cg_endo -75.03 150.24 37.72 Favored 'Trans proline' 0 C--N 1.361 1.191 0 O-C-N 124.503 1.791 . . . . 0.0 110.98 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.613 ' CZ ' ' HB2' ' A' ' 143' ' ' PHE . 21.1 p90 -160.45 178.45 9.55 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.51 1.131 . . . . 0.0 110.937 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 154' ' ' LYS . . . . . 0.415 ' O ' ' C ' ' A' ' 155' ' ' LYS . 1.1 ttpp -126.28 143.5 51.13 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.545 1.153 . . . . 0.0 109.319 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 155' ' ' LYS . . . . . 0.527 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.1 OUTLIER -39.27 128.21 1.77 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.429 1.08 . . . . 0.0 109.267 -180.0 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.474 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 79.6 40.8 14.27 Favored Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.578 1.174 . . . . 0.0 111.033 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 157' ' ' ASP . . . . . 0.523 ' OD1' HD21 ' A' ' 159' ' ' LEU . 5.0 t70 -111.48 162.41 15.13 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.6 0.824 . . . . 0.0 109.277 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.483 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 75.7 mt -120.39 146.69 24.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.454 1.096 . . . . 0.0 109.271 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.949 HD13 HG21 ' A' ' 182' ' ' ILE . 0.9 OUTLIER -141.53 141.85 33.56 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.538 1.149 . . . . 0.0 109.342 179.978 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.49 ' HB2' ' CE1' ' A' ' 136' ' ' TYR . 9.8 ttm-85 -93.48 102.14 14.35 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.553 1.158 . . . . 0.0 110.319 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.838 HG22 ' HB2' ' A' ' 172' ' ' ALA . 0.7 OUTLIER -82.13 125.53 39.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 O-C-N 124.599 1.187 . . . . 0.0 109.278 -179.982 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -121.11 -22.25 6.17 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 124.446 1.091 . . . . 0.0 110.254 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -134.0 144.53 48.78 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.597 1.186 . . . . 0.0 109.268 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.551 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -141.09 80.73 16.66 Favored Pre-proline 0 C--N 1.325 -0.483 0 O-C-N 124.503 1.127 . . . . 0.0 109.317 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.06 -50.35 0.13 Allowed 'Trans proline' 0 C--N 1.359 1.104 0 O-C-N 124.514 1.797 . . . . 0.0 110.929 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' GLU . . . . . 0.425 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 2.0 mt-10 -82.23 179.62 7.74 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 0.0 110.299 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -104.84 9.37 34.82 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.542 1.152 . . . . 0.0 110.284 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -146.55 -42.59 0.19 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.507 1.129 . . . . 0.0 110.279 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 169' ' ' TRP . . . . . 0.402 ' HH2' ' CZ ' ' A' ' 143' ' ' PHE . 68.2 m95 -103.61 111.39 23.85 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.487 1.117 . . . . 0.0 108.002 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 170' ' ' TRP . . . . . 0.681 ' O ' HD13 ' A' ' 182' ' ' ILE . 50.2 m0 -113.71 164.66 13.42 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.54 1.15 . . . . 0.0 107.937 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.483 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -96.75 117.06 30.22 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.457 1.098 . . . . 0.0 109.265 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 172' ' ' ALA . . . . . 0.838 ' HB2' HG22 ' A' ' 161' ' ' ILE . . . -139.59 163.45 32.53 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.586 1.179 . . . . 0.0 109.284 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.574 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 2.7 mp0 -90.79 157.52 17.34 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.575 1.172 . . . . 0.0 110.31 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 174' ' ' ASP . . . . . 0.53 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 2.0 t0 -92.5 -160.67 0.76 Allowed 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.484 1.115 . . . . 0.0 109.364 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 43.1 t -81.13 6.68 13.05 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.484 1.115 . . . . 0.0 109.971 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -127.03 -3.64 6.37 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.523 1.139 . . . . 0.0 110.37 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.512 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 98.88 -11.34 62.47 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.435 1.084 . . . . 0.0 111.011 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 178' ' ' LYS . . . . . 0.69 ' O ' HD11 ' A' ' 151' ' ' LEU . 21.4 mttt -51.91 115.79 1.85 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.521 0.777 . . . . 0.0 109.302 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 179' ' ' ARG . . . . . 0.497 ' HG2' ' CG ' ' A' ' 173' ' ' GLU . 0.5 OUTLIER -86.69 122.05 30.05 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.527 1.142 . . . . 0.0 110.353 179.97 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.726 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -154.82 -166.82 15.71 Favored Glycine 0 CA--C 1.53 1.03 0 O-C-N 124.518 1.136 . . . . 0.0 110.975 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 5.3 ttm -100.4 131.84 46.11 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.533 0.784 . . . . 0.0 110.975 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.949 HG21 HD13 ' A' ' 159' ' ' LEU . 0.2 OUTLIER -126.14 145.79 53.61 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.545 1.153 . . . . 0.0 109.306 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 183' ' ' PRO . . . . . 0.767 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -74.97 123.59 8.01 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.505 1.792 . . . . 0.0 111.021 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.835 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 5.1 t -69.49 -29.87 1.95 Allowed Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.553 1.158 . . . . 0.0 109.303 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 185' ' ' PRO . . . . . 0.835 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.97 -25.23 12.11 Favored 'Trans proline' 0 C--N 1.361 1.209 0 O-C-N 124.491 1.785 . . . . 0.0 111.05 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.767 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.7 m-85 -99.92 0.12 40.59 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.461 1.101 . . . . 0.0 111.013 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 187' ' ' VAL . . . . . 0.712 HG13 ' O ' ' A' ' 183' ' ' PRO . 4.1 m -130.53 152.74 37.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.511 1.132 . . . . 0.0 109.329 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 188' ' ' GLU . . . . . 0.572 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.1 OUTLIER -105.01 166.7 10.2 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.581 1.175 . . . . 0.0 110.291 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.19 116.22 28.81 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.541 1.15 . . . . 0.0 109.295 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 190' ' ' TYR . . . . . 0.479 ' O ' ' C ' ' A' ' 191' ' ' GLY . 7.8 t80 -135.81 73.97 1.49 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.462 1.101 . . . . 0.0 111.005 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 191' ' ' GLY . . . . . 0.479 ' C ' ' O ' ' A' ' 190' ' ' TYR . . . . . . . . 0 CA--C 1.53 0.983 0 O-C-N 124.57 1.169 . . . . 0.0 110.951 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' CYS . . . . . 0.4 ' C ' ' CD1' ' A' ' 136' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.357 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' TYR . . . . . 0.528 ' CD1' ' N ' ' A' ' 136' ' ' TYR . 0.1 OUTLIER -149.72 167.13 27.32 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.437 1.086 . . . . 0.0 110.999 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.571 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 18.6 m -142.88 150.87 17.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.52 1.138 . . . . 0.0 109.299 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.548 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 17.2 ttt-85 -105.45 117.33 33.75 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.539 1.149 . . . . 0.0 110.305 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.566 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -82.08 110.59 17.45 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.535 1.147 . . . . 0.0 109.268 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.806 HD22 ' H ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -89.09 19.13 4.4 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.532 1.145 . . . . 0.0 109.302 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.458 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 9.6 m-85 -143.62 164.39 30.53 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.511 1.132 . . . . 0.0 110.926 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.53 155.79 17.1 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.433 1.083 . . . . 0.0 109.285 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.508 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 8.0 t80 -173.78 98.05 0.11 Allowed 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.578 1.174 . . . . 0.0 110.978 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -126.13 118.04 24.39 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.484 1.115 . . . . 0.0 109.304 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 73.68 115.44 0.07 OUTLIER Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.539 1.15 . . . . 0.0 111.031 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -157.25 -67.69 0.1 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.531 0.783 . . . . 0.0 109.323 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -139.67 169.06 18.42 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.446 1.092 . . . . 0.0 109.263 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -86.61 45.27 1.23 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.506 1.129 . . . . 0.0 110.288 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -162.95 -29.93 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.518 1.136 . . . . 0.0 110.363 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.564 ' OD1' ' CZ3' ' A' ' 169' ' ' TRP . 35.6 m-20 -75.42 130.47 39.02 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.507 1.129 . . . . 0.0 109.302 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.881 HD22 ' O ' ' A' ' 172' ' ' ALA . 13.1 tp -83.5 113.58 47.72 Favored Pre-proline 0 C--N 1.325 -0.467 0 O-C-N 124.48 1.112 . . . . 0.0 109.337 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 152' ' ' PRO . . . . . 0.505 ' HA ' ' O ' ' A' ' 143' ' ' PHE . 18.0 Cg_endo -75.07 159.02 41.59 Favored 'Trans proline' 0 C--N 1.359 1.118 0 O-C-N 124.557 1.82 . . . . 0.0 110.98 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.508 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 0.8 OUTLIER -167.69 -170.78 1.47 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.439 1.087 . . . . 0.0 110.979 -179.921 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -129.2 139.2 51.97 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.491 1.12 . . . . 0.0 109.296 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -46.5 116.93 1.43 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.563 1.165 . . . . 0.0 109.304 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 97.2 39.9 3.88 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.573 1.171 . . . . 0.0 111.041 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 157' ' ' ASP . . . . . 0.417 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 15.0 t70 -118.46 178.5 4.43 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.457 0.739 . . . . 0.0 109.316 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.502 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 10.5 mt -130.1 145.83 35.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.55 1.156 . . . . 0.0 109.338 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.536 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 0.3 OUTLIER -140.21 140.81 35.93 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.513 1.133 . . . . 0.0 109.251 179.972 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.544 ' HB3' ' HB2' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.94 101.07 13.06 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.533 1.145 . . . . 0.0 110.333 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 1.014 HD12 ' HB2' ' A' ' 172' ' ' ALA . 0.3 OUTLIER -83.03 127.6 39.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.422 1.076 . . . . 0.0 109.325 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 24.3 ptt85 -127.69 -22.91 3.51 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.443 1.089 . . . . 0.0 110.302 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 163' ' ' ASP . . . . . 0.41 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 0.9 OUTLIER -121.51 144.08 48.91 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.552 1.157 . . . . 0.0 109.279 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.577 ' HD3' ' CZ3' ' A' ' 170' ' ' TRP . 57.3 mttt -148.64 69.42 10.24 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.501 1.125 . . . . 0.0 109.299 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.96 -52.06 0.11 Allowed 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.486 1.782 . . . . 0.0 111.057 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 166' ' ' GLU . . . . . 0.462 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.3 mm-40 -80.95 178.23 8.55 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.489 1.118 . . . . 0.0 110.321 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 167' ' ' GLU . . . . . 0.504 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 8.9 mm-40 -108.25 29.77 7.03 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.488 1.118 . . . . 0.0 110.259 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.504 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 2.1 mt-30 -167.93 -39.71 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.439 1.087 . . . . 0.0 110.311 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 169' ' ' TRP . . . . . 0.564 ' CZ3' ' OD1' ' A' ' 150' ' ' ASP . 78.8 m95 -105.25 106.3 16.74 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 170' ' ' TRP . . . . . 0.761 ' HB2' HD11 ' A' ' 161' ' ' ILE . 51.0 m0 -112.22 162.8 15.08 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.478 1.111 . . . . 0.0 108.006 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.508 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 1.1 t-20 -98.11 115.4 28.18 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.511 1.132 . . . . 0.0 109.326 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 172' ' ' ALA . . . . . 1.014 ' HB2' HD12 ' A' ' 161' ' ' ILE . . . -134.4 158.11 44.71 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.555 1.159 . . . . 0.0 109.291 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.544 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 1.3 mp0 -94.7 156.57 16.34 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.474 1.109 . . . . 0.0 110.272 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 174' ' ' ASP . . . . . 0.564 ' N ' HD21 ' A' ' 151' ' ' LEU . 0.5 OUTLIER -90.43 -162.17 0.87 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.522 1.139 . . . . 0.0 109.317 179.992 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.81 10.0 5.57 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.533 1.145 . . . . 0.0 109.992 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -128.08 -5.73 5.54 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.595 1.184 . . . . 0.0 110.274 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.512 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 99.97 -11.15 60.58 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.505 1.128 . . . . 0.0 110.997 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 178' ' ' LYS . . . . . 0.541 ' O ' HD11 ' A' ' 151' ' ' LEU . 8.5 mttt -53.23 111.79 0.76 Allowed 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.536 0.786 . . . . 0.0 109.327 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 179' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.1 OUTLIER -89.75 127.36 35.94 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.479 1.112 . . . . 0.0 110.314 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.508 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.61 -168.56 18.15 Favored Glycine 0 CA--C 1.529 0.953 0 O-C-N 124.44 1.088 . . . . 0.0 110.967 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 181' ' ' MET . . . . . 0.464 ' O ' ' HA ' ' A' ' 150' ' ' ASP . 0.4 OUTLIER -103.46 126.27 50.51 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.446 0.733 . . . . 0.0 111.02 179.978 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.745 HG23 ' HB3' ' A' ' 151' ' ' LEU . 2.7 pp -130.42 155.68 80.67 Favored Pre-proline 0 C--N 1.324 -0.51 0 O-C-N 124.496 1.122 . . . . 0.0 109.288 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 183' ' ' PRO . . . . . 0.803 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.0 132.68 15.69 Favored 'Trans proline' 0 C--N 1.361 1.186 0 O-C-N 124.428 1.751 . . . . 0.0 110.993 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.855 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 19.6 t -75.26 -29.63 0.89 Allowed Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 124.501 1.126 . . . . 0.0 109.346 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 185' ' ' PRO . . . . . 0.855 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.0 Cg_endo -75.05 -20.09 17.1 Favored 'Trans proline' 0 C--N 1.361 1.19 0 O-C-N 124.469 1.773 . . . . 0.0 110.94 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.803 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 6.7 m-85 -97.94 2.81 49.46 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.487 1.117 . . . . 0.0 110.993 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 187' ' ' VAL . . . . . 0.566 HG12 ' HA ' ' A' ' 139' ' ' ALA . 6.3 m -137.89 155.1 29.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.479 1.112 . . . . 0.0 109.319 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 188' ' ' GLU . . . . . 0.571 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.8 OUTLIER -105.75 144.88 31.87 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.524 1.14 . . . . 0.0 110.275 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 189' ' ' LYS . . . . . 0.476 ' HA ' HG12 ' A' ' 137' ' ' VAL . 0.1 OUTLIER -86.64 107.89 18.38 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.517 1.136 . . . . 0.0 109.286 179.947 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 190' ' ' TYR . . . . . 0.41 ' HB3' ' CD2' ' A' ' 136' ' ' TYR . 1.3 t80 -97.81 -59.13 1.83 Allowed 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.539 1.149 . . . . 0.0 110.977 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.96 0 O-C-N 124.434 1.084 . . . . 0.0 111.034 179.973 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 135' ' ' CYS . . . . . 0.409 ' O ' ' HG3' ' A' ' 160' ' ' ARG . 20.1 p . . . . . 0 N--CA 1.452 -0.343 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' TYR . . . . . 0.455 ' CE1' ' HB2' ' A' ' 160' ' ' ARG . 2.1 m-85 -151.22 161.43 42.73 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.503 1.127 . . . . 0.0 110.967 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.525 ' O ' ' HA ' ' A' ' 158' ' ' ILE . 31.0 m -143.85 146.33 21.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.579 1.174 . . . . 0.0 109.331 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.48 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 5.4 ttp180 -108.64 112.34 24.63 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.492 1.12 . . . . 0.0 110.308 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.522 ' CB ' HG12 ' A' ' 187' ' ' VAL . . . -80.86 109.14 15.14 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.578 1.174 . . . . 0.0 109.348 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.428 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 3.1 mp -88.49 25.02 1.79 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.474 1.109 . . . . 0.0 109.262 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.405 ' O ' ' N ' ' A' ' 155' ' ' LYS . 20.2 t80 -139.18 168.25 20.26 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.445 1.09 . . . . 0.0 111.046 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -113.59 125.63 54.38 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.488 1.118 . . . . 0.0 109.325 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.66 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 1.9 t80 -160.26 151.25 19.04 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.562 1.164 . . . . 0.0 111.027 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 144' ' ' ASN . . . . . 0.484 ' HA ' ' HB3' ' A' ' 152' ' ' PRO . 21.7 p30 -138.7 150.01 45.72 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.523 1.139 . . . . 0.0 109.263 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -138.05 -124.14 2.23 Favored Glycine 0 CA--C 1.529 0.919 0 O-C-N 124.516 1.135 . . . . 0.0 111.007 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' ASN . . . . . 0.411 ' O ' ' CB ' ' A' ' 147' ' ' ASP . 11.7 p-10 -178.42 33.16 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.416 0.715 . . . . 0.0 109.311 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 147' ' ' ASP . . . . . 0.419 ' O ' ' HB2' ' A' ' 150' ' ' ASP . 0.3 OUTLIER 75.08 -152.01 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.488 1.118 . . . . 0.0 109.375 -179.925 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.581 ' O ' ' CB ' ' A' ' 149' ' ' GLU . 2.2 tp10 51.3 41.2 27.78 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.486 1.116 . . . . 0.0 110.282 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 149' ' ' GLU . . . . . 0.581 ' CB ' ' O ' ' A' ' 148' ' ' GLU . 1.9 mt-10 92.75 25.22 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.488 1.117 . . . . 0.0 110.327 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.419 ' HB2' ' O ' ' A' ' 147' ' ' ASP . 0.2 OUTLIER -143.31 127.54 17.64 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.527 1.142 . . . . 0.0 109.319 -179.979 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.782 HD12 ' HD2' ' A' ' 152' ' ' PRO . 31.5 tp -122.51 118.18 28.77 Favored Pre-proline 0 C--N 1.325 -0.484 0 O-C-N 124.459 1.099 . . . . 0.0 109.32 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 152' ' ' PRO . . . . . 0.782 ' HD2' HD12 ' A' ' 151' ' ' LEU . 18.1 Cg_endo -75.05 143.09 28.49 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.467 1.772 . . . . 0.0 110.966 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.66 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 16.7 p90 -157.03 173.16 17.44 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.507 1.129 . . . . 0.0 111.008 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 154' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -130.68 137.27 49.48 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.522 1.139 . . . . 0.0 109.33 179.912 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 155' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.8 OUTLIER -39.82 108.29 0.08 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.457 1.098 . . . . 0.0 109.298 179.959 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 103.07 33.72 4.21 Favored Glycine 0 CA--C 1.53 1.01 0 O-C-N 124.478 1.111 . . . . 0.0 111.002 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 157' ' ' ASP . . . . . 0.429 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 15.3 t70 -109.55 168.81 9.12 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.448 0.734 . . . . 0.0 109.296 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.525 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 9.1 mt -126.13 147.06 30.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.525 1.141 . . . . 0.0 109.296 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 1.09 HD13 HG21 ' A' ' 182' ' ' ILE . 4.2 mt -143.5 139.36 29.78 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.556 1.16 . . . . 0.0 109.326 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.518 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -88.44 105.47 17.63 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.475 1.109 . . . . 0.0 110.322 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.868 HG22 ' HB2' ' A' ' 172' ' ' ALA . 1.1 pp -81.9 125.89 39.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.506 1.129 . . . . 0.0 109.252 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -121.67 -21.23 6.23 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.552 1.157 . . . . 0.0 110.273 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -131.84 137.69 48.18 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.528 1.142 . . . . 0.0 109.364 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.479 ' CG ' HD13 ' A' ' 161' ' ' ILE . 0.0 OUTLIER -140.15 72.44 33.08 Favored Pre-proline 0 C--N 1.324 -0.511 0 O-C-N 124.496 1.123 . . . . 0.0 109.251 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.04 -49.33 0.15 Allowed 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.465 1.771 . . . . 0.0 111.045 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 166' ' ' GLU . . . . . 0.469 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 5.9 mm-40 -79.38 174.4 11.61 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.469 1.105 . . . . 0.0 110.35 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 167' ' ' GLU . . . . . 0.534 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 0.0 OUTLIER -105.57 32.17 4.48 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.491 1.119 . . . . 0.0 110.319 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.534 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 3.7 mt-30 -172.57 -37.47 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.444 1.09 . . . . 0.0 110.284 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 169' ' ' TRP . . . . . 0.461 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 83.1 m95 -107.38 107.52 18.46 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.451 1.094 . . . . 0.0 108.057 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 170' ' ' TRP . . . . . 0.604 ' CD2' HG21 ' A' ' 184' ' ' VAL . 51.3 m0 -113.29 158.98 19.85 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.548 1.155 . . . . 0.0 107.994 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.614 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -94.76 118.43 31.74 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.469 1.106 . . . . 0.0 109.336 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 172' ' ' ALA . . . . . 0.868 ' HB2' HG22 ' A' ' 161' ' ' ILE . . . -132.53 166.16 22.7 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.533 1.145 . . . . 0.0 109.287 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.696 ' HG2' ' N ' ' A' ' 174' ' ' ASP . 0.0 OUTLIER -98.13 160.04 14.55 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.581 1.176 . . . . 0.0 110.302 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 174' ' ' ASP . . . . . 0.696 ' N ' ' HG2' ' A' ' 173' ' ' GLU . 38.9 p-10 -97.44 -156.26 0.53 Allowed 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.506 1.129 . . . . 0.0 109.26 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.06 13.78 7.22 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.492 1.12 . . . . 0.0 110.054 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -136.52 -0.81 2.36 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.505 1.128 . . . . 0.0 110.251 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.663 ' HA2' ' HG3' ' A' ' 173' ' ' GLU . . . 99.27 -19.17 55.06 Favored Glycine 0 CA--C 1.529 0.948 0 O-C-N 124.448 1.092 . . . . 0.0 111.015 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 178' ' ' LYS . . . . . 0.439 ' HB2' ' CG ' ' A' ' 174' ' ' ASP . 0.1 OUTLIER -47.26 111.1 0.36 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.498 0.764 . . . . 0.0 109.313 179.986 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -93.08 126.81 38.36 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.544 1.152 . . . . 0.0 110.368 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.614 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -149.48 -164.6 11.78 Favored Glycine 0 CA--C 1.531 1.089 0 O-C-N 124.514 1.134 . . . . 0.0 110.979 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 181' ' ' MET . . . . . 0.461 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 16.7 tpp -97.4 128.52 44.27 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.562 0.801 . . . . 0.0 111.001 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 1.09 HG21 HD13 ' A' ' 159' ' ' LEU . 1.4 pp -127.51 144.54 51.3 Favored Pre-proline 0 C--N 1.325 -0.483 0 O-C-N 124.452 1.095 . . . . 0.0 109.317 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 183' ' ' PRO . . . . . 0.745 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.05 124.29 8.48 Favored 'Trans proline' 0 C--N 1.36 1.16 0 O-C-N 124.627 1.856 . . . . 0.0 110.933 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.831 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 37.5 t -71.16 -31.31 1.91 Allowed Pre-proline 0 C--N 1.324 -0.5 0 O-C-N 124.54 1.15 . . . . 0.0 109.322 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 185' ' ' PRO . . . . . 0.831 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -75.06 -23.66 13.48 Favored 'Trans proline' 0 C--N 1.36 1.133 0 O-C-N 124.475 1.776 . . . . 0.0 111.0 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.745 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.9 m-85 -98.23 -2.5 39.55 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.517 1.136 . . . . 0.0 111.005 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 187' ' ' VAL . . . . . 0.692 HG22 ' O ' ' A' ' 183' ' ' PRO . 7.2 m -127.54 153.6 36.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 O-C-N 124.482 1.114 . . . . 0.0 109.315 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 188' ' ' GLU . . . . . 0.505 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 6.0 mm-40 -101.11 160.64 14.22 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.604 1.19 . . . . 0.0 110.295 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.58 109.57 20.19 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.516 1.135 . . . . 0.0 109.296 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -94.61 -59.64 1.89 Allowed 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.531 1.144 . . . . 0.0 111.018 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.033 0 O-C-N 124.498 1.124 . . . . 0.0 111.015 -179.996 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 135' ' ' CYS . . . . . 0.657 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 13.4 p . . . . . 0 N--CA 1.452 -0.346 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' TYR . . . . . 0.657 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 0.1 OUTLIER -136.4 174.75 10.27 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.422 1.077 . . . . 0.0 110.999 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.985 HG12 ' HA ' ' A' ' 189' ' ' LYS . 21.1 m -138.49 156.91 30.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 O-C-N 124.588 1.18 . . . . 0.0 109.297 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.553 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 13.1 ttp180 -108.35 121.71 45.48 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.476 1.11 . . . . 0.0 110.318 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.516 ' C ' HD13 ' A' ' 140' ' ' LEU . . . -82.51 116.79 22.1 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.427 1.08 . . . . 0.0 109.315 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.661 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -93.33 25.8 3.22 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.477 1.111 . . . . 0.0 109.281 -179.973 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -150.65 163.54 38.26 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.511 1.132 . . . . 0.0 111.015 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.47 128.73 54.76 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.451 1.094 . . . . 0.0 109.332 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.578 ' HB2' ' CZ ' ' A' ' 153' ' ' PHE . 35.9 t80 -145.23 127.23 15.53 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.452 1.095 . . . . 0.0 110.947 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -144.49 96.08 2.81 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.497 1.123 . . . . 0.0 109.349 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -130.03 -135.98 3.96 Favored Glycine 0 CA--C 1.529 0.963 0 O-C-N 124.545 1.153 . . . . 0.0 110.961 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 163.61 90.07 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.512 0.772 . . . . 0.0 109.23 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -103.61 -61.92 1.36 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.476 1.11 . . . . 0.0 109.31 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 174.81 -43.88 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.502 1.126 . . . . 0.0 110.356 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' GLU . . . . . 0.434 ' O ' ' N ' ' A' ' 181' ' ' MET . 2.1 mp0 -121.43 4.04 10.22 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.535 1.147 . . . . 0.0 110.298 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.31 146.09 31.78 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.51 1.131 . . . . 0.0 109.321 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.792 HD22 ' O ' ' A' ' 172' ' ' ALA . 12.4 tp -117.83 115.54 36.91 Favored Pre-proline 0 C--N 1.325 -0.468 0 O-C-N 124.525 1.14 . . . . 0.0 109.328 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 152' ' ' PRO . . . . . 0.412 ' O ' ' OD1' ' A' ' 174' ' ' ASP . 18.3 Cg_endo -74.96 165.17 31.91 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.497 1.788 . . . . 0.0 110.949 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.578 ' CZ ' ' HB2' ' A' ' 143' ' ' PHE . 7.7 p90 -170.52 -174.82 1.73 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.493 1.121 . . . . 0.0 110.93 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 154' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 157' ' ' ASP . 0.0 OUTLIER -133.67 147.29 51.4 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.493 1.121 . . . . 0.0 109.259 -179.937 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 155' ' ' LYS . . . . . 0.484 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -51.82 120.01 4.84 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.582 1.176 . . . . 0.0 109.253 179.966 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.475 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 86.08 41.07 7.23 Favored Glycine 0 CA--C 1.53 1.019 0 O-C-N 124.512 1.133 . . . . 0.0 110.979 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 157' ' ' ASP . . . . . 0.484 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 15.1 t70 -114.06 174.3 6.01 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.512 0.772 . . . . 0.0 109.31 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.768 ' O ' HD23 ' A' ' 159' ' ' LEU . 7.3 mm -121.82 154.85 26.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 O-C-N 124.47 1.106 . . . . 0.0 109.337 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.768 HD23 ' O ' ' A' ' 158' ' ' ILE . 6.2 mt -146.96 137.73 23.79 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.508 1.13 . . . . 0.0 109.302 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.584 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 5.0 ttm180 -87.06 109.02 19.13 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.56 1.162 . . . . 0.0 110.324 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.495 ' CD1' ' HB2' ' A' ' 172' ' ' ALA . 0.5 OUTLIER -79.99 125.38 38.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.563 1.165 . . . . 0.0 109.261 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -118.86 -25.03 6.41 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.516 1.135 . . . . 0.0 110.345 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -147.59 153.68 39.72 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.421 1.076 . . . . 0.0 109.227 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.562 ' HB2' ' CD2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -155.49 68.96 5.29 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.509 1.13 . . . . 0.0 109.268 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.95 -42.08 0.58 Allowed 'Trans proline' 0 C--N 1.359 1.103 0 O-C-N 124.535 1.808 . . . . 0.0 111.02 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 166' ' ' GLU . . . . . 0.491 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 10.7 mp0 -82.3 176.36 9.52 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.489 1.118 . . . . 0.0 110.321 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -114.94 48.98 1.08 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.478 1.112 . . . . 0.0 110.324 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 171.96 -35.15 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.552 1.158 . . . . 0.0 110.255 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 169' ' ' TRP . . . . . 0.514 ' CE3' ' HG2' ' A' ' 181' ' ' MET . 61.2 m95 -116.71 99.7 7.31 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.468 1.105 . . . . 0.0 108.028 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 170' ' ' TRP . . . . . 0.717 ' CE2' HG21 ' A' ' 184' ' ' VAL . 51.0 m0 -105.34 166.42 10.43 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.427 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.6 OUTLIER -103.51 108.85 20.29 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.48 1.112 . . . . 0.0 109.308 179.994 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 172' ' ' ALA . . . . . 0.792 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -134.82 166.24 23.42 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.488 1.118 . . . . 0.0 109.295 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.554 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.8 OUTLIER -90.48 155.94 18.55 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.479 1.112 . . . . 0.0 110.32 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 174' ' ' ASP . . . . . 0.428 ' HA ' HD22 ' A' ' 159' ' ' LEU . 0.2 OUTLIER -88.71 -161.88 0.8 Allowed 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.478 1.111 . . . . 0.0 109.293 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 40.7 t -79.68 8.01 7.4 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.536 1.148 . . . . 0.0 110.023 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -129.37 -4.52 4.86 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.489 1.118 . . . . 0.0 110.346 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.53 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 101.49 -11.64 58.14 Favored Glycine 0 CA--C 1.53 1.019 0 O-C-N 124.508 1.13 . . . . 0.0 111.014 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 178' ' ' LYS . . . . . 0.601 ' O ' HD11 ' A' ' 151' ' ' LEU . 4.3 mttm -52.58 113.43 1.06 Allowed 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.458 0.74 . . . . 0.0 109.28 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 179' ' ' ARG . . . . . 0.463 ' CG ' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.72 121.26 28.98 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.509 1.131 . . . . 0.0 110.316 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.562 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -155.15 -164.23 12.85 Favored Glycine 0 CA--C 1.531 1.032 0 O-C-N 124.475 1.11 . . . . 0.0 111.009 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 181' ' ' MET . . . . . 0.514 ' HG2' ' CE3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -96.45 124.32 40.4 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.535 0.785 . . . . 0.0 110.996 -179.985 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.79 HG22 ' HB3' ' A' ' 151' ' ' LEU . 0.2 OUTLIER -122.09 148.7 52.43 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.56 1.162 . . . . 0.0 109.32 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 183' ' ' PRO . . . . . 0.811 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.3 Cg_endo -75.04 129.38 12.25 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.503 1.791 . . . . 0.0 110.979 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.829 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 79.9 t -75.43 -31.91 1.14 Allowed Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.477 1.11 . . . . 0.0 109.243 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 185' ' ' PRO . . . . . 0.829 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.2 Cg_endo -75.06 -24.77 12.41 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.508 1.794 . . . . 0.0 110.964 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.776 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 5.4 m-85 -98.52 1.67 46.81 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.55 1.156 . . . . 0.0 110.992 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 187' ' ' VAL . . . . . 0.811 HG13 ' O ' ' A' ' 183' ' ' PRO . 2.5 m -135.06 145.82 31.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.438 1.086 . . . . 0.0 109.32 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 188' ' ' GLU . . . . . 0.567 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.5 OUTLIER -104.1 140.63 37.52 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.481 1.113 . . . . 0.0 110.256 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 189' ' ' LYS . . . . . 0.985 ' HA ' HG12 ' A' ' 137' ' ' VAL . 1.3 tmtm? -86.48 111.31 20.44 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.505 1.128 . . . . 0.0 109.308 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 190' ' ' TYR . . . . . 0.463 ' HB3' ' CD1' ' A' ' 136' ' ' TYR . 1.3 t80 -98.6 -40.01 8.42 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.474 1.109 . . . . 0.0 111.033 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 191' ' ' GLY . . . . . 0.623 ' O ' ' CE1' ' A' ' 136' ' ' TYR . . . . . . . . 0 CA--C 1.529 0.959 0 O-C-N 124.494 1.121 . . . . 0.0 111.044 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' CYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 160' ' ' ARG . 99.3 m . . . . . 0 N--CA 1.453 -0.316 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' TYR . . . . . 0.494 ' CE1' ' HD2' ' A' ' 160' ' ' ARG . 6.2 m-85 -152.9 167.55 28.73 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.509 1.131 . . . . 0.0 111.021 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.773 HG22 ' O ' ' A' ' 159' ' ' LEU . 16.6 m -142.93 137.26 26.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 O-C-N 124.496 1.122 . . . . 0.0 109.348 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.69 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 9.5 ttm180 -100.78 106.78 18.22 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.523 1.139 . . . . 0.0 110.269 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.779 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -80.36 104.47 10.93 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.486 1.116 . . . . 0.0 109.324 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.613 HD12 ' O ' ' A' ' 138' ' ' ARG . 6.5 mp -90.02 28.86 1.3 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.487 1.117 . . . . 0.0 109.36 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.475 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 34.0 m-85 -144.22 145.21 31.92 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.436 1.085 . . . . 0.0 111.011 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.09 131.62 35.86 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.452 1.095 . . . . 0.0 109.322 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.486 ' O ' ' CB ' ' A' ' 152' ' ' PRO . 2.5 t80 -153.89 95.78 1.9 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.521 1.138 . . . . 0.0 111.005 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -112.91 120.18 40.52 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 0.0 109.36 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' GLY . . . . . 0.577 ' O ' ' CB ' ' A' ' 146' ' ' ASN . . . -168.73 -130.06 1.15 Allowed Glycine 0 CA--C 1.531 1.038 0 O-C-N 124.557 1.161 . . . . 0.0 110.943 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 146' ' ' ASN . . . . . 0.577 ' CB ' ' O ' ' A' ' 145' ' ' GLY . 3.1 t-20 149.46 92.36 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.55 0.794 . . . . 0.0 109.241 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 147' ' ' ASP . . . . . 0.464 ' O ' ' HB2' ' A' ' 148' ' ' GLU . 0.2 OUTLIER -94.45 -75.26 0.51 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.539 1.149 . . . . 0.0 109.256 -179.984 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.518 ' O ' ' HB3' ' A' ' 149' ' ' GLU . 5.8 tp10 178.17 41.15 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.476 1.11 . . . . 0.0 110.258 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 149' ' ' GLU . . . . . 0.518 ' HB3' ' O ' ' A' ' 148' ' ' GLU . 8.0 pt-20 160.29 -21.96 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.499 1.124 . . . . 0.0 110.312 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -76.57 136.05 39.25 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.563 1.164 . . . . 0.0 109.3 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.785 HD21 ' O ' ' A' ' 178' ' ' LYS . 8.0 tp -106.28 110.49 63.96 Favored Pre-proline 0 C--N 1.324 -0.505 0 O-C-N 124.471 1.107 . . . . 0.0 109.328 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 152' ' ' PRO . . . . . 0.486 ' CB ' ' O ' ' A' ' 143' ' ' PHE . 18.0 Cg_endo -75.06 169.23 23.05 Favored 'Trans proline' 0 C--N 1.36 1.146 0 O-C-N 124.507 1.793 . . . . 0.0 110.915 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.475 ' CE1' ' O ' ' A' ' 141' ' ' PHE . 0.8 OUTLIER -172.87 -170.82 0.7 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.488 1.118 . . . . 0.0 110.949 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 154' ' ' LYS . . . . . 0.462 ' O ' ' HG3' ' A' ' 154' ' ' LYS . 0.0 OUTLIER -125.78 140.07 52.99 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.454 1.096 . . . . 0.0 109.296 179.972 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 155' ' ' LYS . . . . . 0.522 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 1.3 tmmm? -45.85 117.02 1.35 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.507 1.129 . . . . 0.0 109.287 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.454 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 93.33 29.72 9.94 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.523 1.139 . . . . 0.0 110.99 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -100.55 169.36 9.12 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.519 0.776 . . . . 0.0 109.311 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.493 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 9.1 mt -122.24 147.06 26.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.556 1.16 . . . . 0.0 109.31 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.773 ' O ' HG22 ' A' ' 137' ' ' VAL . 0.2 OUTLIER -141.02 136.89 32.54 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.547 1.154 . . . . 0.0 109.316 179.978 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.494 ' HD2' ' CE1' ' A' ' 136' ' ' TYR . 0.2 OUTLIER -88.12 111.02 21.12 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.601 1.188 . . . . 0.0 110.309 179.96 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 1.045 HD12 ' HB2' ' A' ' 172' ' ' ALA . 0.5 OUTLIER -80.48 125.21 39.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.551 1.157 . . . . 0.0 109.36 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -116.74 -26.51 6.95 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.532 1.145 . . . . 0.0 110.3 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 163' ' ' ASP . . . . . 0.465 ' OD2' ' CB ' ' A' ' 171' ' ' ASN . 0.0 OUTLIER -149.11 157.3 43.27 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.461 1.101 . . . . 0.0 109.353 -179.978 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.54 ' HG3' ' CE2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -145.88 92.15 5.46 Favored Pre-proline 0 C--N 1.325 -0.46 0 O-C-N 124.464 1.102 . . . . 0.0 109.278 179.994 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.03 -49.71 0.14 Allowed 'Trans proline' 0 C--N 1.361 1.201 0 O-C-N 124.478 1.778 . . . . 0.0 111.061 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 166' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' A' ' 169' ' ' TRP . 12.5 mt-10 -88.92 -177.53 5.5 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.596 1.185 . . . . 0.0 110.306 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -106.52 -9.78 16.49 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.507 1.13 . . . . 0.0 110.315 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -120.29 -27.66 5.19 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.539 1.15 . . . . 0.0 110.29 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 169' ' ' TRP . . . . . 0.474 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 59.7 m95 -121.65 117.75 27.46 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.543 1.152 . . . . 0.0 107.95 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 170' ' ' TRP . . . . . 0.862 ' CE2' HG21 ' A' ' 184' ' ' VAL . 33.9 m0 -114.2 165.08 13.04 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.519 1.137 . . . . 0.0 107.947 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.467 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.4 OUTLIER -100.37 115.2 29.45 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.493 1.121 . . . . 0.0 109.295 -179.98 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 172' ' ' ALA . . . . . 1.045 ' HB2' HD12 ' A' ' 161' ' ' ILE . . . -136.79 168.44 19.53 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.521 1.138 . . . . 0.0 109.238 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.693 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.8 OUTLIER -97.38 154.57 17.37 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.483 1.114 . . . . 0.0 110.305 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 174' ' ' ASP . . . . . 0.546 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.1 OUTLIER -88.29 -163.97 1.05 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.551 1.157 . . . . 0.0 109.325 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 23.2 t -77.9 9.46 3.56 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.482 1.114 . . . . 0.0 109.982 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -128.66 -5.66 5.19 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.495 1.122 . . . . 0.0 110.276 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.539 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 99.9 -11.31 60.7 Favored Glycine 0 CA--C 1.53 1.028 0 O-C-N 124.445 1.091 . . . . 0.0 110.94 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 178' ' ' LYS . . . . . 0.785 ' O ' HD21 ' A' ' 151' ' ' LEU . 0.8 OUTLIER -53.39 112.47 0.9 Allowed 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.505 0.768 . . . . 0.0 109.306 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 179' ' ' ARG . . . . . 0.45 ' HG2' ' CD ' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.59 124.61 33.07 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.499 1.124 . . . . 0.0 110.322 -179.988 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.705 ' HA3' HD13 ' A' ' 151' ' ' LEU . . . -155.73 -165.44 14.39 Favored Glycine 0 CA--C 1.53 0.971 0 O-C-N 124.473 1.108 . . . . 0.0 111.019 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 181' ' ' MET . . . . . 0.474 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -99.64 131.29 45.73 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.479 0.753 . . . . 0.0 111.003 179.99 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.752 HG21 HD13 ' A' ' 159' ' ' LEU . 2.2 pp -132.62 148.88 71.35 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.466 1.104 . . . . 0.0 109.312 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 183' ' ' PRO . . . . . 0.743 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.0 129.71 12.59 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.488 1.783 . . . . 0.0 111.045 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.862 HG21 ' CE2' ' A' ' 170' ' ' TRP . 54.6 t -74.5 -31.53 1.23 Allowed Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.49 1.119 . . . . 0.0 109.319 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 185' ' ' PRO . . . . . 0.834 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.93 -17.43 19.75 Favored 'Trans proline' 0 C--N 1.36 1.172 0 O-C-N 124.509 1.794 . . . . 0.0 111.06 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.743 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 5.2 m-85 -98.33 -12.61 21.33 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.46 1.1 . . . . 0.0 111.019 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 187' ' ' VAL . . . . . 0.779 HG12 ' HA ' ' A' ' 139' ' ' ALA . 2.3 m -126.97 157.01 38.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.503 1.127 . . . . 0.0 109.385 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 188' ' ' GLU . . . . . 0.47 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 3.4 pt-20 -98.13 161.8 13.53 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.44 1.087 . . . . 0.0 110.297 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.07 112.14 22.33 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.51 1.131 . . . . 0.0 109.249 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -122.52 166.16 15.24 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 124.546 1.153 . . . . 0.0 110.998 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.022 0 O-C-N 124.496 1.123 . . . . 0.0 110.971 179.983 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 85.6 m . . . . . 0 N--CA 1.453 -0.317 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 136' ' ' TYR . . . . . 0.428 ' HA ' ' O ' ' A' ' 159' ' ' LEU . 14.6 m-85 -129.81 177.31 7.35 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.509 1.131 . . . . 0.0 110.963 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.516 HG23 ' N ' ' A' ' 138' ' ' ARG . 1.4 m -149.79 166.77 2.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.402 1.064 . . . . 0.0 109.284 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.516 ' N ' HG23 ' A' ' 137' ' ' VAL . 2.3 ttt-85 -128.15 116.27 19.68 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.463 1.102 . . . . 0.0 110.235 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.496 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -83.87 107.25 16.15 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.528 1.142 . . . . 0.0 109.283 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.515 ' C ' ' HG2' ' A' ' 155' ' ' LYS . 1.1 mp -88.54 26.52 1.45 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.59 1.181 . . . . 0.0 109.356 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.601 ' CD1' ' HA ' ' A' ' 186' ' ' TYR . 84.2 m-85 -153.4 146.61 24.7 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.444 1.09 . . . . 0.0 110.993 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.89 153.79 34.38 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.54 1.15 . . . . 0.0 109.304 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.639 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -165.7 140.85 4.9 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.527 1.142 . . . . 0.0 111.044 179.948 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -131.7 -44.76 0.98 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.472 1.107 . . . . 0.0 109.269 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -166.15 121.9 1.02 Allowed Glycine 0 CA--C 1.53 1.03 0 O-C-N 124.45 1.094 . . . . 0.0 110.976 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' ASN . . . . . 0.577 ' HB2' ' CZ ' ' A' ' 143' ' ' PHE . 9.3 t30 -116.95 -47.8 2.68 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.474 0.75 . . . . 0.0 109.281 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 147' ' ' ASP . . . . . 0.515 ' O ' ' CB ' ' A' ' 148' ' ' GLU . 0.7 OUTLIER -113.83 -63.84 1.39 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.458 1.099 . . . . 0.0 109.273 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.515 ' CB ' ' O ' ' A' ' 147' ' ' ASP . 1.2 mt-10 159.81 -25.6 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.471 1.107 . . . . 0.0 110.39 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -112.54 -5.36 14.03 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.531 1.144 . . . . 0.0 110.288 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -65.27 153.45 41.04 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.568 1.167 . . . . 0.0 109.336 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.886 HD22 ' O ' ' A' ' 172' ' ' ALA . 15.5 tp -92.21 112.48 55.34 Favored Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.471 1.107 . . . . 0.0 109.291 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.0 167.26 27.45 Favored 'Trans proline' 0 C--N 1.361 1.189 0 O-C-N 124.529 1.805 . . . . 0.0 111.056 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.639 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 4.7 p90 -178.05 -178.77 0.69 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.525 1.14 . . . . 0.0 110.983 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.47 142.44 47.15 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.492 1.12 . . . . 0.0 109.302 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 155' ' ' LYS . . . . . 0.515 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -46.0 119.34 2.22 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.504 1.127 . . . . 0.0 109.288 179.962 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.455 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 88.57 40.74 6.27 Favored Glycine 0 CA--C 1.53 0.999 0 O-C-N 124.541 1.151 . . . . 0.0 111.027 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 157' ' ' ASP . . . . . 0.451 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 37.0 t70 -111.14 167.8 9.99 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.481 0.754 . . . . 0.0 109.297 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.499 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 2.3 mp -116.68 149.93 18.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.505 1.128 . . . . 0.0 109.303 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.654 HD13 ' CG2' ' A' ' 182' ' ' ILE . 1.0 OUTLIER -141.74 146.01 35.5 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.494 1.121 . . . . 0.0 109.276 179.943 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.468 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.9 OUTLIER -93.68 101.77 13.92 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.478 1.111 . . . . 0.0 110.3 179.968 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.555 HD11 ' HB3' ' A' ' 170' ' ' TRP . 9.4 tp -79.23 128.47 38.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.488 1.118 . . . . 0.0 109.343 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.21 -26.18 3.69 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.525 1.14 . . . . 0.0 110.254 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 163' ' ' ASP . . . . . 0.406 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 45.9 m-20 -137.39 140.91 41.67 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.485 1.116 . . . . 0.0 109.295 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.591 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -146.79 69.34 12.11 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.542 1.151 . . . . 0.0 109.378 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 165' ' ' PRO . . . . . 0.404 ' HG2' ' OE1' ' A' ' 166' ' ' GLU . 18.4 Cg_endo -75.0 -44.08 0.36 Allowed 'Trans proline' 0 C--N 1.359 1.104 0 O-C-N 124.499 1.789 . . . . 0.0 111.037 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 166' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 169' ' ' TRP . 6.6 mp0 -81.03 171.02 15.49 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.503 1.127 . . . . 0.0 110.315 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 167' ' ' GLU . . . . . 0.425 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 12.5 pm0 -112.41 52.39 0.77 Allowed 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.459 1.099 . . . . 0.0 110.261 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.51 ' O ' HG23 ' A' ' 184' ' ' VAL . 0.1 OUTLIER 169.75 -31.68 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.517 1.136 . . . . 0.0 110.316 179.937 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 169' ' ' TRP . . . . . 0.452 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 73.3 m95 -125.52 101.4 6.91 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.562 1.164 . . . . 0.0 107.967 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 170' ' ' TRP . . . . . 0.83 ' CE2' HG21 ' A' ' 184' ' ' VAL . 10.2 m0 -106.86 174.71 5.77 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.534 1.146 . . . . 0.0 107.982 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.46 ' O ' HD12 ' A' ' 161' ' ' ILE . 0.7 OUTLIER -109.06 113.48 26.39 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 124.522 1.139 . . . . 0.0 109.282 -179.998 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 172' ' ' ALA . . . . . 0.886 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -136.55 164.01 29.19 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.534 1.146 . . . . 0.0 109.373 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.581 ' O ' ' HB3' ' A' ' 159' ' ' LEU . 7.5 mp0 -89.32 153.38 20.92 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.466 1.104 . . . . 0.0 110.345 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 174' ' ' ASP . . . . . 0.518 ' N ' HD21 ' A' ' 151' ' ' LEU . 0.5 OUTLIER -88.1 -159.74 0.57 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.521 1.138 . . . . 0.0 109.353 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 94.4 p -81.71 9.85 7.12 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.472 1.108 . . . . 0.0 109.995 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -131.11 -5.34 3.89 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.511 1.132 . . . . 0.0 110.239 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.512 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 100.96 -11.16 58.87 Favored Glycine 0 CA--C 1.532 1.094 0 O-C-N 124.547 1.154 . . . . 0.0 110.966 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 178' ' ' LYS . . . . . 0.534 ' O ' HD11 ' A' ' 151' ' ' LEU . 3.3 mttp -54.5 114.69 1.77 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.511 0.771 . . . . 0.0 109.234 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 179' ' ' ARG . . . . . 0.54 ' CG ' ' CD ' ' A' ' 173' ' ' GLU . 1.1 mtm180 -86.45 123.86 32.14 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.464 1.102 . . . . 0.0 110.279 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.439 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.91 -169.16 19.2 Favored Glycine 0 CA--C 1.531 1.035 0 O-C-N 124.475 1.109 . . . . 0.0 111.022 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 181' ' ' MET . . . . . 0.452 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.1 OUTLIER -88.24 119.12 28.34 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.519 0.776 . . . . 0.0 111.044 179.971 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.685 HG12 ' HB3' ' A' ' 172' ' ' ALA . 1.6 pp -108.86 133.74 20.58 Favored Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.515 1.135 . . . . 0.0 109.318 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 183' ' ' PRO . . . . . 0.845 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.2 Cg_endo -75.05 126.37 9.9 Favored 'Trans proline' 0 C--N 1.359 1.114 0 O-C-N 124.45 1.763 . . . . 0.0 110.952 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.838 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 60.5 t -71.71 -29.76 1.39 Allowed Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 124.445 1.09 . . . . 0.0 109.238 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 185' ' ' PRO . . . . . 0.838 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -74.99 -29.43 8.25 Favored 'Trans proline' 0 C--N 1.359 1.13 0 O-C-N 124.461 1.769 . . . . 0.0 110.994 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.7 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 5.5 m-85 -100.33 -0.67 37.92 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.531 1.144 . . . . 0.0 110.966 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 187' ' ' VAL . . . . . 0.845 HG13 ' O ' ' A' ' 183' ' ' PRO . 1.4 m -137.11 160.73 36.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.51 1.131 . . . . 0.0 109.327 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 188' ' ' GLU . . . . . 0.465 ' O ' ' HB ' ' A' ' 137' ' ' VAL . 6.9 tp10 -116.76 149.94 39.1 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.538 1.148 . . . . 0.0 110.25 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.43 110.41 19.14 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.463 1.102 . . . . 0.0 109.284 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -124.31 70.83 1.11 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.491 1.119 . . . . 0.0 111.015 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.991 0 O-C-N 124.462 1.101 . . . . 0.0 111.037 -179.999 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 135' ' ' CYS . . . . . 0.677 ' O ' ' CD1' ' A' ' 136' ' ' TYR . 3.6 p . . . . . 0 N--CA 1.453 -0.322 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' TYR . . . . . 0.677 ' CD1' ' O ' ' A' ' 135' ' ' CYS . 8.8 m-85 -149.38 179.98 7.52 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.419 1.074 . . . . 0.0 111.045 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.493 HG11 HG13 ' A' ' 161' ' ' ILE . 24.0 m -144.06 143.87 23.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 124.427 1.079 . . . . 0.0 109.307 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.606 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 28.0 ttm-85 -104.26 111.46 24.08 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.476 1.11 . . . . 0.0 110.306 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.759 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -79.63 107.25 12.25 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.526 1.142 . . . . 0.0 109.336 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.46 ' O ' ' HE2' ' A' ' 155' ' ' LYS . 7.4 mp -89.89 29.53 1.18 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.521 1.138 . . . . 0.0 109.278 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.606 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 42.7 m-85 -148.28 151.7 35.87 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.446 1.092 . . . . 0.0 111.011 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -93.82 133.17 37.5 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.558 1.161 . . . . 0.0 109.273 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.621 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 12.0 t80 -161.0 85.03 0.67 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 0.0 111.027 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' ASN . . . . . 0.418 ' HA ' ' CB ' ' A' ' 152' ' ' PRO . 13.0 p-10 -126.11 92.37 3.57 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.498 1.124 . . . . 0.0 109.312 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 125.96 95.02 0.97 Allowed Glycine 0 CA--C 1.53 1.005 0 O-C-N 124.512 1.133 . . . . 0.0 110.995 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -158.87 -70.94 0.09 Allowed 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.506 0.768 . . . . 0.0 109.345 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -163.28 145.08 9.76 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.585 1.178 . . . . 0.0 109.295 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.58 -13.41 9.22 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.47 1.106 . . . . 0.0 110.285 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -78.19 -24.74 47.02 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.481 1.113 . . . . 0.0 110.292 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -109.73 128.28 55.17 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.496 1.123 . . . . 0.0 109.286 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.96 HD23 HD11 ' A' ' 182' ' ' ILE . 10.5 tp -75.4 116.54 55.68 Favored Pre-proline 0 C--N 1.324 -0.517 0 O-C-N 124.492 1.12 . . . . 0.0 109.32 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 152' ' ' PRO . . . . . 0.538 ' HA ' ' O ' ' A' ' 143' ' ' PHE . 18.4 Cg_endo -75.01 166.07 29.96 Favored 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.398 1.736 . . . . 0.0 111.018 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.621 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 3.5 p90 -166.18 -177.18 4.01 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.525 1.14 . . . . 0.0 111.015 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 154' ' ' LYS . . . . . 0.578 ' O ' ' C ' ' A' ' 155' ' ' LYS . 2.0 ttmt -133.82 129.79 37.02 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.476 1.11 . . . . 0.0 109.301 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 155' ' ' LYS . . . . . 0.578 ' C ' ' O ' ' A' ' 154' ' ' LYS . 12.5 ttmt -25.33 123.37 0.06 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.579 1.174 . . . . 0.0 109.373 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 74.36 49.94 10.96 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 124.49 1.119 . . . . 0.0 110.988 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 157' ' ' ASP . . . . . 0.452 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 28.8 t0 -113.41 165.2 12.69 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.516 0.774 . . . . 0.0 109.355 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.571 HD11 ' NH1' ' A' ' 138' ' ' ARG . 1.3 mp -118.36 148.63 21.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.47 1.106 . . . . 0.0 109.298 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.857 HD13 HD13 ' A' ' 182' ' ' ILE . 1.3 mt -147.14 138.78 24.17 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.527 1.142 . . . . 0.0 109.307 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.56 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.8 OUTLIER -87.63 106.2 17.86 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.572 1.17 . . . . 0.0 110.272 -179.95 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.873 ' CD1' ' HB2' ' A' ' 172' ' ' ALA . 2.2 mm -82.98 125.98 40.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.486 1.116 . . . . 0.0 109.268 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 10.5 ttt180 -127.62 -26.21 3.02 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.524 1.14 . . . . 0.0 110.277 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 163' ' ' ASP . . . . . 0.491 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -126.65 140.52 52.35 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.55 1.156 . . . . 0.0 109.344 179.981 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.5 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 1.7 mtmt -146.32 63.4 8.82 Favored Pre-proline 0 C--N 1.324 -0.502 0 O-C-N 124.487 1.117 . . . . 0.0 109.312 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 165' ' ' PRO . . . . . 0.43 ' HD3' ' N ' ' A' ' 164' ' ' LYS . 18.5 Cg_endo -74.98 6.96 3.07 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.491 1.785 . . . . 0.0 110.995 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 166' ' ' GLU . . . . . 0.467 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 5.5 mm-40 -135.66 176.04 9.04 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.557 1.16 . . . . 0.0 110.282 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 167' ' ' GLU . . . . . 0.539 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 4.2 mm-40 -113.73 35.79 3.92 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.539 1.149 . . . . 0.0 110.244 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.539 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 0.4 OUTLIER -174.93 -37.84 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.48 1.112 . . . . 0.0 110.361 179.974 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 169' ' ' TRP . . . . . 0.45 ' O ' ' HB2' ' A' ' 166' ' ' GLU . 76.6 m95 -113.56 104.77 12.59 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 170' ' ' TRP . . . . . 0.698 ' CE2' HG21 ' A' ' 184' ' ' VAL . 38.7 m0 -111.2 159.91 17.45 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.534 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 1.0 OUTLIER -96.91 114.3 25.91 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.43 1.081 . . . . 0.0 109.296 179.969 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 172' ' ' ALA . . . . . 1.04 ' HB3' HD12 ' A' ' 182' ' ' ILE . . . -128.64 167.69 16.83 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.506 1.128 . . . . 0.0 109.29 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.529 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 2.0 mp0 -97.48 157.28 16.09 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.48 1.112 . . . . 0.0 110.38 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 174' ' ' ASP . . . . . 0.453 ' OD1' ' N ' ' A' ' 177' ' ' GLY . 46.2 p-10 -95.14 -159.92 0.75 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.478 1.111 . . . . 0.0 109.291 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 44.6 t -81.32 12.29 3.71 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.562 1.163 . . . . 0.0 109.97 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -132.31 -3.72 3.44 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.443 1.09 . . . . 0.0 110.346 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.518 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 97.29 -12.25 65.17 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.494 1.122 . . . . 0.0 111.003 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 178' ' ' LYS . . . . . 0.45 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 0.1 OUTLIER -54.78 115.17 2.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.492 0.76 . . . . 0.0 109.306 -179.965 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 179' ' ' ARG . . . . . 0.435 ' HG2' ' CD ' ' A' ' 173' ' ' GLU . 0.3 OUTLIER -88.72 127.78 35.6 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.487 1.117 . . . . 0.0 110.286 -179.973 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.534 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -153.48 -171.77 21.0 Favored Glycine 0 CA--C 1.529 0.946 0 O-C-N 124.441 1.088 . . . . 0.0 111.019 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.4 135.34 33.53 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.492 0.76 . . . . 0.0 111.039 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 1.04 HD12 ' HB3' ' A' ' 172' ' ' ALA . 30.4 mt -134.09 137.67 28.77 Favored Pre-proline 0 C--N 1.325 -0.466 0 O-C-N 124.422 1.076 . . . . 0.0 109.315 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 183' ' ' PRO . . . . . 0.73 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.1 Cg_endo -75.03 121.87 6.84 Favored 'Trans proline' 0 C--N 1.36 1.152 0 O-C-N 124.508 1.794 . . . . 0.0 111.027 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.84 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 24.6 t -69.5 -29.32 1.75 Allowed Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.536 1.147 . . . . 0.0 109.26 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 185' ' ' PRO . . . . . 0.84 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.98 -23.68 13.6 Favored 'Trans proline' 0 C--N 1.359 1.09 0 O-C-N 124.538 1.81 . . . . 0.0 111.012 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.73 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.6 m-85 -99.42 -3.12 34.46 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.521 1.138 . . . . 0.0 111.0 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 187' ' ' VAL . . . . . 0.759 HG12 ' HA ' ' A' ' 139' ' ' ALA . 5.2 m -130.34 162.41 38.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.542 1.151 . . . . 0.0 109.265 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 188' ' ' GLU . . . . . 0.484 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 1.0 OUTLIER -110.67 158.2 18.87 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.583 1.177 . . . . 0.0 110.286 179.993 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.55 110.09 21.4 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.505 1.128 . . . . 0.0 109.274 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 190' ' ' TYR . . . . . 0.411 ' O ' ' HB2' ' A' ' 136' ' ' TYR . 41.3 t80 -161.48 126.02 3.44 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.491 1.119 . . . . 0.0 111.061 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 191' ' ' GLY . . . . . 0.575 ' HA3' ' CD2' ' A' ' 136' ' ' TYR . . . . . . . . 0 CA--C 1.531 1.037 0 O-C-N 124.567 1.167 . . . . 0.0 110.958 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' CYS . . . . . 0.43 ' O ' ' CD1' ' A' ' 136' ' ' TYR . 8.9 t . . . . . 0 N--CA 1.453 -0.296 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' TYR . . . . . 0.43 ' CD1' ' O ' ' A' ' 135' ' ' CYS . 36.3 m-85 -150.99 164.0 37.41 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.405 1.066 . . . . 0.0 111.062 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.754 HG12 ' HA ' ' A' ' 189' ' ' LYS . 15.4 m -138.61 165.72 24.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.573 1.171 . . . . 0.0 109.332 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.598 ' HA ' HD13 ' A' ' 158' ' ' ILE . 16.1 ttp180 -124.04 112.93 17.74 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.475 1.109 . . . . 0.0 110.321 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.554 ' O ' ' N ' ' A' ' 156' ' ' GLY . . . -83.36 103.93 13.12 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.498 1.123 . . . . 0.0 109.305 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.407 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 0.7 OUTLIER -88.87 27.82 1.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.449 1.093 . . . . 0.0 109.41 179.93 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.456 ' CD1' ' HA ' ' A' ' 186' ' ' TYR . 58.1 m-85 -147.86 151.3 35.69 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.497 1.123 . . . . 0.0 110.98 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -88.9 126.21 35.28 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.536 1.148 . . . . 0.0 109.317 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.626 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 3.0 t80 -130.3 145.12 51.73 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.445 1.09 . . . . 0.0 111.007 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 144' ' ' ASN . . . . . 0.515 ' O ' ' HB3' ' A' ' 152' ' ' PRO . 11.9 t-20 -114.11 -35.0 5.18 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.5 1.125 . . . . 0.0 109.264 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 145' ' ' GLY . . . . . 0.424 ' HA2' ' CG ' ' A' ' 150' ' ' ASP . . . 142.59 141.45 3.88 Favored Glycine 0 CA--C 1.53 1.025 0 O-C-N 124.522 1.139 . . . . 0.0 110.963 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 146' ' ' ASN . . . . . 0.459 ' CG ' ' N ' ' A' ' 147' ' ' ASP . 12.2 p-10 -128.29 -47.41 1.32 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.486 0.756 . . . . 0.0 109.215 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 147' ' ' ASP . . . . . 0.561 ' H ' ' HB3' ' A' ' 150' ' ' ASP . 7.7 p-10 -108.03 169.21 8.76 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.643 1.214 . . . . 0.0 109.351 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 54.8 tt0 -63.39 -40.54 97.49 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.478 1.111 . . . . 0.0 110.331 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' GLU . . . . . 0.424 ' C ' ' OD2' ' A' ' 147' ' ' ASP . 38.1 mt-10 -94.82 23.56 5.39 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.47 1.107 . . . . 0.0 110.312 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.561 ' HB3' ' H ' ' A' ' 147' ' ' ASP . 0.6 OUTLIER -74.77 159.59 31.79 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.527 1.142 . . . . 0.0 109.353 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.753 HD23 ' CG2' ' A' ' 182' ' ' ILE . 15.8 tp -125.03 108.57 27.8 Favored Pre-proline 0 C--N 1.325 -0.48 0 O-C-N 124.491 1.12 . . . . 0.0 109.31 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 152' ' ' PRO . . . . . 0.515 ' HB3' ' O ' ' A' ' 144' ' ' ASN . 18.3 Cg_endo -75.03 162.34 37.22 Favored 'Trans proline' 0 C--N 1.36 1.168 0 O-C-N 124.465 1.771 . . . . 0.0 110.984 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.626 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 17.9 p90 -178.69 177.32 0.89 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.478 1.111 . . . . 0.0 111.01 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.57 140.7 49.48 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.512 1.132 . . . . 0.0 109.311 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 155' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.1 OUTLIER -45.28 131.01 8.18 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.527 1.142 . . . . 0.0 109.313 179.887 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 85.85 22.71 48.63 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 124.441 1.088 . . . . 0.0 111.002 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 157' ' ' ASP . . . . . 0.407 ' O ' HD13 ' A' ' 158' ' ' ILE . 30.9 t70 -99.07 167.9 10.42 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.504 0.767 . . . . 0.0 109.269 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.598 HD13 ' HA ' ' A' ' 138' ' ' ARG . 51.5 mm -120.72 146.89 24.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.567 1.167 . . . . 0.0 109.306 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.632 HD13 ' CG2' ' A' ' 182' ' ' ILE . 0.9 OUTLIER -136.92 138.45 40.66 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.432 1.082 . . . . 0.0 109.347 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.42 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 5.0 mtm180 -87.67 96.41 10.42 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.513 1.133 . . . . 0.0 110.311 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.853 HD11 ' HD2' ' A' ' 164' ' ' LYS . 0.0 OUTLIER -84.44 125.85 40.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.431 1.082 . . . . 0.0 109.296 -179.951 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 162' ' ' ARG . . . . . 0.453 ' CG ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -119.04 -21.76 7.54 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.58 1.175 . . . . 0.0 110.322 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 163' ' ' ASP . . . . . 0.634 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -136.6 149.87 48.26 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.472 1.107 . . . . 0.0 109.307 -179.993 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.853 ' HD2' HD11 ' A' ' 161' ' ' ILE . 0.0 OUTLIER -155.48 74.17 5.35 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.488 1.118 . . . . 0.0 109.312 179.981 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 -38.34 1.64 Allowed 'Trans proline' 0 C--N 1.359 1.108 0 O-C-N 124.51 1.795 . . . . 0.0 111.086 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 166' ' ' GLU . . . . . 0.446 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.5 mm-40 -85.69 171.49 11.59 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.545 1.153 . . . . 0.0 110.271 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -110.49 50.42 0.81 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.589 1.181 . . . . 0.0 110.336 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 170.66 -32.19 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.435 1.085 . . . . 0.0 110.259 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -120.65 100.54 7.18 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.514 1.133 . . . . 0.0 107.974 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 170' ' ' TRP . . . . . 0.686 ' CE2' HG21 ' A' ' 184' ' ' VAL . 40.8 m0 -105.8 164.26 12.07 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.492 1.12 . . . . 0.0 107.991 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.449 ' HB3' ' OD1' ' A' ' 163' ' ' ASP . 1.6 m-20 -98.91 114.08 26.52 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.441 1.088 . . . . 0.0 109.343 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 172' ' ' ALA . . . . . 0.654 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -139.0 166.31 24.83 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.466 1.103 . . . . 0.0 109.288 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.558 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 2.1 mp0 -95.8 157.45 15.89 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.493 1.121 . . . . 0.0 110.369 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 174' ' ' ASP . . . . . 0.517 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.1 OUTLIER -89.84 -163.46 1.01 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.515 1.135 . . . . 0.0 109.32 -179.993 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 60.8 p -80.31 9.65 5.53 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.489 1.118 . . . . 0.0 110.024 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -131.08 -4.92 3.91 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.522 1.139 . . . . 0.0 110.31 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.509 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 103.14 -11.45 55.39 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 124.53 1.144 . . . . 0.0 111.008 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 178' ' ' LYS . . . . . 0.627 ' O ' HD11 ' A' ' 151' ' ' LEU . 2.6 mttt -52.51 111.7 0.69 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.483 0.755 . . . . 0.0 109.286 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 179' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 179' ' ' ARG . 0.1 OUTLIER -88.79 123.51 33.26 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.451 1.094 . . . . 0.0 110.291 -179.981 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.446 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -155.57 -161.8 10.88 Favored Glycine 0 CA--C 1.531 1.034 0 O-C-N 124.535 1.147 . . . . 0.0 110.991 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.9 mmt -93.73 116.11 28.58 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.506 0.768 . . . . 0.0 110.956 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.884 HD13 HG21 ' A' ' 187' ' ' VAL . 2.2 pp -103.48 132.28 21.24 Favored Pre-proline 0 C--N 1.324 -0.518 0 O-C-N 124.551 1.157 . . . . 0.0 109.259 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 183' ' ' PRO . . . . . 0.834 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.6 Cg_endo -74.99 123.39 7.85 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.521 1.801 . . . . 0.0 111.025 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.838 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 69.7 t -71.36 -30.57 1.65 Allowed Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.464 1.102 . . . . 0.0 109.261 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 185' ' ' PRO . . . . . 0.838 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.99 -28.22 9.36 Favored 'Trans proline' 0 C--N 1.36 1.143 0 O-C-N 124.547 1.814 . . . . 0.0 110.988 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.618 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.8 m-85 -99.47 -5.07 30.01 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.47 1.106 . . . . 0.0 110.921 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 187' ' ' VAL . . . . . 0.884 HG21 HD13 ' A' ' 182' ' ' ILE . 1.5 m -132.13 162.96 38.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.492 1.12 . . . . 0.0 109.269 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 188' ' ' GLU . . . . . 0.471 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 3.8 tt0 -111.82 147.97 34.59 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.5 1.125 . . . . 0.0 110.32 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 189' ' ' LYS . . . . . 0.754 ' HA ' HG12 ' A' ' 137' ' ' VAL . 3.4 ptpp? -88.23 103.15 15.52 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.533 1.145 . . . . 0.0 109.284 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 190' ' ' TYR . . . . . 0.421 ' HB3' ' O ' ' A' ' 136' ' ' TYR . 20.7 t80 -88.54 -31.17 18.81 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.568 1.167 . . . . 0.0 110.96 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.962 0 O-C-N 124.474 1.109 . . . . 0.0 110.982 -179.984 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 135' ' ' CYS . . . . . 0.637 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 20.4 p . . . . . 0 N--CA 1.452 -0.364 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' TYR . . . . . 0.637 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 27.1 m-85 -149.8 157.32 43.09 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.561 1.163 . . . . 0.0 111.0 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.595 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 21.9 m -136.65 137.59 47.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.568 1.168 . . . . 0.0 109.234 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.59 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 7.1 ttt180 -101.51 111.01 23.12 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.444 1.09 . . . . 0.0 110.285 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.599 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -80.55 110.77 16.34 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.453 1.096 . . . . 0.0 109.349 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.663 HD13 ' H ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -88.23 19.01 3.94 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.526 1.141 . . . . 0.0 109.296 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -141.7 172.2 13.01 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.541 1.15 . . . . 0.0 110.979 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -109.93 156.08 20.9 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.492 1.12 . . . . 0.0 109.283 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.585 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 65.3 t80 -175.3 104.42 0.08 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.572 1.17 . . . . 0.0 110.985 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 16.9 p-10 -129.01 87.7 2.6 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.523 1.139 . . . . 0.0 109.318 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -131.04 -131.5 3.29 Favored Glycine 0 CA--C 1.531 1.042 0 O-C-N 124.509 1.131 . . . . 0.0 110.99 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 164.99 88.71 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.514 0.773 . . . . 0.0 109.343 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.2 -60.73 1.82 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.412 1.07 . . . . 0.0 109.353 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 177.87 -43.39 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.486 1.116 . . . . 0.0 110.286 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 181' ' ' MET . 54.9 mt-10 -130.14 13.2 5.66 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.469 1.105 . . . . 0.0 110.309 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.18 155.72 24.81 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.478 1.111 . . . . 0.0 109.353 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.578 HD22 ' O ' ' A' ' 172' ' ' ALA . 24.8 tp -119.75 115.46 33.59 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.425 1.078 . . . . 0.0 109.316 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 152' ' ' PRO . . . . . 0.462 ' HA ' ' O ' ' A' ' 143' ' ' PHE . 18.3 Cg_endo -75.02 157.84 42.47 Favored 'Trans proline' 0 C--N 1.359 1.122 0 O-C-N 124.527 1.804 . . . . 0.0 110.952 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.585 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 25.8 p90 -166.43 -175.53 3.26 Favored 'General case' 0 C--N 1.327 -0.412 0 O-C-N 124.449 1.093 . . . . 0.0 110.95 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 154' ' ' LYS . . . . . 0.52 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -138.55 132.3 30.91 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.574 1.171 . . . . 0.0 109.326 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 155' ' ' LYS . . . . . 0.52 ' C ' ' O ' ' A' ' 154' ' ' LYS . 5.8 ttmt -31.15 130.76 0.11 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.526 1.141 . . . . 0.0 109.252 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 72.85 42.24 46.43 Favored Glycine 0 CA--C 1.53 1.005 0 O-C-N 124.496 1.123 . . . . 0.0 111.033 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 157' ' ' ASP . . . . . 0.716 ' C ' HD12 ' A' ' 158' ' ' ILE . 15.5 t70 -111.21 167.49 10.24 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.502 0.766 . . . . 0.0 109.305 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.716 HD12 ' C ' ' A' ' 157' ' ' ASP . 1.8 mp -122.81 146.16 28.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 O-C-N 124.499 1.124 . . . . 0.0 109.23 -179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.651 ' CD1' HD13 ' A' ' 182' ' ' ILE . 0.6 OUTLIER -142.07 138.69 31.92 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.481 1.113 . . . . 0.0 109.323 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.464 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.3 OUTLIER -91.49 105.07 17.49 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.522 1.139 . . . . 0.0 110.281 -179.976 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.808 HD11 ' HG2' ' A' ' 164' ' ' LYS . 0.0 OUTLIER -85.79 126.48 40.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.469 1.105 . . . . 0.0 109.324 179.983 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.08 -25.92 6.08 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.52 1.137 . . . . 0.0 110.327 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 163' ' ' ASP . . . . . 0.605 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -137.23 157.4 46.74 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.532 1.145 . . . . 0.0 109.28 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.808 ' HG2' HD11 ' A' ' 161' ' ' ILE . 5.5 mttt -142.66 78.82 15.67 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.526 1.141 . . . . 0.0 109.268 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.06 10.1 1.84 Allowed 'Trans proline' 0 C--N 1.36 1.141 0 O-C-N 124.528 1.804 . . . . 0.0 110.984 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 166' ' ' GLU . . . . . 0.402 ' H ' ' C ' ' A' ' 164' ' ' LYS . 26.1 mt-10 -151.06 174.39 13.23 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.545 1.153 . . . . 0.0 110.261 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -99.07 7.98 45.38 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.505 1.128 . . . . 0.0 110.287 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.508 ' O ' ' N ' ' A' ' 184' ' ' VAL . 57.5 mt-30 -147.99 -45.11 0.16 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.582 1.176 . . . . 0.0 110.34 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -98.45 96.89 8.31 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 170' ' ' TRP . . . . . 0.975 ' CE2' HG21 ' A' ' 184' ' ' VAL . 31.5 m0 -102.06 154.82 18.62 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.521 1.138 . . . . 0.0 107.964 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.448 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -88.2 111.13 21.29 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.463 1.102 . . . . 0.0 109.325 179.933 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 172' ' ' ALA . . . . . 0.578 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -134.92 166.65 22.52 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.487 1.117 . . . . 0.0 109.251 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.57 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.6 OUTLIER -96.31 155.48 16.75 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.554 1.159 . . . . 0.0 110.291 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 174' ' ' ASP . . . . . 0.492 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.7 OUTLIER -94.57 -162.08 0.91 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.442 1.089 . . . . 0.0 109.263 -179.984 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 38.1 m -79.33 7.23 8.21 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.476 1.11 . . . . 0.0 109.978 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 176' ' ' GLU . . . . . 0.418 ' HB2' ' HG2' ' A' ' 178' ' ' LYS . 2.6 mt-10 -125.72 -4.92 7.02 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.548 1.155 . . . . 0.0 110.291 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.508 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 96.7 -12.0 66.22 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.5 1.125 . . . . 0.0 111.032 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 178' ' ' LYS . . . . . 0.481 ' O ' HD11 ' A' ' 151' ' ' LEU . 0.1 OUTLIER -57.48 114.9 2.43 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.467 0.745 . . . . 0.0 109.29 -179.954 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 179' ' ' ARG . . . . . 0.452 ' HG3' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -88.94 127.34 35.65 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.52 1.137 . . . . 0.0 110.307 -179.992 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.448 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -153.42 -169.74 18.81 Favored Glycine 0 CA--C 1.53 0.998 0 O-C-N 124.422 1.077 . . . . 0.0 111.001 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 181' ' ' MET . . . . . 0.45 ' N ' ' O ' ' A' ' 149' ' ' GLU . 1.9 mmt -93.55 116.38 28.89 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 124.47 0.747 . . . . 0.0 111.04 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.651 HD13 ' CD1' ' A' ' 159' ' ' LEU . 1.3 tp -117.12 141.37 28.37 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.492 1.12 . . . . 0.0 109.255 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 183' ' ' PRO . . . . . 0.755 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.07 128.92 11.81 Favored 'Trans proline' 0 C--N 1.361 1.186 0 O-C-N 124.492 1.786 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.975 HG21 ' CE2' ' A' ' 170' ' ' TRP . 10.4 t -72.75 -28.8 1.06 Allowed Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.472 1.108 . . . . 0.0 109.277 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 185' ' ' PRO . . . . . 0.854 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -75.02 -17.56 19.39 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.473 1.775 . . . . 0.0 110.989 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.755 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 9.9 m-85 -100.78 -6.63 24.63 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.524 1.14 . . . . 0.0 111.021 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 187' ' ' VAL . . . . . 0.599 HG12 ' HA ' ' A' ' 139' ' ' ALA . 2.6 m -133.98 157.68 42.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.568 1.168 . . . . 0.0 109.292 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 188' ' ' GLU . . . . . 0.595 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 1.3 tm-20 -98.78 152.62 19.49 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.508 1.13 . . . . 0.0 110.293 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 9.3 mtmm -88.99 106.82 18.68 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.573 1.17 . . . . 0.0 109.273 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -90.91 -38.2 13.05 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.52 1.137 . . . . 0.0 111.05 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 191' ' ' GLY . . . . . 0.489 ' O ' ' SG ' ' A' ' 135' ' ' CYS . . . . . . . . 0 CA--C 1.53 0.997 0 O-C-N 124.548 1.155 . . . . 0.0 111.04 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.452 -0.334 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 136' ' ' TYR . . . . . 0.425 ' HA ' ' O ' ' A' ' 159' ' ' LEU . 89.0 m-85 -138.54 178.73 6.93 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.448 1.093 . . . . 0.0 111.015 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.659 HG23 HD12 ' A' ' 159' ' ' LEU . 33.5 m -145.33 139.1 21.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.571 1.169 . . . . 0.0 109.271 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.644 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 12.2 ttm180 -101.35 114.84 29.2 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.442 1.089 . . . . 0.0 110.285 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.49 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -82.86 109.72 17.24 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.476 1.11 . . . . 0.0 109.279 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.804 HD22 ' H ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -89.92 23.97 2.58 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.511 1.132 . . . . 0.0 109.28 179.995 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.42 ' CA ' ' HG2' ' A' ' 155' ' ' LYS . 39.8 m-85 -143.82 155.47 44.14 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.48 1.113 . . . . 0.0 111.002 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.31 126.48 40.65 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.545 1.153 . . . . 0.0 109.339 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.578 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.6 OUTLIER -137.98 123.1 19.19 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.485 1.115 . . . . 0.0 110.981 -179.944 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 144' ' ' ASN . . . . . 0.503 ' C ' ' HB3' ' A' ' 152' ' ' PRO . 3.0 m-20 -86.23 -42.49 13.74 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.522 1.139 . . . . 0.0 109.35 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 126.31 138.22 4.8 Favored Glycine 0 CA--C 1.529 0.91 0 O-C-N 124.481 1.113 . . . . 0.0 111.056 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -114.05 -34.62 5.33 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.427 0.722 . . . . 0.0 109.311 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -136.59 165.57 25.56 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.48 1.113 . . . . 0.0 109.329 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -83.02 37.66 0.55 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.497 1.123 . . . . 0.0 110.24 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -133.68 -27.1 1.53 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.511 1.132 . . . . 0.0 110.267 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.58 122.31 38.19 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.508 1.13 . . . . 0.0 109.3 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.801 ' HB3' HG23 ' A' ' 182' ' ' ILE . 7.7 tp -76.05 114.27 35.72 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 124.532 1.145 . . . . 0.0 109.345 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 152' ' ' PRO . . . . . 0.503 ' HB3' ' C ' ' A' ' 144' ' ' ASN . 18.3 Cg_endo -74.99 -178.18 3.98 Favored 'Trans proline' 0 C--N 1.359 1.089 0 O-C-N 124.551 1.816 . . . . 0.0 111.012 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.578 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 1.6 p90 173.19 -177.89 0.07 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.53 1.144 . . . . 0.0 111.024 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 154' ' ' LYS . . . . . 0.416 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.4 OUTLIER -119.93 138.45 53.44 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.515 1.134 . . . . 0.0 109.301 179.98 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 155' ' ' LYS . . . . . 0.515 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.1 OUTLIER -39.06 123.94 1.39 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.469 1.106 . . . . 0.0 109.291 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.478 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 83.98 38.61 10.11 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.522 1.139 . . . . 0.0 110.999 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 157' ' ' ASP . . . . . 0.425 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 17.0 t70 -108.52 169.04 8.9 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.521 0.777 . . . . 0.0 109.301 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.49 ' C ' ' HG ' ' A' ' 159' ' ' LEU . 8.4 mm -122.22 149.41 25.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 O-C-N 124.472 1.107 . . . . 0.0 109.346 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.778 HD13 HG21 ' A' ' 182' ' ' ILE . 0.2 OUTLIER -143.78 141.21 30.31 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.543 1.152 . . . . 0.0 109.314 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.535 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.1 OUTLIER -86.66 96.73 10.23 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.456 1.098 . . . . 0.0 110.278 -179.97 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.86 HD11 ' HB2' ' A' ' 170' ' ' TRP . 0.2 OUTLIER -82.71 125.61 39.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.41 1.069 . . . . 0.0 109.281 179.995 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -124.39 -22.06 4.78 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.476 1.11 . . . . 0.0 110.306 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 163' ' ' ASP . . . . . 0.481 ' C ' ' HG3' ' A' ' 164' ' ' LYS . 71.2 m-20 -125.46 125.31 43.12 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.52 1.137 . . . . 0.0 109.365 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.602 ' HE3' HG21 ' A' ' 161' ' ' ILE . 2.2 mtpt -136.47 63.08 46.53 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.559 1.162 . . . . 0.0 109.277 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 165' ' ' PRO . . . . . 0.442 ' HD3' ' N ' ' A' ' 164' ' ' LYS . 18.2 Cg_endo -75.03 -50.89 0.12 Allowed 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.508 1.794 . . . . 0.0 110.967 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 166' ' ' GLU . . . . . 0.511 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 0.6 OUTLIER -73.2 177.32 5.17 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.49 1.119 . . . . 0.0 110.359 179.979 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -117.81 47.57 1.53 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.566 1.166 . . . . 0.0 110.292 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 174.87 -32.56 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.491 1.119 . . . . 0.0 110.3 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 169' ' ' TRP . . . . . 0.579 ' CE3' ' HG2' ' A' ' 181' ' ' MET . 70.0 m95 -119.1 104.92 10.9 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.493 1.121 . . . . 0.0 108.01 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 170' ' ' TRP . . . . . 0.86 ' HB2' HD11 ' A' ' 161' ' ' ILE . 53.9 m0 -110.63 154.56 23.62 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.504 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 2.6 t30 -95.26 117.86 31.01 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.434 1.084 . . . . 0.0 109.326 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 172' ' ' ALA . . . . . 0.794 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -141.03 161.42 37.9 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.476 1.11 . . . . 0.0 109.28 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.613 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.8 OUTLIER -90.54 155.63 18.75 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.45 1.094 . . . . 0.0 110.326 -179.966 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 174' ' ' ASP . . . . . 0.651 ' N ' HD21 ' A' ' 151' ' ' LEU . 0.4 OUTLIER -90.08 -161.41 0.79 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.449 1.093 . . . . 0.0 109.308 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 5.6 t -81.21 12.7 3.3 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.507 1.129 . . . . 0.0 109.994 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -132.23 -6.26 3.41 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.567 1.167 . . . . 0.0 110.318 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.521 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 101.62 -12.98 58.15 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.476 1.11 . . . . 0.0 111.007 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 178' ' ' LYS . . . . . 0.588 ' O ' HD11 ' A' ' 151' ' ' LEU . 2.7 mtmt -52.75 113.28 1.03 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.545 0.791 . . . . 0.0 109.322 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 179' ' ' ARG . . . . . 0.466 ' CG ' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -89.24 125.02 34.91 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 124.531 1.145 . . . . 0.0 110.327 -179.979 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.504 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.42 -165.96 14.5 Favored Glycine 0 CA--C 1.53 1.021 0 O-C-N 124.529 1.143 . . . . 0.0 110.954 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 181' ' ' MET . . . . . 0.579 ' HG2' ' CE3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -101.88 125.85 48.64 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.529 0.782 . . . . 0.0 111.004 179.976 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.843 ' O ' HD12 ' A' ' 182' ' ' ILE . 2.2 pp -121.89 149.3 53.34 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.54 1.15 . . . . 0.0 109.292 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 183' ' ' PRO . . . . . 0.894 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -74.95 125.87 9.63 Favored 'Trans proline' 0 C--N 1.359 1.124 0 O-C-N 124.591 1.837 . . . . 0.0 110.966 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.852 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 55.4 t -68.98 -29.43 1.91 Allowed Pre-proline 0 C--N 1.326 -0.436 0 O-C-N 124.492 1.12 . . . . 0.0 109.265 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 185' ' ' PRO . . . . . 0.852 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -75.04 -24.28 12.9 Favored 'Trans proline' 0 C--N 1.359 1.079 0 O-C-N 124.542 1.812 . . . . 0.0 110.995 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.894 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.0 m-85 -99.58 -0.18 40.97 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.525 1.141 . . . . 0.0 110.965 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 187' ' ' VAL . . . . . 0.65 HG22 ' O ' ' A' ' 183' ' ' PRO . 4.2 m -134.03 154.96 38.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 O-C-N 124.464 1.102 . . . . 0.0 109.313 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 188' ' ' GLU . . . . . 0.539 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.2 OUTLIER -106.11 159.53 16.01 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 0.0 110.275 -179.991 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.69 110.72 21.21 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 124.509 1.13 . . . . 0.0 109.32 180.0 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -83.32 -56.89 3.51 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.505 1.128 . . . . 0.0 110.995 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.011 0 O-C-N 124.497 1.123 . . . . 0.0 110.98 -179.988 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 10.4 p . . . . . 0 N--CA 1.453 -0.319 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 136' ' ' TYR . . . . . 0.427 ' HB2' ' O ' ' A' ' 191' ' ' GLY . 43.0 m-85 -155.88 165.52 36.22 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.515 1.135 . . . . 0.0 111.013 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 159' ' ' LEU . 19.8 m -142.86 147.02 21.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.58 1.175 . . . . 0.0 109.27 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.719 ' O ' HD13 ' A' ' 140' ' ' LEU . 0.1 OUTLIER -103.08 111.55 23.96 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.523 1.139 . . . . 0.0 110.285 -179.981 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.57 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -82.12 104.39 12.42 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.501 1.126 . . . . 0.0 109.336 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.719 HD13 ' O ' ' A' ' 138' ' ' ARG . 0.0 OUTLIER -88.74 24.27 2.07 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.564 1.165 . . . . 0.0 109.33 -179.998 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.497 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 9.6 m-85 -146.93 145.86 29.93 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.485 1.116 . . . . 0.0 110.989 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.6 152.26 22.75 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.57 1.169 . . . . 0.0 109.285 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.57 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.3 OUTLIER -168.48 126.56 1.1 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.434 1.084 . . . . 0.0 110.959 179.956 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 144' ' ' ASN . . . . . 0.459 ' HA ' ' CB ' ' A' ' 152' ' ' PRO . 15.1 t-20 -142.01 87.0 2.01 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.394 1.059 . . . . 0.0 109.307 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 104.22 121.72 4.97 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.495 1.122 . . . . 0.0 111.026 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' ASN . . . . . 0.482 ' HB2' ' CE1' ' A' ' 143' ' ' PHE . 40.0 t30 -146.35 -62.32 0.31 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.494 0.761 . . . . 0.0 109.326 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -144.77 -175.88 4.85 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.526 1.141 . . . . 0.0 109.338 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -87.05 35.56 0.7 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.433 1.083 . . . . 0.0 110.348 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -176.39 32.78 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.485 1.116 . . . . 0.0 110.283 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.601 ' OD2' ' CZ3' ' A' ' 169' ' ' TRP . 3.2 t70 -117.3 139.87 50.27 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.521 1.138 . . . . 0.0 109.326 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.841 ' O ' HG22 ' A' ' 182' ' ' ILE . 8.8 tp -100.55 107.34 48.03 Favored Pre-proline 0 C--N 1.325 -0.483 0 O-C-N 124.455 1.097 . . . . 0.0 109.258 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 152' ' ' PRO . . . . . 0.459 ' CB ' ' HA ' ' A' ' 144' ' ' ASN . 18.2 Cg_endo -75.08 179.03 6.51 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.491 1.785 . . . . 0.0 111.035 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.57 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 0.4 OUTLIER -177.58 -171.81 0.33 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.43 1.081 . . . . 0.0 111.033 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.82 139.96 53.44 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.545 1.153 . . . . 0.0 109.287 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 155' ' ' LYS . . . . . 0.494 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -44.26 115.53 0.86 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.543 1.152 . . . . 0.0 109.312 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.443 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 93.35 43.73 3.93 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 124.605 1.191 . . . . 0.0 111.025 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -115.53 170.94 8.05 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.458 0.74 . . . . 0.0 109.295 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 158' ' ' ILE . . . . . 0.529 HD13 ' HA ' ' A' ' 138' ' ' ARG . 48.8 mm -120.66 144.99 27.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.529 1.143 . . . . 0.0 109.376 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.648 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 0.5 OUTLIER -140.88 133.74 29.03 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.497 1.123 . . . . 0.0 109.286 -179.91 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.481 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 8.5 ttp85 -89.83 106.85 18.75 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.484 1.115 . . . . 0.0 110.298 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.711 ' C ' HD12 ' A' ' 161' ' ' ILE . 0.5 OUTLIER -83.42 127.8 39.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 124.468 1.105 . . . . 0.0 109.259 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.47 -20.59 6.01 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 124.498 1.124 . . . . 0.0 110.275 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 163' ' ' ASP . . . . . 0.447 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 3.7 m-20 -135.63 148.76 49.11 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.517 1.135 . . . . 0.0 109.343 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.569 ' HG3' ' CE2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -145.68 76.36 12.92 Favored Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.36 1.038 . . . . 0.0 109.334 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -74.89 -46.95 0.22 Allowed 'Trans proline' 0 C--N 1.36 1.183 0 O-C-N 124.504 1.792 . . . . 0.0 111.049 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 166' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -91.17 173.87 7.7 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.416 1.072 . . . . 0.0 110.278 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 167' ' ' GLU . . . . . 0.458 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 1.6 mm-40 -104.04 36.43 2.35 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.453 1.096 . . . . 0.0 110.358 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 184' ' ' VAL . 3.3 mt-30 -173.09 -39.06 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.58 1.175 . . . . 0.0 110.312 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 169' ' ' TRP . . . . . 0.601 ' CZ3' ' OD2' ' A' ' 150' ' ' ASP . 85.6 m95 -109.66 98.6 7.92 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.527 1.142 . . . . 0.0 107.994 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 170' ' ' TRP . . . . . 0.986 ' CE2' HG21 ' A' ' 184' ' ' VAL . 20.7 m0 -105.01 160.04 15.34 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.5 1.125 . . . . 0.0 108.041 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.57 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -92.02 112.16 23.99 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.53 1.144 . . . . 0.0 109.283 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 172' ' ' ALA . . . . . 0.635 ' HB2' HG22 ' A' ' 161' ' ' ILE . . . -135.0 164.17 28.23 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.575 1.172 . . . . 0.0 109.283 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.648 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 18.6 mp0 -95.02 157.87 15.71 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.481 1.113 . . . . 0.0 110.229 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 174' ' ' ASP . . . . . 0.808 ' CG ' HD11 ' A' ' 151' ' ' LEU . 0.4 OUTLIER -90.21 -158.89 0.56 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.564 1.165 . . . . 0.0 109.295 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 24.6 m -83.34 10.67 8.1 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.539 1.15 . . . . 0.0 109.958 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -133.61 -5.23 2.89 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.553 1.158 . . . . 0.0 110.294 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 177' ' ' GLY . . . . . 0.527 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 106.58 -17.59 39.29 Favored Glycine 0 CA--C 1.53 1.031 0 O-C-N 124.502 1.126 . . . . 0.0 110.983 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 178' ' ' LYS . . . . . 0.514 ' O ' HD22 ' A' ' 151' ' ' LEU . 0.6 OUTLIER -42.87 109.43 0.14 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.495 0.762 . . . . 0.0 109.336 179.956 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 179' ' ' ARG . . . . . 0.472 ' HG2' ' OE2' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -91.3 123.19 34.55 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.494 1.121 . . . . 0.0 110.278 -179.986 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.57 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -157.25 -162.89 11.93 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.5 1.125 . . . . 0.0 110.998 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 41.5 mtp -104.78 120.75 42.12 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.446 0.733 . . . . 0.0 110.999 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.841 HG22 ' O ' ' A' ' 151' ' ' LEU . 2.5 pp -120.88 150.89 53.93 Favored Pre-proline 0 C--N 1.325 -0.47 0 O-C-N 124.489 1.118 . . . . 0.0 109.369 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 183' ' ' PRO . . . . . 0.775 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.02 131.27 14.07 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.451 1.764 . . . . 0.0 110.995 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.986 HG21 ' CE2' ' A' ' 170' ' ' TRP . 53.9 t -74.43 -28.98 0.9 Allowed Pre-proline 0 C--N 1.324 -0.521 0 O-C-N 124.509 1.131 . . . . 0.0 109.272 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 185' ' ' PRO . . . . . 0.868 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.2 Cg_endo -74.99 -19.25 18.05 Favored 'Trans proline' 0 C--N 1.361 1.191 0 O-C-N 124.442 1.759 . . . . 0.0 111.026 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.775 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 8.5 m-85 -98.57 -1.36 41.22 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.532 1.145 . . . . 0.0 110.997 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 187' ' ' VAL . . . . . 0.57 HG12 ' HA ' ' A' ' 139' ' ' ALA . 7.5 m -134.68 156.37 39.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 124.534 1.146 . . . . 0.0 109.26 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 188' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 1.5 pp20? -108.55 168.12 9.55 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.489 1.118 . . . . 0.0 110.274 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 189' ' ' LYS . . . . . 0.417 ' O ' ' OE2' ' A' ' 188' ' ' GLU . 0.1 OUTLIER -86.75 116.09 24.62 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.555 1.159 . . . . 0.0 109.244 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -108.2 -34.43 6.84 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.486 1.116 . . . . 0.0 110.987 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 191' ' ' GLY . . . . . 0.427 ' O ' ' HB2' ' A' ' 136' ' ' TYR . . . . . . . . 0 CA--C 1.529 0.96 0 O-C-N 124.567 1.167 . . . . 0.0 110.99 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.452 -0.329 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . 0.558 ' CE2' ' HB2' ' A' ' 160' ' ' ARG . 80.2 m-85 -152.71 169.23 23.24 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.541 1.15 . . . . 0.0 110.996 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.567 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 26.8 m -145.54 148.41 17.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.487 1.117 . . . . 0.0 109.306 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.504 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 5.6 ttp180 -104.34 111.47 24.12 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.514 1.134 . . . . 0.0 110.314 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.483 ' CB ' HG12 ' A' ' 187' ' ' VAL . . . -80.18 107.05 12.66 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.508 1.13 . . . . 0.0 109.34 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.404 ' O ' ' HG2' ' A' ' 155' ' ' LYS . 1.1 mt -88.33 21.8 2.72 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.5 1.125 . . . . 0.0 109.287 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.507 ' CD1' ' HA ' ' A' ' 186' ' ' TYR . 72.3 m-85 -141.55 138.86 32.99 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.487 1.117 . . . . 0.0 111.01 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.28 153.46 25.85 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.469 1.105 . . . . 0.0 109.319 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.597 ' HB3' ' CE1' ' A' ' 153' ' ' PHE . 4.7 t80 . . . . . 0 C--N 1.325 -0.49 0 O-C-N 124.505 1.128 . . . . 0.0 110.991 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.762 HD23 ' CG1' ' A' ' 182' ' ' ILE . 34.7 tp . . . . . 0 N--CA 1.453 -0.305 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . 0.596 ' HD2' HD12 ' A' ' 151' ' ' LEU . 18.4 Cg_endo -75.03 170.2 20.93 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.535 1.808 . . . . 0.0 111.029 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.597 ' CE1' ' HB3' ' A' ' 143' ' ' PHE . 0.7 OUTLIER -173.83 -175.59 1.1 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.502 1.126 . . . . 0.0 110.966 -179.996 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . 0.439 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -131.56 135.87 47.36 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.505 1.128 . . . . 0.0 109.313 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' LYS . . . . . 0.439 ' C ' ' O ' ' A' ' 154' ' ' LYS . 0.0 OUTLIER -37.54 110.88 0.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.511 1.132 . . . . 0.0 109.353 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 94.79 42.41 3.86 Favored Glycine 0 CA--C 1.529 0.955 0 O-C-N 124.496 1.122 . . . . 0.0 110.999 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . 0.431 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 17.6 t70 -111.68 165.88 11.65 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.496 0.762 . . . . 0.0 109.339 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.465 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 4.9 mp -119.89 140.16 44.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.504 1.128 . . . . 0.0 109.338 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.742 HD13 HD12 ' A' ' 182' ' ' ILE . 0.8 OUTLIER -137.07 134.64 36.72 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.5 1.125 . . . . 0.0 109.297 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.558 ' HB2' ' CE2' ' A' ' 136' ' ' TYR . 10.0 ttm180 -87.1 104.07 15.99 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.507 1.129 . . . . 0.0 110.28 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' ILE . . . . . 0.795 HG22 ' HB2' ' A' ' 172' ' ' ALA . 0.8 OUTLIER -84.62 125.93 40.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.44 1.088 . . . . 0.0 109.286 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 5.9 ptt180 -121.43 -24.94 5.28 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.45 1.094 . . . . 0.0 110.279 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' ASP . . . . . 0.446 ' HB2' ' CB ' ' A' ' 171' ' ' ASN . 79.2 m-20 -126.4 131.82 51.66 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.471 1.107 . . . . 0.0 109.261 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . 0.548 ' CG ' HD13 ' A' ' 161' ' ' ILE . 0.0 OUTLIER -133.46 69.62 76.96 Favored Pre-proline 0 C--N 1.325 -0.466 0 O-C-N 124.473 1.108 . . . . 0.0 109.248 179.998 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.02 -52.15 0.11 Allowed 'Trans proline' 0 C--N 1.359 1.12 0 O-C-N 124.512 1.796 . . . . 0.0 111.002 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 166' ' ' GLU . . . . . 0.444 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 4.1 mm-40 -76.73 175.1 9.71 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.478 1.111 . . . . 0.0 110.267 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . 0.522 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 3.3 pt-20 -106.56 31.69 5.05 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.467 1.104 . . . . 0.0 110.321 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.522 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 3.1 mt-30 -172.35 -40.17 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.475 1.11 . . . . 0.0 110.316 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -106.04 104.57 14.3 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 0.0 107.981 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 170' ' ' TRP . . . . . 0.704 ' CE2' HG21 ' A' ' 184' ' ' VAL . 50.1 m0 -109.45 154.6 22.4 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.527 1.142 . . . . 0.0 107.988 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . 0.468 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 1.0 OUTLIER -88.25 111.06 21.24 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.503 1.127 . . . . 0.0 109.355 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . 0.795 ' HB2' HG22 ' A' ' 161' ' ' ILE . . . -127.51 167.34 16.43 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.492 1.12 . . . . 0.0 109.292 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.51 ' CG ' ' O ' ' A' ' 177' ' ' GLY . 6.9 mp0 -101.39 156.28 17.55 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.473 1.108 . . . . 0.0 110.287 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 174' ' ' ASP . . . . . 0.654 ' HB3' HD11 ' A' ' 151' ' ' LEU . 45.2 p-10 -93.85 -160.19 0.75 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.444 1.09 . . . . 0.0 109.316 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 45.0 t -80.92 11.46 3.97 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.478 1.111 . . . . 0.0 109.996 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -132.22 -2.25 3.56 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.435 1.084 . . . . 0.0 110.337 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . 0.51 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 96.01 -12.28 67.12 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.462 1.102 . . . . 0.0 110.985 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . 0.478 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 2.9 mtpp -52.67 113.25 1.01 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.474 0.749 . . . . 0.0 109.303 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . 0.441 ' HG2' ' CD ' ' A' ' 173' ' ' GLU . 0.5 OUTLIER -87.89 126.26 34.94 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.485 1.116 . . . . 0.0 110.304 -179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . 0.468 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -152.72 -169.3 17.83 Favored Glycine 0 CA--C 1.53 1.002 0 O-C-N 124.522 1.139 . . . . 0.0 110.993 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.4 mmt -86.78 126.03 34.33 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.528 0.781 . . . . 0.0 111.024 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.762 ' CG1' HD23 ' A' ' 151' ' ' LEU . 18.1 mm -121.5 134.56 24.58 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.475 1.109 . . . . 0.0 109.313 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 183' ' ' PRO . . . . . 0.683 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.2 Cg_endo -75.01 121.13 6.38 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.543 1.812 . . . . 0.0 111.025 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.835 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 9.8 t -69.66 -30.28 2.04 Favored Pre-proline 0 C--N 1.325 -0.475 0 O-C-N 124.51 1.131 . . . . 0.0 109.299 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 185' ' ' PRO . . . . . 0.835 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -75.03 -23.96 13.24 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.527 1.804 . . . . 0.0 111.003 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.681 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.5 m-85 -100.32 -5.02 28.02 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.545 1.153 . . . . 0.0 110.989 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 187' ' ' VAL . . . . . 0.701 HG11 ' CG2' ' A' ' 182' ' ' ILE . 3.3 m -128.49 152.63 36.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.539 1.149 . . . . 0.0 109.273 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 188' ' ' GLU . . . . . 0.567 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.0 OUTLIER -107.98 166.08 10.98 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.491 1.119 . . . . 0.0 110.322 179.992 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.501 0 O-C-N 124.491 1.12 . . . . 0.0 109.325 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . 0.553 ' HB3' ' CE2' ' A' ' 136' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . 0.553 ' CE2' ' HB3' ' A' ' 135' ' ' CYS . 68.1 m-85 -151.3 173.9 13.94 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.475 1.109 . . . . 0.0 111.035 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.522 ' HB ' ' CG2' ' A' ' 187' ' ' VAL . 4.2 m -147.67 149.55 15.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 O-C-N 124.492 1.12 . . . . 0.0 109.302 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.83 HH21 HD21 ' A' ' 140' ' ' LEU . 16.4 ttp180 -105.25 107.49 18.5 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.501 1.126 . . . . 0.0 110.316 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.482 ' CB ' HG12 ' A' ' 187' ' ' VAL . . . -80.92 103.95 11.1 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.47 1.106 . . . . 0.0 109.371 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.83 HD21 HH21 ' A' ' 138' ' ' ARG . 2.9 mp -88.89 22.99 2.49 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.527 1.142 . . . . 0.0 109.332 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.429 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 36.4 m-85 -144.01 145.2 32.05 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.514 1.134 . . . . 0.0 111.009 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . 0.402 ' N ' ' HB2' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -87.63 152.66 21.99 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.563 1.164 . . . . 0.0 109.328 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.603 ' HB3' ' CZ ' ' A' ' 153' ' ' PHE . 5.8 t80 . . . . . 0 C--N 1.326 -0.449 0 O-C-N 124.469 1.105 . . . . 0.0 111.013 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.66 HD22 ' O ' ' A' ' 172' ' ' ALA . 11.6 tp . . . . . 0 N--CA 1.453 -0.287 0 N-CA-C 109.344 -0.614 . . . . 0.0 109.344 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.08 133.62 16.69 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.417 1.746 . . . . 0.0 110.967 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.603 ' CZ ' ' HB3' ' A' ' 143' ' ' PHE . 4.8 p90 -150.8 -179.05 6.95 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 0.0 111.023 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -130.94 147.16 52.54 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.447 1.092 . . . . 0.0 109.238 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' LYS . . . . . 0.412 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -56.34 118.12 4.46 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.538 1.149 . . . . 0.0 109.365 179.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 99.72 35.57 4.56 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.472 1.108 . . . . 0.0 110.984 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -120.61 170.29 9.56 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.522 0.778 . . . . 0.0 109.286 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.486 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 5.2 mt -119.46 148.23 22.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 O-C-N 124.553 1.158 . . . . 0.0 109.268 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.644 HD23 ' HA ' ' A' ' 174' ' ' ASP . 0.4 OUTLIER -139.79 136.69 34.33 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.496 1.123 . . . . 0.0 109.28 -179.976 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.445 ' HB3' ' HB2' ' A' ' 173' ' ' GLU . 6.1 ttt-85 -87.69 100.96 13.21 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.554 1.159 . . . . 0.0 110.275 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' ILE . . . . . 0.916 HD11 ' HG2' ' A' ' 164' ' ' LYS . 0.0 OUTLIER -86.1 130.55 36.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.566 1.166 . . . . 0.0 109.322 179.946 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -129.19 -24.49 2.85 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.5 1.125 . . . . 0.0 110.32 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' ASP . . . . . 0.427 ' HB2' ' CB ' ' A' ' 171' ' ' ASN . 8.7 m-20 -124.78 147.97 48.39 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.406 1.066 . . . . 0.0 109.305 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . 0.916 ' HG2' HD11 ' A' ' 161' ' ' ILE . 10.9 mtmm -144.0 71.32 16.71 Favored Pre-proline 0 C--N 1.324 -0.508 0 O-C-N 124.535 1.147 . . . . 0.0 109.272 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -75.01 4.97 4.27 Favored 'Trans proline' 0 C--N 1.36 1.172 0 O-C-N 124.453 1.765 . . . . 0.0 111.05 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 166' ' ' GLU . . . . . 0.468 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 26.3 mm-40 -141.46 172.75 12.25 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.469 1.106 . . . . 0.0 110.316 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -100.07 16.38 24.25 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.521 1.138 . . . . 0.0 110.318 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.428 ' NE2' ' HG3' ' A' ' 185' ' ' PRO . 7.0 mt-30 -157.84 -43.19 0.06 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.53 1.144 . . . . 0.0 110.26 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 169' ' ' TRP . . . . . 0.502 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 90.0 m95 -100.18 101.03 11.96 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 170' ' ' TRP . . . . . 0.779 ' CE2' HG21 ' A' ' 184' ' ' VAL . 28.8 m0 -107.96 154.45 21.61 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.545 1.153 . . . . 0.0 108.026 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . 0.449 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.5 OUTLIER -87.77 111.79 21.73 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.471 1.107 . . . . 0.0 109.264 -179.921 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . 0.66 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -132.81 163.7 28.49 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.556 1.16 . . . . 0.0 109.286 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.494 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.6 OUTLIER -95.98 158.88 15.25 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.493 1.12 . . . . 0.0 110.288 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 174' ' ' ASP . . . . . 0.644 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.2 OUTLIER -94.58 -166.18 1.43 Allowed 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.512 1.133 . . . . 0.0 109.261 -179.898 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.91 5.64 6.2 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.529 1.143 . . . . 0.0 110.042 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -124.64 -5.31 7.59 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.444 1.09 . . . . 0.0 110.264 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . 0.488 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 98.34 -7.48 61.94 Favored Glycine 0 CA--C 1.53 0.979 0 O-C-N 124.429 1.081 . . . . 0.0 110.99 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . 0.635 ' O ' HD11 ' A' ' 151' ' ' LEU . 5.4 mtmt -56.76 112.77 1.4 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.481 0.753 . . . . 0.0 109.322 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.1 OUTLIER -87.8 123.37 32.52 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.49 1.119 . . . . 0.0 110.322 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . 0.604 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -155.46 -162.93 11.66 Favored Glycine 0 CA--C 1.531 1.072 0 O-C-N 124.514 1.134 . . . . 0.0 110.959 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 181' ' ' MET . . . . . 0.502 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.2 OUTLIER -88.25 130.65 35.04 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.606 0.827 . . . . 0.0 111.005 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.639 HD12 HD13 ' A' ' 159' ' ' LEU . 23.0 mm -126.92 131.83 24.05 Favored Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 124.53 1.144 . . . . 0.0 109.255 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 183' ' ' PRO . . . . . 0.751 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.3 Cg_endo -75.02 123.19 7.69 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.485 1.782 . . . . 0.0 110.944 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.827 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 14.0 t -71.93 -31.08 1.64 Allowed Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.496 1.123 . . . . 0.0 109.331 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 185' ' ' PRO . . . . . 0.827 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.96 -21.01 16.38 Favored 'Trans proline' 0 C--N 1.36 1.145 0 O-C-N 124.508 1.794 . . . . 0.0 111.057 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.685 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.9 m-85 -97.72 -21.47 16.97 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.481 1.113 . . . . 0.0 110.984 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 187' ' ' VAL . . . . . 0.751 HG13 ' O ' ' A' ' 183' ' ' PRO . 1.4 m -116.35 157.93 17.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.474 1.109 . . . . 0.0 109.371 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 188' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.2 OUTLIER -102.24 163.61 12.14 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.428 1.08 . . . . 0.0 110.331 179.968 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 189' ' ' LYS . . . . . 0.61 ' NZ ' HG22 ' A' ' 184' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.448 0 O-C-N 124.573 1.17 . . . . 0.0 109.3 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 27.0 p . . . . . 0 N--CA 1.452 -0.343 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . 0.576 ' CE1' ' HB2' ' A' ' 160' ' ' ARG . 12.7 m-85 -130.21 164.64 24.07 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.489 1.118 . . . . 0.0 111.044 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.756 HG21 ' CG2' ' A' ' 187' ' ' VAL . 0.5 OUTLIER -147.69 165.06 6.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.547 1.154 . . . . 0.0 109.274 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.5 ' N ' HG23 ' A' ' 137' ' ' VAL . 2.5 ttm180 -125.49 118.68 26.31 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.498 1.124 . . . . 0.0 110.324 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.475 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -84.03 113.33 20.94 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.493 1.121 . . . . 0.0 109.287 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.8 mt -87.14 20.28 2.78 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.565 1.165 . . . . 0.0 109.329 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.446 ' CD2' ' CD2' ' A' ' 186' ' ' TYR . 17.8 t80 -142.8 166.78 23.72 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 124.467 1.105 . . . . 0.0 110.958 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -106.78 154.7 20.61 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.484 1.115 . . . . 0.0 109.321 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.465 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 11.0 t80 . . . . . 0 C--N 1.324 -0.505 0 O-C-N 124.495 1.122 . . . . 0.0 111.037 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.504 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 13.0 tp . . . . . 0 N--CA 1.453 -0.295 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . 0.452 ' CB ' ' O ' ' A' ' 143' ' ' PHE . 18.3 Cg_endo -74.92 169.53 22.41 Favored 'Trans proline' 0 C--N 1.36 1.151 0 O-C-N 124.558 1.82 . . . . 0.0 111.039 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.465 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 2.0 p90 -174.86 173.13 2.79 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.522 1.139 . . . . 0.0 110.99 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . 0.495 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -123.39 127.3 48.27 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.529 1.143 . . . . 0.0 109.301 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' LYS . . . . . 0.495 ' C ' ' O ' ' A' ' 154' ' ' LYS . 0.9 OUTLIER -32.58 107.51 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.544 0 O-C-N 124.542 1.151 . . . . 0.0 109.298 -179.975 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 99.79 39.5 3.36 Favored Glycine 0 CA--C 1.53 0.988 0 O-C-N 124.453 1.096 . . . . 0.0 110.975 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . 0.477 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 22.2 t70 -111.9 172.05 7.13 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.454 0.737 . . . . 0.0 109.32 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.742 HD13 ' O ' ' A' ' 137' ' ' VAL . 6.1 mm -123.64 149.31 27.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.502 1.126 . . . . 0.0 109.294 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.953 HD13 HG21 ' A' ' 182' ' ' ILE . 3.1 mt -145.86 140.07 26.78 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.456 1.098 . . . . 0.0 109.311 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.576 ' HB2' ' CE1' ' A' ' 136' ' ' TYR . 1.9 ttt180 -88.64 102.17 14.7 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.514 1.134 . . . . 0.0 110.302 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' ILE . . . . . 0.998 HD12 ' HB2' ' A' ' 172' ' ' ALA . 0.1 OUTLIER -83.12 124.13 39.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.535 1.147 . . . . 0.0 109.287 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -118.91 -25.11 6.37 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.545 1.153 . . . . 0.0 110.335 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' ASP . . . . . 0.455 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 1.4 m-20 -131.74 157.77 42.92 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.53 1.144 . . . . 0.0 109.236 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . 0.518 ' HB2' ' CG ' ' A' ' 170' ' ' TRP . 0.7 OUTLIER -165.13 65.29 1.1 Allowed Pre-proline 0 C--N 1.326 -0.432 0 O-C-N 124.497 1.123 . . . . 0.0 109.289 -179.956 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 6.46 3.37 Favored 'Trans proline' 0 C--N 1.359 1.131 0 O-C-N 124.473 1.775 . . . . 0.0 110.992 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 166' ' ' GLU . . . . . 0.446 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 6.5 mm-40 -131.21 171.04 13.76 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.457 1.098 . . . . 0.0 110.279 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . 0.518 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 2.5 mt-10 -112.56 48.07 1.03 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.448 1.092 . . . . 0.0 110.277 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.518 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 1.3 mt-30 173.64 -32.12 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.487 1.117 . . . . 0.0 110.281 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 169' ' ' TRP . . . . . 0.436 ' O ' ' HB2' ' A' ' 166' ' ' GLU . 76.3 m95 -123.27 103.26 8.41 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.524 1.14 . . . . 0.0 107.994 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 170' ' ' TRP . . . . . 0.972 ' HB2' HD11 ' A' ' 161' ' ' ILE . 30.0 m0 -108.68 169.68 8.51 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.48 1.112 . . . . 0.0 108.002 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . 0.512 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -104.96 115.87 31.0 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.5 1.125 . . . . 0.0 109.236 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . 0.998 ' HB2' HD12 ' A' ' 161' ' ' ILE . . . -133.88 167.97 19.6 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.485 1.116 . . . . 0.0 109.307 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.538 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 4.0 mp0 -100.44 158.67 15.73 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.533 1.146 . . . . 0.0 110.297 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 174' ' ' ASP . . . . . 0.496 ' OD1' ' N ' ' A' ' 177' ' ' GLY . 44.2 p-10 -94.55 -161.25 0.84 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.574 1.171 . . . . 0.0 109.298 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.73 14.06 2.85 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.528 1.143 . . . . 0.0 109.97 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -133.47 -5.34 2.94 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.474 1.109 . . . . 0.0 110.297 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . 0.51 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 99.85 -12.72 60.91 Favored Glycine 0 CA--C 1.531 1.039 0 O-C-N 124.477 1.111 . . . . 0.0 110.921 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . 0.433 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 2.8 mttm -53.78 112.75 0.99 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.506 0.768 . . . . 0.0 109.298 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -88.51 128.08 35.54 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.402 1.064 . . . . 0.0 110.356 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . 0.512 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -152.73 -167.87 16.03 Favored Glycine 0 CA--C 1.529 0.966 0 O-C-N 124.454 1.096 . . . . 0.0 111.039 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -96.75 118.91 34.22 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.522 0.778 . . . . 0.0 111.06 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.953 HG21 HD13 ' A' ' 159' ' ' LEU . 4.8 pt -112.77 141.39 25.32 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.505 1.128 . . . . 0.0 109.333 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 183' ' ' PRO . . . . . 0.775 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.1 Cg_endo -75.01 126.74 10.16 Favored 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.48 1.779 . . . . 0.0 111.058 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.828 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 48.8 t -71.98 -30.61 1.52 Allowed Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.498 1.124 . . . . 0.0 109.248 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 185' ' ' PRO . . . . . 0.828 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.94 -26.69 10.81 Favored 'Trans proline' 0 C--N 1.36 1.16 0 O-C-N 124.459 1.768 . . . . 0.0 111.005 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.775 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 7.2 m-85 -98.76 2.46 46.95 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.451 1.094 . . . . 0.0 110.986 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 187' ' ' VAL . . . . . 0.756 ' CG2' HG21 ' A' ' 137' ' ' VAL . 2.0 m -140.02 160.25 26.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 124.453 1.096 . . . . 0.0 109.365 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 188' ' ' GLU . . . . . 0.412 ' O ' ' HB ' ' A' ' 137' ' ' VAL . 0.9 OUTLIER -111.45 149.08 31.79 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.544 1.152 . . . . 0.0 110.249 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.496 0 O-C-N 124.553 1.158 . . . . 0.0 109.274 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . 0.491 ' HB3' ' CE2' ' A' ' 136' ' ' TYR . 1.3 m . . . . . 0 N--CA 1.453 -0.313 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . 0.558 ' CE1' ' HD2' ' A' ' 160' ' ' ARG . 34.6 m-85 -150.58 177.62 9.86 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.514 1.134 . . . . 0.0 111.007 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.877 HG21 HD11 ' A' ' 182' ' ' ILE . 9.9 m -143.85 141.04 25.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.479 1.112 . . . . 0.0 109.302 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.633 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 14.0 ttp180 -99.65 112.28 24.52 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.551 1.157 . . . . 0.0 110.291 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.489 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -80.07 112.37 17.31 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.579 1.174 . . . . 0.0 109.309 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.65 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.1 OUTLIER -91.15 22.9 3.51 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.586 1.179 . . . . 0.0 109.312 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.486 ' CG ' ' CD2' ' A' ' 186' ' ' TYR . 55.3 m-85 -147.36 156.24 42.72 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.549 1.156 . . . . 0.0 110.926 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.67 128.59 45.0 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.582 1.176 . . . . 0.0 109.27 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.622 ' HB3' ' CZ ' ' A' ' 153' ' ' PHE . 0.8 OUTLIER . . . . . 0 C--N 1.326 -0.447 0 O-C-N 124.468 1.105 . . . . 0.0 111.011 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.64 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 14.6 tp . . . . . 0 N--CA 1.454 -0.262 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 135.11 18.6 Favored 'Trans proline' 0 C--N 1.36 1.171 0 O-C-N 124.508 1.794 . . . . 0.0 111.04 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.622 ' CZ ' ' HB3' ' A' ' 143' ' ' PHE . 4.8 p90 -157.25 -178.59 7.47 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.469 1.105 . . . . 0.0 110.947 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.93 142.7 50.86 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.501 1.126 . . . . 0.0 109.273 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 4.7 ttpt -48.67 118.83 2.73 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.452 1.095 . . . . 0.0 109.29 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 91.82 42.99 4.6 Favored Glycine 0 CA--C 1.529 0.953 0 O-C-N 124.446 1.091 . . . . 0.0 110.981 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . 0.451 ' C ' HD12 ' A' ' 158' ' ' ILE . 17.8 t70 -121.91 171.11 9.16 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.468 0.746 . . . . 0.0 109.271 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.583 ' O ' HD23 ' A' ' 159' ' ' LEU . 2.8 mp -119.62 147.97 22.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.523 1.14 . . . . 0.0 109.279 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.906 HD12 HD13 ' A' ' 182' ' ' ILE . 3.4 mt -143.5 139.9 30.04 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.443 1.089 . . . . 0.0 109.237 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.558 ' HD2' ' CE1' ' A' ' 136' ' ' TYR . 8.3 ttt180 -84.59 101.37 12.06 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.564 1.165 . . . . 0.0 110.265 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' ILE . . . . . 0.822 HD12 ' HB2' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -82.91 122.67 37.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 O-C-N 124.511 1.132 . . . . 0.0 109.244 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.24 -26.73 5.81 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.54 1.15 . . . . 0.0 110.293 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.14 154.17 39.0 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.537 1.148 . . . . 0.0 109.32 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . 0.474 ' HB2' ' CE2' ' A' ' 170' ' ' TRP . 5.6 ptpp? -165.85 71.14 1.26 Allowed Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.544 1.152 . . . . 0.0 109.253 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.09 -38.38 1.57 Allowed 'Trans proline' 0 C--N 1.36 1.164 0 O-C-N 124.463 1.77 . . . . 0.0 110.946 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 166' ' ' GLU . . . . . 0.44 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.3 mt-10 -85.58 -177.65 6.47 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.492 1.12 . . . . 0.0 110.277 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -114.1 17.33 17.82 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.416 1.073 . . . . 0.0 110.233 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.453 ' O ' ' N ' ' A' ' 184' ' ' VAL . 33.5 mt-30 -152.13 -40.05 0.11 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.481 1.113 . . . . 0.0 110.288 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 169' ' ' TRP . . . . . 0.439 ' CE3' ' HG2' ' A' ' 181' ' ' MET . 73.9 m95 -107.54 111.18 23.33 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 170' ' ' TRP . . . . . 0.767 ' HB2' HD11 ' A' ' 161' ' ' ILE . 51.3 m0 -114.84 164.17 14.48 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.552 1.158 . . . . 0.0 108.063 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . 0.411 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -102.57 121.76 43.02 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.546 1.153 . . . . 0.0 109.304 -179.967 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . 0.822 ' HB2' HD12 ' A' ' 161' ' ' ILE . . . -141.91 162.3 35.83 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.49 1.119 . . . . 0.0 109.312 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.519 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 2.2 mp0 -96.48 154.41 17.29 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.476 1.11 . . . . 0.0 110.246 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 174' ' ' ASP . . . . . 0.475 ' N ' HD21 ' A' ' 151' ' ' LEU . 0.2 OUTLIER -89.13 -162.01 0.82 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.485 1.116 . . . . 0.0 109.268 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 2.4 m -79.18 5.73 11.43 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.47 1.106 . . . . 0.0 109.973 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -123.8 -5.38 8.04 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.466 1.104 . . . . 0.0 110.327 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . 0.501 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 97.48 -6.41 63.13 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.555 1.159 . . . . 0.0 110.969 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . 0.603 ' O ' HD11 ' A' ' 151' ' ' LEU . 0.9 OUTLIER -57.26 111.92 1.22 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.478 0.752 . . . . 0.0 109.292 -179.974 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . 0.434 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -87.02 125.57 34.18 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.46 1.1 . . . . 0.0 110.29 179.983 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . 0.505 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -154.75 -173.97 24.2 Favored Glycine 0 CA--C 1.531 1.035 0 O-C-N 124.46 1.1 . . . . 0.0 110.98 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 181' ' ' MET . . . . . 0.439 ' HG2' ' CE3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -96.67 128.06 43.25 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.526 0.78 . . . . 0.0 111.013 179.962 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.929 HD12 HG11 ' A' ' 187' ' ' VAL . 4.2 pt -128.38 156.65 76.56 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.448 1.093 . . . . 0.0 109.287 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 183' ' ' PRO . . . . . 0.807 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.1 Cg_endo -75.04 132.79 15.77 Favored 'Trans proline' 0 C--N 1.361 1.197 0 O-C-N 124.488 1.783 . . . . 0.0 111.003 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.825 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 39.2 t -78.38 -31.95 0.81 Allowed Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.525 1.141 . . . . 0.0 109.319 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 185' ' ' PRO . . . . . 0.825 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.99 -26.07 11.29 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.467 1.772 . . . . 0.0 110.983 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.779 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 2.9 m-85 -96.58 7.66 46.02 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.488 1.117 . . . . 0.0 110.958 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 187' ' ' VAL . . . . . 0.929 HG11 HD12 ' A' ' 182' ' ' ILE . 3.5 m -135.98 151.98 29.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 O-C-N 124.417 1.073 . . . . 0.0 109.322 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 188' ' ' GLU . . . . . 0.558 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 39.4 tt0 -101.85 153.25 20.0 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.499 1.124 . . . . 0.0 110.264 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 2.3 ptmm? . . . . . 0 C--N 1.326 -0.439 0 O-C-N 124.524 1.14 . . . . 0.0 109.272 179.995 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . 0.414 ' O ' ' HG3' ' A' ' 160' ' ' ARG . 3.6 m . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -150.93 163.35 38.9 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.526 1.141 . . . . 0.0 111.044 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.615 HG22 ' O ' ' A' ' 159' ' ' LEU . 13.5 m -144.58 136.21 21.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.517 1.136 . . . . 0.0 109.296 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.527 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 6.6 ttp180 -103.27 110.9 23.05 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.474 1.108 . . . . 0.0 110.299 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.543 ' HB1' ' CD1' ' A' ' 153' ' ' PHE . . . -81.37 104.64 11.96 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.451 1.095 . . . . 0.0 109.334 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.413 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 1.7 mt -89.59 22.93 2.8 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.503 1.127 . . . . 0.0 109.218 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -140.52 149.7 42.79 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.5 1.125 . . . . 0.0 111.014 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.17 128.92 34.97 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.49 1.119 . . . . 0.0 109.312 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.598 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.4 OUTLIER . . . . . 0 C--N 1.325 -0.494 0 O-C-N 124.572 1.17 . . . . 0.0 111.007 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.633 HD21 ' O ' ' A' ' 178' ' ' LYS . 6.4 tp . . . . . 0 N--CA 1.452 -0.344 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.99 171.28 18.63 Favored 'Trans proline' 0 C--N 1.36 1.138 0 O-C-N 124.465 1.771 . . . . 0.0 111.04 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.598 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 8.7 p90 -174.08 178.88 2.02 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.433 1.083 . . . . 0.0 111.008 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.62 135.94 54.16 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.53 1.144 . . . . 0.0 109.31 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.3 OUTLIER -42.9 108.07 0.1 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.523 1.139 . . . . 0.0 109.358 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 105.7 34.23 3.35 Favored Glycine 0 CA--C 1.529 0.946 0 O-C-N 124.448 1.093 . . . . 0.0 111.018 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . 0.417 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 17.5 t0 -109.97 176.58 5.01 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.49 0.759 . . . . 0.0 109.308 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.467 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 51.7 mt -131.67 148.25 32.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.483 1.114 . . . . 0.0 109.288 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.926 HD13 HG21 ' A' ' 182' ' ' ILE . 2.3 mt -145.01 139.94 27.81 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.512 1.133 . . . . 0.0 109.409 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.544 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 14.0 ttt-85 -86.19 97.12 10.18 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.465 1.103 . . . . 0.0 110.311 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' ILE . . . . . 0.54 HD11 ' HB3' ' A' ' 164' ' ' LYS . 0.0 OUTLIER -82.98 120.66 34.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.512 1.133 . . . . 0.0 109.284 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.11 -22.71 7.67 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.442 1.089 . . . . 0.0 110.373 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -122.05 137.4 54.82 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.458 1.098 . . . . 0.0 109.276 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . 0.54 ' HB3' HD11 ' A' ' 161' ' ' ILE . 0.0 OUTLIER -147.92 66.95 9.92 Favored Pre-proline 0 C--N 1.325 -0.459 0 O-C-N 124.455 1.097 . . . . 0.0 109.292 179.967 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.0 -38.48 1.57 Allowed 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.523 1.801 . . . . 0.0 111.036 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 166' ' ' GLU . . . . . 0.469 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 8.8 mm-40 -88.08 176.21 7.39 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.469 1.106 . . . . 0.0 110.324 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . 0.443 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 6.7 pt-20 -113.99 47.71 1.17 Allowed 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.524 1.14 . . . . 0.0 110.229 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.443 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 0.2 OUTLIER 174.41 -33.84 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.545 1.153 . . . . 0.0 110.351 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 169' ' ' TRP . . . . . 0.469 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 74.5 m95 -117.07 105.32 12.15 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 170' ' ' TRP . . . . . 0.748 ' O ' HD13 ' A' ' 182' ' ' ILE . 52.8 m0 -110.27 163.52 13.56 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.481 1.113 . . . . 0.0 107.997 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . 0.582 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -101.78 119.32 38.6 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.394 1.059 . . . . 0.0 109.287 179.985 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . 0.605 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -136.78 167.52 21.29 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.53 1.144 . . . . 0.0 109.292 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.722 ' HG3' ' HA2' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -98.32 159.4 14.97 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.475 1.109 . . . . 0.0 110.301 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 174' ' ' ASP . . . . . 0.678 ' N ' ' HG2' ' A' ' 173' ' ' GLU . 42.8 p-10 -95.85 -157.03 0.55 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.581 1.176 . . . . 0.0 109.309 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 38.3 t -85.66 14.38 5.83 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.567 1.167 . . . . 0.0 110.09 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -136.78 -1.96 2.18 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.546 1.154 . . . . 0.0 110.334 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . 0.722 ' HA2' ' HG3' ' A' ' 173' ' ' GLU . . . 100.03 -17.53 57.03 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 124.531 1.145 . . . . 0.0 111.113 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . 0.633 ' O ' HD21 ' A' ' 151' ' ' LEU . 5.3 mttm -49.62 108.28 0.19 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.584 0.814 . . . . 0.0 109.299 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 33.4 mtm180 -90.75 127.04 36.19 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.457 1.098 . . . . 0.0 110.305 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . 0.582 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -149.92 -164.13 11.57 Favored Glycine 0 CA--C 1.53 1.012 0 O-C-N 124.488 1.117 . . . . 0.0 110.978 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 181' ' ' MET . . . . . 0.473 ' O ' ' N ' ' A' ' 151' ' ' LEU . 0.0 OUTLIER -100.69 126.81 47.24 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.533 0.784 . . . . 0.0 111.021 -179.979 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.926 HG21 HD13 ' A' ' 159' ' ' LEU . 0.2 OUTLIER -126.43 150.87 71.64 Favored Pre-proline 0 C--N 1.324 -0.506 0 O-C-N 124.554 1.159 . . . . 0.0 109.324 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 183' ' ' PRO . . . . . 0.756 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.1 Cg_endo -75.1 131.34 14.07 Favored 'Trans proline' 0 C--N 1.361 1.194 0 O-C-N 124.496 1.787 . . . . 0.0 111.006 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.839 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 55.3 t -76.18 -31.21 0.96 Allowed Pre-proline 0 C--N 1.325 -0.482 0 O-C-N 124.418 1.074 . . . . 0.0 109.287 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 185' ' ' PRO . . . . . 0.839 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.95 -24.13 13.23 Favored 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.553 1.817 . . . . 0.0 111.005 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.756 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.6 m-85 -96.27 -5.02 41.2 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.463 1.102 . . . . 0.0 110.989 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 187' ' ' VAL . . . . . 0.752 HG13 ' O ' ' A' ' 183' ' ' PRO . 2.9 m -127.73 153.72 37.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.484 1.115 . . . . 0.0 109.259 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 188' ' ' GLU . . . . . 0.585 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 4.6 pt-20 -105.78 155.59 19.14 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.509 1.13 . . . . 0.0 110.287 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.468 0 O-C-N 124.483 1.114 . . . . 0.0 109.332 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . 0.652 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 1.5 p . . . . . 0 N--CA 1.452 -0.335 0 N-CA-C 108.361 -0.978 . . . . 0.0 108.361 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . 0.652 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 0.0 OUTLIER -151.12 177.4 10.23 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.469 1.106 . . . . 0.0 110.999 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.607 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 28.5 m -142.48 155.24 18.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 O-C-N 124.586 1.179 . . . . 0.0 109.289 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.479 ' HA ' ' O ' ' A' ' 157' ' ' ASP . 0.2 OUTLIER -107.84 114.35 28.23 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.466 1.104 . . . . 0.0 110.248 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.523 ' O ' ' N ' ' A' ' 156' ' ' GLY . . . -80.63 110.23 15.91 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.422 1.076 . . . . 0.0 109.263 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.411 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 4.3 mt -88.5 23.79 2.13 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.547 1.154 . . . . 0.0 109.236 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.404 ' O ' ' N ' ' A' ' 155' ' ' LYS . 23.8 t80 -140.58 168.83 18.87 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 124.485 1.116 . . . . 0.0 110.994 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -109.14 122.79 48.06 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.54 1.15 . . . . 0.0 109.325 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.557 ' O ' ' HA ' ' A' ' 152' ' ' PRO . 4.4 t80 . . . . . 0 C--N 1.326 -0.445 0 O-C-N 124.508 1.13 . . . . 0.0 111.004 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.684 ' HB3' HG23 ' A' ' 182' ' ' ILE . 13.7 tp . . . . . 0 N--CA 1.452 -0.329 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . 0.557 ' HA ' ' O ' ' A' ' 143' ' ' PHE . 18.3 Cg_endo -74.96 142.14 27.61 Favored 'Trans proline' 0 C--N 1.359 1.13 0 O-C-N 124.531 1.806 . . . . 0.0 111.048 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.475 ' CZ ' ' HB3' ' A' ' 143' ' ' PHE . 7.5 p90 -164.92 -180.0 6.12 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.505 1.128 . . . . 0.0 111.036 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . 0.423 ' O ' ' C ' ' A' ' 155' ' ' LYS . 1.8 ttmt -135.76 144.17 45.67 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.489 1.118 . . . . 0.0 109.277 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' LYS . . . . . 0.423 ' C ' ' O ' ' A' ' 154' ' ' LYS . 2.8 tmpt? -38.32 135.49 0.74 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.473 1.108 . . . . 0.0 109.331 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 76.63 31.69 53.17 Favored Glycine 0 CA--C 1.529 0.912 0 O-C-N 124.433 1.083 . . . . 0.0 111.029 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . 0.479 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 6.6 t70 -105.47 165.99 10.75 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.48 0.753 . . . . 0.0 109.293 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.488 ' C ' ' HG ' ' A' ' 159' ' ' LEU . 18.7 mm -121.32 147.6 25.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.51 1.131 . . . . 0.0 109.328 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.856 HD13 HG21 ' A' ' 182' ' ' ILE . 0.6 OUTLIER -145.48 133.85 21.84 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.469 1.105 . . . . 0.0 109.33 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.477 ' HB3' ' HB2' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -87.62 105.08 17.1 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.575 1.172 . . . . 0.0 110.328 -179.983 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' ILE . . . . . 0.565 HD13 ' C ' ' A' ' 161' ' ' ILE . 0.0 OUTLIER -83.47 129.23 37.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.567 1.167 . . . . 0.0 109.289 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . 0.431 ' HB3' ' OD1' ' A' ' 163' ' ' ASP . 4.7 ttt-85 -124.05 -22.11 4.9 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.513 1.133 . . . . 0.0 110.257 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' ASP . . . . . 0.59 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -138.26 158.3 44.56 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.489 1.118 . . . . 0.0 109.245 -179.952 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . 0.552 ' HB2' ' CG ' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -155.19 76.14 5.2 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.466 1.103 . . . . 0.0 109.303 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.03 -1.17 10.88 Favored 'Trans proline' 0 C--N 1.361 1.213 0 O-C-N 124.534 1.808 . . . . 0.0 110.999 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 166' ' ' GLU . . . . . 0.481 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.1 mt-10 -128.03 171.9 11.44 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.492 1.12 . . . . 0.0 110.301 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -100.24 14.99 29.06 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.53 1.144 . . . . 0.0 110.261 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.444 ' O ' ' N ' ' A' ' 184' ' ' VAL . 8.6 mt-30 -155.31 -45.73 0.08 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.449 1.093 . . . . 0.0 110.291 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 169' ' ' TRP . . . . . 0.448 ' O ' ' HE1' ' A' ' 181' ' ' MET . 91.1 m95 -98.32 103.17 15.09 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 170' ' ' TRP . . . . . 0.7 ' CD2' HG21 ' A' ' 184' ' ' VAL . 36.0 m0 -107.91 154.7 21.22 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.977 -1.119 . . . . 0.0 107.977 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 1.2 t-20 -88.05 116.17 26.04 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.514 1.134 . . . . 0.0 109.294 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . 0.62 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -137.37 160.24 39.64 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.511 1.132 . . . . 0.0 109.216 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.576 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 2.6 mp0 -89.17 156.31 18.87 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.496 1.123 . . . . 0.0 110.279 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 174' ' ' ASP . . . . . 0.571 ' N ' HD21 ' A' ' 151' ' ' LEU . 0.4 OUTLIER -90.73 -162.07 0.87 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.478 1.111 . . . . 0.0 109.343 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 4.1 m -80.74 9.54 6.12 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.549 1.156 . . . . 0.0 109.996 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -132.04 -5.97 3.5 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.523 1.14 . . . . 0.0 110.338 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . 0.502 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 103.69 -10.4 52.88 Favored Glycine 0 CA--C 1.53 0.979 0 O-C-N 124.557 1.161 . . . . 0.0 111.011 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . 0.578 ' O ' HD11 ' A' ' 151' ' ' LEU . 1.2 mttt -53.89 114.19 1.49 Allowed 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.478 0.752 . . . . 0.0 109.319 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . 0.557 ' CG ' ' CD ' ' A' ' 173' ' ' GLU . 5.6 mtm105 -88.07 126.58 35.18 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.48 1.113 . . . . 0.0 110.281 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . 0.501 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -155.53 -172.42 23.09 Favored Glycine 0 CA--C 1.53 0.999 0 O-C-N 124.53 1.144 . . . . 0.0 111.043 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 181' ' ' MET . . . . . 0.448 ' HE1' ' O ' ' A' ' 169' ' ' TRP . 84.5 mmm -99.94 117.87 35.16 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.506 0.768 . . . . 0.0 111.009 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.856 HG21 HD13 ' A' ' 159' ' ' LEU . 1.1 pt -117.96 151.28 48.68 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.494 1.121 . . . . 0.0 109.337 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 183' ' ' PRO . . . . . 0.778 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -74.9 131.02 13.94 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.58 1.832 . . . . 0.0 110.987 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.84 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 4.0 t -76.76 -30.72 0.85 Allowed Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.522 1.139 . . . . 0.0 109.251 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 185' ' ' PRO . . . . . 0.84 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -75.03 -22.42 14.78 Favored 'Trans proline' 0 C--N 1.36 1.137 0 O-C-N 124.503 1.791 . . . . 0.0 111.013 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.778 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 11.6 m-85 -97.67 -4.89 36.47 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.443 1.089 . . . . 0.0 111.007 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 187' ' ' VAL . . . . . 0.641 HG22 ' HA ' ' A' ' 184' ' ' VAL . 4.0 m -127.3 151.31 33.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.556 1.16 . . . . 0.0 109.343 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 188' ' ' GLU . . . . . 0.607 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 2.4 mt-10 -101.84 144.42 30.52 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.468 1.105 . . . . 0.0 110.278 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 189' ' ' LYS . . . . . 0.557 ' HA ' HG12 ' A' ' 137' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.471 0 O-C-N 124.541 1.151 . . . . 0.0 109.27 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . 0.409 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 7.5 p . . . . . 0 N--CA 1.452 -0.35 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . 0.409 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 10.5 m-85 -150.88 167.17 28.34 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.463 1.102 . . . . 0.0 111.017 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.577 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 6.2 m -142.38 133.29 24.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.522 1.139 . . . . 0.0 109.306 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.524 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 23.6 ttp85 -101.57 110.18 22.12 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.509 1.131 . . . . 0.0 110.329 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.469 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -81.46 109.27 15.77 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.465 1.103 . . . . 0.0 109.317 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.502 HD12 ' O ' ' A' ' 138' ' ' ARG . 5.2 mp -89.44 23.3 2.61 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.526 1.141 . . . . 0.0 109.347 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -140.95 165.32 27.85 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.457 1.098 . . . . 0.0 110.972 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.81 127.52 53.15 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.518 1.136 . . . . 0.0 109.286 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.644 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 64.2 t80 . . . . . 0 C--N 1.325 -0.464 0 O-C-N 124.479 1.112 . . . . 0.0 110.968 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.732 ' HB3' HG23 ' A' ' 182' ' ' ILE . 13.8 tp . . . . . 0 N--CA 1.453 -0.313 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.04 154.62 42.43 Favored 'Trans proline' 0 C--N 1.359 1.125 0 O-C-N 124.506 1.793 . . . . 0.0 111.062 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.644 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 4.8 p90 -164.69 -177.55 4.83 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.555 1.16 . . . . 0.0 111.043 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.43 138.44 51.46 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.538 1.149 . . . . 0.0 109.253 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -45.97 117.67 1.6 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.474 1.109 . . . . 0.0 109.283 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 96.48 35.42 5.45 Favored Glycine 0 CA--C 1.529 0.939 0 O-C-N 124.517 1.135 . . . . 0.0 110.985 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -113.86 173.23 6.53 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.508 0.769 . . . . 0.0 109.298 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.456 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 24.1 mt -127.62 149.85 32.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.43 1.081 . . . . 0.0 109.328 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.875 HD13 HG21 ' A' ' 182' ' ' ILE . 0.2 OUTLIER -143.33 139.46 30.1 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.563 1.164 . . . . 0.0 109.283 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.488 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 8.4 ttp180 -87.51 107.06 18.4 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.504 1.127 . . . . 0.0 110.324 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' ILE . . . . . 0.845 HD12 ' O ' ' A' ' 171' ' ' ASN . 10.6 tp -84.45 128.17 39.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.445 1.091 . . . . 0.0 109.325 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.9 ttt180 -128.32 -24.29 3.12 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.506 1.129 . . . . 0.0 110.313 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -127.07 151.93 47.96 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.515 1.134 . . . . 0.0 109.244 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . 0.547 ' HG3' ' CE2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -147.67 80.25 9.07 Favored Pre-proline 0 C--N 1.326 -0.455 0 O-C-N 124.48 1.112 . . . . 0.0 109.289 179.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 -45.91 0.26 Allowed 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.499 1.789 . . . . 0.0 110.99 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 166' ' ' GLU . . . . . . . . . . . . . 62.6 mm-40 -93.11 -173.2 3.19 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.484 1.115 . . . . 0.0 110.305 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -108.16 -11.39 15.27 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.471 1.107 . . . . 0.0 110.261 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -123.64 -32.52 3.33 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.533 1.146 . . . . 0.0 110.306 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -110.51 112.93 25.17 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.562 1.164 . . . . 0.0 107.977 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 170' ' ' TRP . . . . . 0.858 ' CE2' HG21 ' A' ' 184' ' ' VAL . 45.9 m0 -112.69 159.35 19.0 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.527 1.142 . . . . 0.0 107.992 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . 0.845 ' O ' HD12 ' A' ' 161' ' ' ILE . 1.5 t30 -94.65 115.16 27.21 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.507 1.129 . . . . 0.0 109.3 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . 0.768 ' HB3' ' CD1' ' A' ' 182' ' ' ILE . . . -136.58 164.86 27.21 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.521 1.138 . . . . 0.0 109.292 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.615 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 6.5 mp0 -97.77 153.85 18.0 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.518 1.136 . . . . 0.0 110.295 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 174' ' ' ASP . . . . . 0.45 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.4 OUTLIER -85.97 -161.5 0.64 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.541 1.15 . . . . 0.0 109.305 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 1.5 t -81.27 11.93 3.94 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.505 1.128 . . . . 0.0 110.057 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -133.56 -4.53 2.93 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.505 1.128 . . . . 0.0 110.226 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . 0.537 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 103.63 -15.3 53.11 Favored Glycine 0 CA--C 1.531 1.07 0 O-C-N 124.504 1.128 . . . . 0.0 110.994 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . 0.45 ' O ' HD11 ' A' ' 151' ' ' LEU . 2.2 mtpt -46.74 109.04 0.16 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.595 0.82 . . . . 0.0 109.358 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -89.21 123.5 33.5 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.533 1.146 . . . . 0.0 110.281 -179.946 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . 0.502 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.57 -164.08 12.57 Favored Glycine 0 CA--C 1.53 0.982 0 O-C-N 124.5 1.125 . . . . 0.0 111.0 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -103.18 123.83 47.45 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.521 0.777 . . . . 0.0 111.002 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.875 HG21 HD13 ' A' ' 159' ' ' LEU . 0.1 OUTLIER -122.7 152.19 61.66 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.506 1.129 . . . . 0.0 109.315 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 183' ' ' PRO . . . . . 0.743 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.01 129.82 12.69 Favored 'Trans proline' 0 C--N 1.358 1.065 0 O-C-N 124.571 1.827 . . . . 0.0 110.95 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.858 HG21 ' CE2' ' A' ' 170' ' ' TRP . 3.6 t -76.29 -32.24 1.07 Allowed Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.407 1.067 . . . . 0.0 109.203 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 185' ' ' PRO . . . . . 0.822 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -75.1 -24.19 12.9 Favored 'Trans proline' 0 C--N 1.359 1.095 0 O-C-N 124.519 1.8 . . . . 0.0 111.012 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.743 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 9.1 m-85 -96.54 -1.41 47.16 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.53 1.144 . . . . 0.0 111.057 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 187' ' ' VAL . . . . . 0.737 HG22 ' O ' ' A' ' 183' ' ' PRO . 9.4 m -128.57 152.36 36.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 O-C-N 124.575 1.172 . . . . 0.0 109.313 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 188' ' ' GLU . . . . . 0.577 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 2.2 tt0 -97.8 151.76 19.86 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.421 1.076 . . . . 0.0 110.404 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.514 0 O-C-N 124.552 1.157 . . . . 0.0 109.305 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . 0.437 ' O ' ' HG2' ' A' ' 160' ' ' ARG . 67.7 m . . . . . 0 N--CA 1.453 -0.318 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -156.35 167.0 31.78 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.509 1.131 . . . . 0.0 110.937 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.529 HG23 ' N ' ' A' ' 138' ' ' ARG . 0.5 OUTLIER -148.67 167.17 3.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.511 1.132 . . . . 0.0 109.282 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.529 ' N ' HG23 ' A' ' 137' ' ' VAL . 0.1 OUTLIER -128.41 117.03 20.67 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.47 1.106 . . . . 0.0 110.282 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -84.78 109.78 18.32 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.443 1.089 . . . . 0.0 109.304 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.402 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 1.4 mt -89.47 26.12 1.78 Allowed 'General case' 0 C--N 1.323 -0.55 0 O-C-N 124.544 1.153 . . . . 0.0 109.284 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.503 ' CD2' ' CD2' ' A' ' 186' ' ' TYR . 41.1 m-85 -144.3 150.43 37.86 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.489 1.118 . . . . 0.0 111.007 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -94.14 127.02 39.71 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.483 1.114 . . . . 0.0 109.286 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.592 ' CB ' ' CE1' ' A' ' 153' ' ' PHE . 5.0 t80 . . . . . 0 C--N 1.326 -0.448 0 O-C-N 124.41 1.069 . . . . 0.0 110.962 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.672 HD22 ' O ' ' A' ' 172' ' ' ALA . 14.8 tp . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.29 -0.634 . . . . 0.0 109.29 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.11 162.63 36.55 Favored 'Trans proline' 0 C--N 1.36 1.138 0 O-C-N 124.54 1.81 . . . . 0.0 110.98 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.592 ' CE1' ' CB ' ' A' ' 143' ' ' PHE . 8.2 p90 -175.48 178.89 1.55 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.513 1.133 . . . . 0.0 111.003 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . 0.426 ' HD3' ' N ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -123.29 143.71 49.89 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.602 1.189 . . . . 0.0 109.242 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' LYS . . . . . 0.426 ' N ' ' HD3' ' A' ' 154' ' ' LYS . 2.6 ttpt -53.72 114.23 1.48 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.44 1.088 . . . . 0.0 109.256 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 99.35 30.01 6.81 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.488 1.117 . . . . 0.0 111.035 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . 0.439 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 12.4 t70 -107.3 174.41 5.9 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.451 0.736 . . . . 0.0 109.365 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.525 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 32.7 mt -121.32 155.95 25.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 O-C-N 124.482 1.114 . . . . 0.0 109.308 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.728 HD13 HG21 ' A' ' 182' ' ' ILE . 3.2 mt -144.76 148.35 34.01 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.475 1.11 . . . . 0.0 109.289 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.53 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.3 OUTLIER -99.63 107.86 20.1 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.482 1.114 . . . . 0.0 110.291 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' ILE . . . . . 0.686 HG12 ' HB2' ' A' ' 172' ' ' ALA . 1.6 mm -79.83 130.5 35.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.468 1.105 . . . . 0.0 109.292 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.6 ttt-85 -128.23 -25.5 2.97 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.494 1.121 . . . . 0.0 110.309 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -141.73 158.15 44.17 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.504 1.128 . . . . 0.0 109.285 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . 0.558 ' HB3' ' CD1' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -142.4 77.58 17.34 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.554 1.158 . . . . 0.0 109.277 179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 -2.71 12.89 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.454 1.765 . . . . 0.0 110.981 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 166' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 169' ' ' TRP . 11.9 mt-10 -144.6 -171.76 3.67 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.503 1.127 . . . . 0.0 110.359 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -113.38 -16.84 12.4 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.466 1.104 . . . . 0.0 110.275 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.408 ' CD ' ' N ' ' A' ' 168' ' ' GLN . 4.0 mp0 -116.88 -24.59 7.58 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.491 1.12 . . . . 0.0 110.247 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 169' ' ' TRP . . . . . 0.443 ' O ' ' HE1' ' A' ' 181' ' ' MET . 85.9 m95 -125.37 105.58 9.2 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.551 1.157 . . . . 0.0 107.959 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 170' ' ' TRP . . . . . 0.567 ' CE3' HG22 ' A' ' 184' ' ' VAL . 34.4 m0 -103.19 164.36 11.68 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.503 1.127 . . . . 0.0 107.997 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . 0.438 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.8 OUTLIER -99.39 97.48 8.52 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.448 1.092 . . . . 0.0 109.26 -179.949 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . 0.686 ' HB2' HG12 ' A' ' 161' ' ' ILE . . . -124.39 166.87 15.21 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.468 1.105 . . . . 0.0 109.302 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.528 ' CG ' ' O ' ' A' ' 177' ' ' GLY . 0.8 OUTLIER -96.07 159.17 15.1 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.468 1.105 . . . . 0.0 110.298 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 174' ' ' ASP . . . . . 0.576 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.4 OUTLIER -90.28 -160.39 0.69 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.464 1.102 . . . . 0.0 109.249 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 2.5 m -81.24 8.35 9.19 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.505 1.128 . . . . 0.0 109.985 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -128.08 -5.61 5.54 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.491 1.119 . . . . 0.0 110.341 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . 0.528 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 101.06 -9.47 58.02 Favored Glycine 0 CA--C 1.53 0.994 0 O-C-N 124.472 1.108 . . . . 0.0 111.023 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . 0.468 ' O ' HD11 ' A' ' 151' ' ' LEU . 4.7 mtmt -53.74 111.8 0.8 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.469 0.746 . . . . 0.0 109.3 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . 0.444 ' CG ' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.61 122.31 30.35 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.476 1.11 . . . . 0.0 110.238 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . 0.438 ' HA3' ' HB2' ' A' ' 151' ' ' LEU . . . -155.33 -164.98 13.63 Favored Glycine 0 CA--C 1.529 0.93 0 O-C-N 124.478 1.111 . . . . 0.0 111.023 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 181' ' ' MET . . . . . 0.443 ' HE1' ' O ' ' A' ' 169' ' ' TRP . 1.1 mmt -94.55 122.87 37.58 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.488 0.758 . . . . 0.0 110.983 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.728 HG21 HD13 ' A' ' 159' ' ' LEU . 18.0 pt -116.29 141.96 28.65 Favored Pre-proline 0 C--N 1.326 -0.454 0 O-C-N 124.495 1.122 . . . . 0.0 109.294 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 183' ' ' PRO . . . . . 0.839 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.3 Cg_endo -74.99 126.64 10.1 Favored 'Trans proline' 0 C--N 1.36 1.132 0 O-C-N 124.472 1.775 . . . . 0.0 111.044 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.819 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 90.6 t -74.08 -31.21 1.24 Allowed Pre-proline 0 C--N 1.325 -0.491 0 O-C-N 124.541 1.151 . . . . 0.0 109.276 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 185' ' ' PRO . . . . . 0.819 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -75.01 -28.17 9.38 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.493 1.786 . . . . 0.0 111.023 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.643 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.9 m-85 -98.07 2.86 49.18 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.532 1.145 . . . . 0.0 110.938 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 187' ' ' VAL . . . . . 0.839 HG13 ' O ' ' A' ' 183' ' ' PRO . 2.4 m -136.12 162.46 36.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.548 1.155 . . . . 0.0 109.29 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 188' ' ' GLU . . . . . 0.407 ' N ' ' O ' ' A' ' 138' ' ' ARG . 0.1 OUTLIER -116.35 155.3 28.7 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.505 1.128 . . . . 0.0 110.254 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.481 0 O-C-N 124.554 1.159 . . . . 0.0 109.316 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . 0.578 ' HB3' ' CD2' ' A' ' 136' ' ' TYR . 0.5 OUTLIER . . . . . 0 N--CA 1.452 -0.333 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . 0.578 ' CD2' ' HB3' ' A' ' 135' ' ' CYS . 0.4 OUTLIER -143.82 169.52 17.63 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.549 1.156 . . . . 0.0 110.971 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.821 HG12 ' HA ' ' A' ' 189' ' ' LYS . 33.3 m -140.3 161.83 24.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.475 1.109 . . . . 0.0 109.269 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.447 ' O ' HD13 ' A' ' 140' ' ' LEU . 30.5 ttm180 -118.35 113.69 21.8 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.563 1.165 . . . . 0.0 110.247 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.539 ' O ' ' N ' ' A' ' 156' ' ' GLY . . . -82.52 112.31 19.32 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.498 1.123 . . . . 0.0 109.282 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.639 HD22 ' H ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -87.68 21.05 2.71 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.531 1.144 . . . . 0.0 109.229 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.411 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -147.47 164.05 34.59 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.464 1.103 . . . . 0.0 110.996 179.96 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -102.78 156.79 17.4 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.542 1.151 . . . . 0.0 109.309 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.651 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 20.6 t80 . . . . . 0 C--N 1.325 -0.476 0 O-C-N 124.535 1.147 . . . . 0.0 110.969 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 1.082 HD23 HD11 ' A' ' 182' ' ' ILE . 14.5 tp . . . . . 0 N--CA 1.453 -0.324 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.03 145.5 31.4 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.481 1.779 . . . . 0.0 110.975 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.651 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 5.9 p90 -157.5 -177.67 6.76 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.526 1.141 . . . . 0.0 110.999 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.29 140.06 43.11 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.525 1.141 . . . . 0.0 109.285 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 1.0 OUTLIER -43.61 131.13 5.25 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.493 1.12 . . . . 0.0 109.352 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.539 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 78.84 39.72 19.74 Favored Glycine 0 CA--C 1.53 0.997 0 O-C-N 124.548 1.155 . . . . 0.0 111.036 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . 0.42 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 25.2 t70 -116.98 165.66 13.09 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.487 0.757 . . . . 0.0 109.292 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.49 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 11.2 mm -116.9 147.81 20.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.553 1.158 . . . . 0.0 109.327 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.955 HD13 HD13 ' A' ' 182' ' ' ILE . 0.9 OUTLIER -141.84 138.1 31.92 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.434 1.084 . . . . 0.0 109.34 179.972 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.517 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.0 OUTLIER -87.45 102.25 14.37 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.477 1.11 . . . . 0.0 110.352 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' ILE . . . . . 1.018 HD12 ' HB2' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -84.86 123.28 39.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.494 1.121 . . . . 0.0 109.279 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -122.77 -22.89 5.2 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.501 1.125 . . . . 0.0 110.273 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -131.31 152.55 50.46 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.491 1.12 . . . . 0.0 109.265 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . 0.575 ' CB ' ' CG ' ' A' ' 170' ' ' TRP . 3.4 pttp -160.15 66.63 2.62 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 124.519 1.137 . . . . 0.0 109.276 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -75.05 4.26 4.92 Favored 'Trans proline' 0 C--N 1.361 1.191 0 O-C-N 124.445 1.761 . . . . 0.0 110.935 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 166' ' ' GLU . . . . . 0.474 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 9.2 mt-10 -127.65 177.92 6.47 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.567 1.167 . . . . 0.0 110.272 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . 0.505 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 7.3 pt-20 -112.61 33.53 4.9 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.459 1.099 . . . . 0.0 110.302 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.505 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 3.4 mt-30 -175.66 -37.99 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.523 1.14 . . . . 0.0 110.309 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -108.43 100.22 9.53 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.554 1.159 . . . . 0.0 107.983 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 170' ' ' TRP . . . . . 0.814 ' HB2' HD11 ' A' ' 161' ' ' ILE . 37.3 m0 -108.15 153.75 22.71 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.518 1.136 . . . . 0.0 108.013 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 2.8 t30 -88.04 110.23 20.45 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.475 1.11 . . . . 0.0 109.27 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . 1.026 ' HB3' HD12 ' A' ' 182' ' ' ILE . . . -130.37 159.58 36.56 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.529 1.143 . . . . 0.0 109.385 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.557 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.8 OUTLIER -92.26 156.79 17.04 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.458 1.099 . . . . 0.0 110.292 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 174' ' ' ASP . . . . . 0.581 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.5 OUTLIER -91.08 -160.32 0.71 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.498 1.124 . . . . 0.0 109.335 179.968 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.94 8.45 8.35 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.525 1.141 . . . . 0.0 110.004 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -128.66 -5.07 5.23 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.466 1.104 . . . . 0.0 110.287 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . 0.521 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 100.16 -11.01 60.23 Favored Glycine 0 CA--C 1.53 0.999 0 O-C-N 124.449 1.093 . . . . 0.0 111.05 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 10.7 mttp -52.6 111.75 0.7 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.583 0.813 . . . . 0.0 109.293 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -87.19 124.28 33.12 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.523 1.14 . . . . 0.0 110.282 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . 0.456 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -155.13 -168.05 17.73 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.51 1.131 . . . . 0.0 110.906 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -89.19 122.13 32.17 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.441 0.73 . . . . 0.0 111.095 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 1.082 HD11 HD23 ' A' ' 151' ' ' LEU . 62.0 mt -121.29 143.07 36.56 Favored Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.476 1.11 . . . . 0.0 109.265 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 183' ' ' PRO . . . . . 0.771 ' HD2' HG23 ' A' ' 182' ' ' ILE . 18.0 Cg_endo -75.1 133.12 16.06 Favored 'Trans proline' 0 C--N 1.361 1.193 0 O-C-N 124.466 1.772 . . . . 0.0 110.928 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.828 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 42.2 t -80.09 -31.82 0.67 Allowed Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.508 1.13 . . . . 0.0 109.295 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 185' ' ' PRO . . . . . 0.828 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -75.03 -28.14 9.36 Favored 'Trans proline' 0 C--N 1.361 1.208 0 O-C-N 124.443 1.759 . . . . 0.0 110.989 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.605 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 9.7 m-85 -96.9 12.29 32.83 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.418 1.074 . . . . 0.0 111.067 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 187' ' ' VAL . . . . . 0.673 HG13 ' O ' ' A' ' 183' ' ' PRO . 1.7 m -149.55 149.97 14.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.55 1.156 . . . . 0.0 109.257 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 188' ' ' GLU . . . . . 0.503 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.6 OUTLIER -98.36 138.22 35.92 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.48 1.113 . . . . 0.0 110.318 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 189' ' ' LYS . . . . . 0.821 ' HA ' HG12 ' A' ' 137' ' ' VAL . 1.0 OUTLIER . . . . . 0 C--N 1.324 -0.531 0 O-C-N 124.513 1.133 . . . . 0.0 109.283 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . 0.401 ' O ' ' HG2' ' A' ' 160' ' ' ARG . 26.3 p . . . . . 0 N--CA 1.453 -0.312 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . 0.49 ' CE1' ' HB2' ' A' ' 160' ' ' ARG . 5.6 m-85 -155.48 171.69 19.5 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.608 1.193 . . . . 0.0 110.995 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.622 HG22 HG23 ' A' ' 161' ' ' ILE . 3.3 m -145.27 144.4 21.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.501 1.126 . . . . 0.0 109.327 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.738 ' O ' HD13 ' A' ' 140' ' ' LEU . 0.4 OUTLIER -106.31 112.91 26.13 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.543 1.152 . . . . 0.0 110.332 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.435 ' CB ' HG12 ' A' ' 187' ' ' VAL . . . -83.27 105.45 14.24 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.474 1.108 . . . . 0.0 109.276 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.738 HD13 ' O ' ' A' ' 138' ' ' ARG . 0.0 OUTLIER -88.3 26.98 1.31 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.513 1.133 . . . . 0.0 109.236 179.974 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.402 ' CA ' ' HG2' ' A' ' 155' ' ' LYS . 6.4 m-85 -144.58 157.2 44.32 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.511 1.132 . . . . 0.0 110.993 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -93.28 130.89 38.84 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.513 1.133 . . . . 0.0 109.282 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.613 ' HB2' ' CZ ' ' A' ' 153' ' ' PHE . 35.5 t80 . . . . . 0 C--N 1.325 -0.489 0 O-C-N 124.518 1.136 . . . . 0.0 110.981 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.881 HD23 ' CG2' ' A' ' 182' ' ' ILE . 12.2 tp . . . . . 0 N--CA 1.453 -0.294 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.03 150.24 37.72 Favored 'Trans proline' 0 C--N 1.361 1.191 0 O-C-N 124.503 1.791 . . . . 0.0 110.98 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.613 ' CZ ' ' HB2' ' A' ' 143' ' ' PHE . 21.1 p90 -160.45 178.45 9.55 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.51 1.131 . . . . 0.0 110.937 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . 0.415 ' O ' ' C ' ' A' ' 155' ' ' LYS . 1.1 ttpp -126.28 143.5 51.13 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.545 1.153 . . . . 0.0 109.319 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' LYS . . . . . 0.527 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.1 OUTLIER -39.27 128.21 1.77 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.429 1.08 . . . . 0.0 109.267 -180.0 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.474 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 79.6 40.8 14.27 Favored Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.578 1.174 . . . . 0.0 111.033 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . 0.523 ' OD1' HD21 ' A' ' 159' ' ' LEU . 5.0 t70 -111.48 162.41 15.13 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.6 0.824 . . . . 0.0 109.277 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.483 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 75.7 mt -120.39 146.69 24.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.454 1.096 . . . . 0.0 109.271 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.949 HD13 HG21 ' A' ' 182' ' ' ILE . 0.9 OUTLIER -141.53 141.85 33.56 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.538 1.149 . . . . 0.0 109.342 179.978 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.49 ' HB2' ' CE1' ' A' ' 136' ' ' TYR . 9.8 ttm-85 -93.48 102.14 14.35 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.553 1.158 . . . . 0.0 110.319 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' ILE . . . . . 0.838 HG22 ' HB2' ' A' ' 172' ' ' ALA . 0.7 OUTLIER -82.13 125.53 39.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 O-C-N 124.599 1.187 . . . . 0.0 109.278 -179.982 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -121.11 -22.25 6.17 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 124.446 1.091 . . . . 0.0 110.254 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -134.0 144.53 48.78 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.597 1.186 . . . . 0.0 109.268 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . 0.551 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -141.09 80.73 16.66 Favored Pre-proline 0 C--N 1.325 -0.483 0 O-C-N 124.503 1.127 . . . . 0.0 109.317 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.06 -50.35 0.13 Allowed 'Trans proline' 0 C--N 1.359 1.104 0 O-C-N 124.514 1.797 . . . . 0.0 110.929 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 166' ' ' GLU . . . . . 0.425 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 2.0 mt-10 -82.23 179.62 7.74 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 0.0 110.299 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -104.84 9.37 34.82 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.542 1.152 . . . . 0.0 110.284 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -146.55 -42.59 0.19 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.507 1.129 . . . . 0.0 110.279 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 169' ' ' TRP . . . . . 0.402 ' HH2' ' CZ ' ' A' ' 143' ' ' PHE . 68.2 m95 -103.61 111.39 23.85 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.487 1.117 . . . . 0.0 108.002 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 170' ' ' TRP . . . . . 0.681 ' O ' HD13 ' A' ' 182' ' ' ILE . 50.2 m0 -113.71 164.66 13.42 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.54 1.15 . . . . 0.0 107.937 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . 0.483 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -96.75 117.06 30.22 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.457 1.098 . . . . 0.0 109.265 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . 0.838 ' HB2' HG22 ' A' ' 161' ' ' ILE . . . -139.59 163.45 32.53 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.586 1.179 . . . . 0.0 109.284 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.574 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 2.7 mp0 -90.79 157.52 17.34 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.575 1.172 . . . . 0.0 110.31 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 174' ' ' ASP . . . . . 0.53 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 2.0 t0 -92.5 -160.67 0.76 Allowed 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.484 1.115 . . . . 0.0 109.364 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 43.1 t -81.13 6.68 13.05 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.484 1.115 . . . . 0.0 109.971 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -127.03 -3.64 6.37 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.523 1.139 . . . . 0.0 110.37 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . 0.512 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 98.88 -11.34 62.47 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.435 1.084 . . . . 0.0 111.011 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . 0.69 ' O ' HD11 ' A' ' 151' ' ' LEU . 21.4 mttt -51.91 115.79 1.85 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.521 0.777 . . . . 0.0 109.302 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . 0.497 ' HG2' ' CG ' ' A' ' 173' ' ' GLU . 0.5 OUTLIER -86.69 122.05 30.05 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.527 1.142 . . . . 0.0 110.353 179.97 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . 0.726 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -154.82 -166.82 15.71 Favored Glycine 0 CA--C 1.53 1.03 0 O-C-N 124.518 1.136 . . . . 0.0 110.975 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 5.3 ttm -100.4 131.84 46.11 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.533 0.784 . . . . 0.0 110.975 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.949 HG21 HD13 ' A' ' 159' ' ' LEU . 0.2 OUTLIER -126.14 145.79 53.61 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.545 1.153 . . . . 0.0 109.306 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 183' ' ' PRO . . . . . 0.767 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -74.97 123.59 8.01 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.505 1.792 . . . . 0.0 111.021 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.835 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 5.1 t -69.49 -29.87 1.95 Allowed Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.553 1.158 . . . . 0.0 109.303 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 185' ' ' PRO . . . . . 0.835 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.97 -25.23 12.11 Favored 'Trans proline' 0 C--N 1.361 1.209 0 O-C-N 124.491 1.785 . . . . 0.0 111.05 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.767 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.7 m-85 -99.92 0.12 40.59 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.461 1.101 . . . . 0.0 111.013 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 187' ' ' VAL . . . . . 0.712 HG13 ' O ' ' A' ' 183' ' ' PRO . 4.1 m -130.53 152.74 37.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.511 1.132 . . . . 0.0 109.329 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 188' ' ' GLU . . . . . 0.572 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.1 OUTLIER -105.01 166.7 10.2 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.581 1.175 . . . . 0.0 110.291 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.516 0 O-C-N 124.541 1.15 . . . . 0.0 109.295 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . 0.4 ' C ' ' CD1' ' A' ' 136' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.357 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . 0.528 ' N ' ' CD1' ' A' ' 136' ' ' TYR . 0.1 OUTLIER -149.72 167.13 27.32 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.437 1.086 . . . . 0.0 110.999 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.571 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 18.6 m -142.88 150.87 17.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.52 1.138 . . . . 0.0 109.299 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.548 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 17.2 ttt-85 -105.45 117.33 33.75 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.539 1.149 . . . . 0.0 110.305 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.566 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -82.08 110.59 17.45 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.535 1.147 . . . . 0.0 109.268 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.806 HD22 ' H ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -89.09 19.13 4.4 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.532 1.145 . . . . 0.0 109.302 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.458 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 9.6 m-85 -143.62 164.39 30.53 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.511 1.132 . . . . 0.0 110.926 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.53 155.79 17.1 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.433 1.083 . . . . 0.0 109.285 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.508 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 8.0 t80 . . . . . 0 C--N 1.325 -0.467 0 O-C-N 124.578 1.174 . . . . 0.0 110.978 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.881 HD22 ' O ' ' A' ' 172' ' ' ALA . 13.1 tp . . . . . 0 N--CA 1.453 -0.313 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . 0.505 ' HA ' ' O ' ' A' ' 143' ' ' PHE . 18.0 Cg_endo -75.07 159.02 41.59 Favored 'Trans proline' 0 C--N 1.359 1.118 0 O-C-N 124.557 1.82 . . . . 0.0 110.98 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.508 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 0.8 OUTLIER -167.69 -170.78 1.47 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.439 1.087 . . . . 0.0 110.979 -179.921 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -129.2 139.2 51.97 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.491 1.12 . . . . 0.0 109.296 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -46.5 116.93 1.43 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.563 1.165 . . . . 0.0 109.304 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 97.2 39.9 3.88 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.573 1.171 . . . . 0.0 111.041 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . 0.417 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 15.0 t70 -118.46 178.5 4.43 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.457 0.739 . . . . 0.0 109.316 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.502 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 10.5 mt -130.1 145.83 35.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.55 1.156 . . . . 0.0 109.338 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.536 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 0.3 OUTLIER -140.21 140.81 35.93 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.513 1.133 . . . . 0.0 109.251 179.972 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.544 ' HB3' ' HB2' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.94 101.07 13.06 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.533 1.145 . . . . 0.0 110.333 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 161' ' ' ILE . . . . . 1.014 HD12 ' HB2' ' A' ' 172' ' ' ALA . 0.3 OUTLIER -83.03 127.6 39.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.422 1.076 . . . . 0.0 109.325 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 24.3 ptt85 -127.69 -22.91 3.51 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.443 1.089 . . . . 0.0 110.302 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 163' ' ' ASP . . . . . 0.41 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 0.9 OUTLIER -121.51 144.08 48.91 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.552 1.157 . . . . 0.0 109.279 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . 0.577 ' HD3' ' CZ3' ' A' ' 170' ' ' TRP . 57.3 mttt -148.64 69.42 10.24 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.501 1.125 . . . . 0.0 109.299 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.96 -52.06 0.11 Allowed 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.486 1.782 . . . . 0.0 111.057 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 166' ' ' GLU . . . . . 0.462 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.3 mm-40 -80.95 178.23 8.55 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.489 1.118 . . . . 0.0 110.321 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . 0.504 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 8.9 mm-40 -108.25 29.77 7.03 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.488 1.118 . . . . 0.0 110.259 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.504 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 2.1 mt-30 -167.93 -39.71 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.439 1.087 . . . . 0.0 110.311 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -105.25 106.3 16.74 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 170' ' ' TRP . . . . . 0.761 ' HB2' HD11 ' A' ' 161' ' ' ILE . 51.0 m0 -112.22 162.8 15.08 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.478 1.111 . . . . 0.0 108.006 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . 0.508 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 1.1 t-20 -98.11 115.4 28.18 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.511 1.132 . . . . 0.0 109.326 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . 1.014 ' HB2' HD12 ' A' ' 161' ' ' ILE . . . -134.4 158.11 44.71 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.555 1.159 . . . . 0.0 109.291 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.544 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 1.3 mp0 -94.7 156.57 16.34 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.474 1.109 . . . . 0.0 110.272 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 174' ' ' ASP . . . . . 0.564 ' N ' HD21 ' A' ' 151' ' ' LEU . 0.5 OUTLIER -90.43 -162.17 0.87 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.522 1.139 . . . . 0.0 109.317 179.992 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.81 10.0 5.57 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.533 1.145 . . . . 0.0 109.992 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -128.08 -5.73 5.54 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.595 1.184 . . . . 0.0 110.274 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . 0.512 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 99.97 -11.15 60.58 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.505 1.128 . . . . 0.0 110.997 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . 0.541 ' O ' HD11 ' A' ' 151' ' ' LEU . 8.5 mttt -53.23 111.79 0.76 Allowed 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.536 0.786 . . . . 0.0 109.327 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.1 OUTLIER -89.75 127.36 35.94 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.479 1.112 . . . . 0.0 110.314 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . 0.508 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.61 -168.56 18.15 Favored Glycine 0 CA--C 1.529 0.953 0 O-C-N 124.44 1.088 . . . . 0.0 110.967 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -103.46 126.27 50.51 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.446 0.733 . . . . 0.0 111.02 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.745 HG23 ' HB3' ' A' ' 151' ' ' LEU . 2.7 pp -130.42 155.68 80.67 Favored Pre-proline 0 C--N 1.324 -0.51 0 O-C-N 124.496 1.122 . . . . 0.0 109.288 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 183' ' ' PRO . . . . . 0.803 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.0 132.68 15.69 Favored 'Trans proline' 0 C--N 1.361 1.186 0 O-C-N 124.428 1.751 . . . . 0.0 110.993 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.855 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 19.6 t -75.26 -29.63 0.89 Allowed Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 124.501 1.126 . . . . 0.0 109.346 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 185' ' ' PRO . . . . . 0.855 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.0 Cg_endo -75.05 -20.09 17.1 Favored 'Trans proline' 0 C--N 1.361 1.19 0 O-C-N 124.469 1.773 . . . . 0.0 110.94 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.803 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 6.7 m-85 -97.94 2.81 49.46 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.487 1.117 . . . . 0.0 110.993 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 187' ' ' VAL . . . . . 0.566 HG12 ' HA ' ' A' ' 139' ' ' ALA . 6.3 m -137.89 155.1 29.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.479 1.112 . . . . 0.0 109.319 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 188' ' ' GLU . . . . . 0.571 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.8 OUTLIER -105.75 144.88 31.87 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.524 1.14 . . . . 0.0 110.275 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 189' ' ' LYS . . . . . 0.476 ' HA ' HG12 ' A' ' 137' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.487 0 O-C-N 124.517 1.136 . . . . 0.0 109.286 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . 0.409 ' O ' ' HG3' ' A' ' 160' ' ' ARG . 20.1 p . . . . . 0 N--CA 1.452 -0.343 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . 0.455 ' CE1' ' HB2' ' A' ' 160' ' ' ARG . 2.1 m-85 -151.22 161.43 42.73 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.503 1.127 . . . . 0.0 110.967 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.525 ' O ' ' HA ' ' A' ' 158' ' ' ILE . 31.0 m -143.85 146.33 21.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.579 1.174 . . . . 0.0 109.331 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.48 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 5.4 ttp180 -108.64 112.34 24.63 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.492 1.12 . . . . 0.0 110.308 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.522 ' CB ' HG12 ' A' ' 187' ' ' VAL . . . -80.86 109.14 15.14 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.578 1.174 . . . . 0.0 109.348 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.428 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 3.1 mp -88.49 25.02 1.79 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.474 1.109 . . . . 0.0 109.262 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.405 ' O ' ' N ' ' A' ' 155' ' ' LYS . 20.2 t80 -139.18 168.25 20.26 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.445 1.09 . . . . 0.0 111.046 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -113.59 125.63 54.38 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.488 1.118 . . . . 0.0 109.325 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.66 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 1.9 t80 . . . . . 0 C--N 1.325 -0.486 0 O-C-N 124.562 1.164 . . . . 0.0 111.027 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.782 HD12 ' HD2' ' A' ' 152' ' ' PRO . 31.5 tp . . . . . 0 N--CA 1.453 -0.289 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . 0.782 ' HD2' HD12 ' A' ' 151' ' ' LEU . 18.1 Cg_endo -75.05 143.09 28.49 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.467 1.772 . . . . 0.0 110.966 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.66 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 16.7 p90 -157.03 173.16 17.44 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.507 1.129 . . . . 0.0 111.008 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -130.68 137.27 49.48 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.522 1.139 . . . . 0.0 109.33 179.912 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.8 OUTLIER -39.82 108.29 0.08 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.457 1.098 . . . . 0.0 109.298 179.959 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 103.07 33.72 4.21 Favored Glycine 0 CA--C 1.53 1.01 0 O-C-N 124.478 1.111 . . . . 0.0 111.002 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . 0.429 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 15.3 t70 -109.55 168.81 9.12 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.448 0.734 . . . . 0.0 109.296 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.525 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 9.1 mt -126.13 147.06 30.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.525 1.141 . . . . 0.0 109.296 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 1.09 HD13 HG21 ' A' ' 182' ' ' ILE . 4.2 mt -143.5 139.36 29.78 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.556 1.16 . . . . 0.0 109.326 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.518 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -88.44 105.47 17.63 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.475 1.109 . . . . 0.0 110.322 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 161' ' ' ILE . . . . . 0.868 HG22 ' HB2' ' A' ' 172' ' ' ALA . 1.1 pp -81.9 125.89 39.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.506 1.129 . . . . 0.0 109.252 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -121.67 -21.23 6.23 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.552 1.157 . . . . 0.0 110.273 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -131.84 137.69 48.18 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.528 1.142 . . . . 0.0 109.364 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . 0.479 ' CG ' HD13 ' A' ' 161' ' ' ILE . 0.0 OUTLIER -140.15 72.44 33.08 Favored Pre-proline 0 C--N 1.324 -0.511 0 O-C-N 124.496 1.123 . . . . 0.0 109.251 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.04 -49.33 0.15 Allowed 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.465 1.771 . . . . 0.0 111.045 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 166' ' ' GLU . . . . . 0.469 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 5.9 mm-40 -79.38 174.4 11.61 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.469 1.105 . . . . 0.0 110.35 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . 0.534 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 0.0 OUTLIER -105.57 32.17 4.48 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.491 1.119 . . . . 0.0 110.319 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.534 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 3.7 mt-30 -172.57 -37.47 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.444 1.09 . . . . 0.0 110.284 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 169' ' ' TRP . . . . . 0.461 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 83.1 m95 -107.38 107.52 18.46 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.451 1.094 . . . . 0.0 108.057 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 170' ' ' TRP . . . . . 0.604 ' CD2' HG21 ' A' ' 184' ' ' VAL . 51.3 m0 -113.29 158.98 19.85 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.548 1.155 . . . . 0.0 107.994 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . 0.614 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -94.76 118.43 31.74 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.469 1.106 . . . . 0.0 109.336 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . 0.868 ' HB2' HG22 ' A' ' 161' ' ' ILE . . . -132.53 166.16 22.7 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.533 1.145 . . . . 0.0 109.287 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.696 ' HG2' ' N ' ' A' ' 174' ' ' ASP . 0.0 OUTLIER -98.13 160.04 14.55 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.581 1.176 . . . . 0.0 110.302 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 174' ' ' ASP . . . . . 0.696 ' N ' ' HG2' ' A' ' 173' ' ' GLU . 38.9 p-10 -97.44 -156.26 0.53 Allowed 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.506 1.129 . . . . 0.0 109.26 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.06 13.78 7.22 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.492 1.12 . . . . 0.0 110.054 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -136.52 -0.81 2.36 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.505 1.128 . . . . 0.0 110.251 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . 0.663 ' HA2' ' HG3' ' A' ' 173' ' ' GLU . . . 99.27 -19.17 55.06 Favored Glycine 0 CA--C 1.529 0.948 0 O-C-N 124.448 1.092 . . . . 0.0 111.015 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . 0.439 ' HB2' ' CG ' ' A' ' 174' ' ' ASP . 0.1 OUTLIER -47.26 111.1 0.36 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.498 0.764 . . . . 0.0 109.313 179.986 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -93.08 126.81 38.36 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.544 1.152 . . . . 0.0 110.368 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . 0.614 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -149.48 -164.6 11.78 Favored Glycine 0 CA--C 1.531 1.089 0 O-C-N 124.514 1.134 . . . . 0.0 110.979 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 181' ' ' MET . . . . . 0.461 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 16.7 tpp -97.4 128.52 44.27 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.562 0.801 . . . . 0.0 111.001 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 1.09 HG21 HD13 ' A' ' 159' ' ' LEU . 1.4 pp -127.51 144.54 51.3 Favored Pre-proline 0 C--N 1.325 -0.483 0 O-C-N 124.452 1.095 . . . . 0.0 109.317 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 183' ' ' PRO . . . . . 0.745 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.05 124.29 8.48 Favored 'Trans proline' 0 C--N 1.36 1.16 0 O-C-N 124.627 1.856 . . . . 0.0 110.933 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.831 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 37.5 t -71.16 -31.31 1.91 Allowed Pre-proline 0 C--N 1.324 -0.5 0 O-C-N 124.54 1.15 . . . . 0.0 109.322 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 185' ' ' PRO . . . . . 0.831 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -75.06 -23.66 13.48 Favored 'Trans proline' 0 C--N 1.36 1.133 0 O-C-N 124.475 1.776 . . . . 0.0 111.0 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.745 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.9 m-85 -98.23 -2.5 39.55 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.517 1.136 . . . . 0.0 111.005 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 187' ' ' VAL . . . . . 0.692 HG22 ' O ' ' A' ' 183' ' ' PRO . 7.2 m -127.54 153.6 36.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 O-C-N 124.482 1.114 . . . . 0.0 109.315 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 188' ' ' GLU . . . . . 0.505 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 6.0 mm-40 -101.11 160.64 14.22 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.604 1.19 . . . . 0.0 110.295 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.486 0 O-C-N 124.516 1.135 . . . . 0.0 109.296 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . 0.657 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 13.4 p . . . . . 0 N--CA 1.452 -0.346 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . 0.657 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 0.1 OUTLIER -136.4 174.75 10.27 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.422 1.077 . . . . 0.0 110.999 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.985 HG12 ' HA ' ' A' ' 189' ' ' LYS . 21.1 m -138.49 156.91 30.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 O-C-N 124.588 1.18 . . . . 0.0 109.297 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.553 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 13.1 ttp180 -108.35 121.71 45.48 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.476 1.11 . . . . 0.0 110.318 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.516 ' C ' HD13 ' A' ' 140' ' ' LEU . . . -82.51 116.79 22.1 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.427 1.08 . . . . 0.0 109.315 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.661 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -93.33 25.8 3.22 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.477 1.111 . . . . 0.0 109.281 -179.973 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -150.65 163.54 38.26 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.511 1.132 . . . . 0.0 111.015 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.47 128.73 54.76 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.451 1.094 . . . . 0.0 109.332 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.578 ' HB2' ' CZ ' ' A' ' 153' ' ' PHE . 35.9 t80 . . . . . 0 C--N 1.325 -0.458 0 O-C-N 124.452 1.095 . . . . 0.0 110.947 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.792 HD22 ' O ' ' A' ' 172' ' ' ALA . 12.4 tp . . . . . 0 N--CA 1.453 -0.283 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . 0.412 ' O ' ' OD1' ' A' ' 174' ' ' ASP . 18.3 Cg_endo -74.96 165.17 31.91 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.497 1.788 . . . . 0.0 110.949 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.578 ' CZ ' ' HB2' ' A' ' 143' ' ' PHE . 7.7 p90 -170.52 -174.82 1.73 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.493 1.121 . . . . 0.0 110.93 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 157' ' ' ASP . 0.0 OUTLIER -133.67 147.29 51.4 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.493 1.121 . . . . 0.0 109.259 -179.937 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' LYS . . . . . 0.484 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -51.82 120.01 4.84 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.582 1.176 . . . . 0.0 109.253 179.966 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.475 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 86.08 41.07 7.23 Favored Glycine 0 CA--C 1.53 1.019 0 O-C-N 124.512 1.133 . . . . 0.0 110.979 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . 0.484 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 15.1 t70 -114.06 174.3 6.01 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.512 0.772 . . . . 0.0 109.31 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.768 ' O ' HD23 ' A' ' 159' ' ' LEU . 7.3 mm -121.82 154.85 26.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 O-C-N 124.47 1.106 . . . . 0.0 109.337 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.768 HD23 ' O ' ' A' ' 158' ' ' ILE . 6.2 mt -146.96 137.73 23.79 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.508 1.13 . . . . 0.0 109.302 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.584 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 5.0 ttm180 -87.06 109.02 19.13 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.56 1.162 . . . . 0.0 110.324 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 161' ' ' ILE . . . . . 0.495 ' CD1' ' HB2' ' A' ' 172' ' ' ALA . 0.5 OUTLIER -79.99 125.38 38.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.563 1.165 . . . . 0.0 109.261 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -118.86 -25.03 6.41 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.516 1.135 . . . . 0.0 110.345 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -147.59 153.68 39.72 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.421 1.076 . . . . 0.0 109.227 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . 0.562 ' HB2' ' CD2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -155.49 68.96 5.29 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.509 1.13 . . . . 0.0 109.268 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.95 -42.08 0.58 Allowed 'Trans proline' 0 C--N 1.359 1.103 0 O-C-N 124.535 1.808 . . . . 0.0 111.02 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 166' ' ' GLU . . . . . 0.491 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 10.7 mp0 -82.3 176.36 9.52 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.489 1.118 . . . . 0.0 110.321 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -114.94 48.98 1.08 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.478 1.112 . . . . 0.0 110.324 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.426 ' NE2' ' HG3' ' A' ' 185' ' ' PRO . 0.0 OUTLIER 171.96 -35.15 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.552 1.158 . . . . 0.0 110.255 -179.919 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 169' ' ' TRP . . . . . 0.514 ' CE3' ' HG2' ' A' ' 181' ' ' MET . 61.2 m95 -116.71 99.7 7.31 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.468 1.105 . . . . 0.0 108.028 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 170' ' ' TRP . . . . . 0.717 ' CE2' HG21 ' A' ' 184' ' ' VAL . 51.0 m0 -105.34 166.42 10.43 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . 0.427 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.6 OUTLIER -103.51 108.85 20.29 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.48 1.112 . . . . 0.0 109.308 179.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . 0.792 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -134.82 166.24 23.42 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.488 1.118 . . . . 0.0 109.295 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.554 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.8 OUTLIER -90.48 155.94 18.55 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.479 1.112 . . . . 0.0 110.32 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 174' ' ' ASP . . . . . 0.428 ' HA ' HD22 ' A' ' 159' ' ' LEU . 0.2 OUTLIER -88.71 -161.88 0.8 Allowed 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.478 1.111 . . . . 0.0 109.293 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 40.7 t -79.68 8.01 7.4 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.536 1.148 . . . . 0.0 110.023 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -129.37 -4.52 4.86 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.489 1.118 . . . . 0.0 110.346 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . 0.53 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 101.49 -11.64 58.14 Favored Glycine 0 CA--C 1.53 1.019 0 O-C-N 124.508 1.13 . . . . 0.0 111.014 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . 0.601 ' O ' HD11 ' A' ' 151' ' ' LEU . 4.3 mttm -52.58 113.43 1.06 Allowed 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.458 0.74 . . . . 0.0 109.28 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . 0.463 ' CG ' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.72 121.26 28.98 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.509 1.131 . . . . 0.0 110.316 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . 0.562 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -155.15 -164.23 12.85 Favored Glycine 0 CA--C 1.531 1.032 0 O-C-N 124.475 1.11 . . . . 0.0 111.009 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 181' ' ' MET . . . . . 0.514 ' HG2' ' CE3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -96.45 124.32 40.4 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.535 0.785 . . . . 0.0 110.996 -179.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.79 HG22 ' HB3' ' A' ' 151' ' ' LEU . 0.2 OUTLIER -122.09 148.7 52.43 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.56 1.162 . . . . 0.0 109.32 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 183' ' ' PRO . . . . . 0.811 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.3 Cg_endo -75.04 129.38 12.25 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.503 1.791 . . . . 0.0 110.979 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.829 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 79.9 t -75.43 -31.91 1.14 Allowed Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.477 1.11 . . . . 0.0 109.243 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 185' ' ' PRO . . . . . 0.829 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.2 Cg_endo -75.06 -24.77 12.41 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.508 1.794 . . . . 0.0 110.964 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.776 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 5.4 m-85 -98.52 1.67 46.81 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.55 1.156 . . . . 0.0 110.992 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 187' ' ' VAL . . . . . 0.811 HG13 ' O ' ' A' ' 183' ' ' PRO . 2.5 m -135.06 145.82 31.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.438 1.086 . . . . 0.0 109.32 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 188' ' ' GLU . . . . . 0.567 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.5 OUTLIER -104.1 140.63 37.52 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.481 1.113 . . . . 0.0 110.256 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 189' ' ' LYS . . . . . 0.985 ' HA ' HG12 ' A' ' 137' ' ' VAL . 1.3 tmtm? . . . . . 0 C--N 1.326 -0.443 0 O-C-N 124.505 1.128 . . . . 0.0 109.308 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 160' ' ' ARG . 99.3 m . . . . . 0 N--CA 1.453 -0.316 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . 0.494 ' CE1' ' HD2' ' A' ' 160' ' ' ARG . 6.2 m-85 -152.9 167.55 28.73 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.509 1.131 . . . . 0.0 111.021 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.773 HG22 ' O ' ' A' ' 159' ' ' LEU . 16.6 m -142.93 137.26 26.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 O-C-N 124.496 1.122 . . . . 0.0 109.348 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.69 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 9.5 ttm180 -100.78 106.78 18.22 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.523 1.139 . . . . 0.0 110.269 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.779 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -80.36 104.47 10.93 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.486 1.116 . . . . 0.0 109.324 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.613 HD12 ' O ' ' A' ' 138' ' ' ARG . 6.5 mp -90.02 28.86 1.3 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.487 1.117 . . . . 0.0 109.36 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.475 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 34.0 m-85 -144.22 145.21 31.92 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.436 1.085 . . . . 0.0 111.011 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.09 131.62 35.86 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.452 1.095 . . . . 0.0 109.322 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.486 ' O ' ' CB ' ' A' ' 152' ' ' PRO . 2.5 t80 . . . . . 0 C--N 1.326 -0.456 0 O-C-N 124.521 1.138 . . . . 0.0 111.005 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.785 HD21 ' O ' ' A' ' 178' ' ' LYS . 8.0 tp . . . . . 0 N--CA 1.453 -0.301 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . 0.486 ' CB ' ' O ' ' A' ' 143' ' ' PHE . 18.0 Cg_endo -75.06 169.23 23.05 Favored 'Trans proline' 0 C--N 1.36 1.146 0 O-C-N 124.507 1.793 . . . . 0.0 110.915 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.475 ' CE1' ' O ' ' A' ' 141' ' ' PHE . 0.8 OUTLIER -172.87 -170.82 0.7 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.488 1.118 . . . . 0.0 110.949 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . 0.462 ' O ' ' HG3' ' A' ' 154' ' ' LYS . 0.0 OUTLIER -125.78 140.07 52.99 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.454 1.096 . . . . 0.0 109.296 179.972 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' LYS . . . . . 0.522 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 1.3 tmmm? -45.85 117.02 1.35 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.507 1.129 . . . . 0.0 109.287 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.454 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 93.33 29.72 9.94 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.523 1.139 . . . . 0.0 110.99 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -100.55 169.36 9.12 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.519 0.776 . . . . 0.0 109.311 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.493 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 9.1 mt -122.24 147.06 26.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.556 1.16 . . . . 0.0 109.31 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.773 ' O ' HG22 ' A' ' 137' ' ' VAL . 0.2 OUTLIER -141.02 136.89 32.54 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.547 1.154 . . . . 0.0 109.316 179.978 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.494 ' HD2' ' CE1' ' A' ' 136' ' ' TYR . 0.2 OUTLIER -88.12 111.02 21.12 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.601 1.188 . . . . 0.0 110.309 179.96 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 161' ' ' ILE . . . . . 1.045 HD12 ' HB2' ' A' ' 172' ' ' ALA . 0.5 OUTLIER -80.48 125.21 39.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.551 1.157 . . . . 0.0 109.36 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -116.74 -26.51 6.95 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.532 1.145 . . . . 0.0 110.3 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 163' ' ' ASP . . . . . 0.465 ' OD2' ' CB ' ' A' ' 171' ' ' ASN . 0.0 OUTLIER -149.11 157.3 43.27 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.461 1.101 . . . . 0.0 109.353 -179.978 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . 0.54 ' HG3' ' CE2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -145.88 92.15 5.46 Favored Pre-proline 0 C--N 1.325 -0.46 0 O-C-N 124.464 1.102 . . . . 0.0 109.278 179.994 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.03 -49.71 0.14 Allowed 'Trans proline' 0 C--N 1.361 1.201 0 O-C-N 124.478 1.778 . . . . 0.0 111.061 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 166' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' A' ' 169' ' ' TRP . 12.5 mt-10 -88.92 -177.53 5.5 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.596 1.185 . . . . 0.0 110.306 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -106.52 -9.78 16.49 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.507 1.13 . . . . 0.0 110.315 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -120.29 -27.66 5.19 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.539 1.15 . . . . 0.0 110.29 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 169' ' ' TRP . . . . . 0.474 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 59.7 m95 -121.65 117.75 27.46 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.543 1.152 . . . . 0.0 107.95 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 170' ' ' TRP . . . . . 0.862 ' CE2' HG21 ' A' ' 184' ' ' VAL . 33.9 m0 -114.2 165.08 13.04 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.519 1.137 . . . . 0.0 107.947 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . 0.467 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.4 OUTLIER -100.37 115.2 29.45 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.493 1.121 . . . . 0.0 109.295 -179.98 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . 1.045 ' HB2' HD12 ' A' ' 161' ' ' ILE . . . -136.79 168.44 19.53 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.521 1.138 . . . . 0.0 109.238 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.693 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.8 OUTLIER -97.38 154.57 17.37 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.483 1.114 . . . . 0.0 110.305 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 174' ' ' ASP . . . . . 0.546 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.1 OUTLIER -88.29 -163.97 1.05 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.551 1.157 . . . . 0.0 109.325 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 23.2 t -77.9 9.46 3.56 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.482 1.114 . . . . 0.0 109.982 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -128.66 -5.66 5.19 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.495 1.122 . . . . 0.0 110.276 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . 0.539 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 99.9 -11.31 60.7 Favored Glycine 0 CA--C 1.53 1.028 0 O-C-N 124.445 1.091 . . . . 0.0 110.94 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . 0.785 ' O ' HD21 ' A' ' 151' ' ' LEU . 0.8 OUTLIER -53.39 112.47 0.9 Allowed 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.505 0.768 . . . . 0.0 109.306 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . 0.45 ' HG2' ' CD ' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.59 124.61 33.07 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.499 1.124 . . . . 0.0 110.322 -179.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . 0.705 ' HA3' HD13 ' A' ' 151' ' ' LEU . . . -155.73 -165.44 14.39 Favored Glycine 0 CA--C 1.53 0.971 0 O-C-N 124.473 1.108 . . . . 0.0 111.019 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 181' ' ' MET . . . . . 0.474 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -99.64 131.29 45.73 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.479 0.753 . . . . 0.0 111.003 179.99 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.752 HG21 HD13 ' A' ' 159' ' ' LEU . 2.2 pp -132.62 148.88 71.35 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.466 1.104 . . . . 0.0 109.312 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 183' ' ' PRO . . . . . 0.743 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.0 129.71 12.59 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.488 1.783 . . . . 0.0 111.045 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.862 HG21 ' CE2' ' A' ' 170' ' ' TRP . 54.6 t -74.5 -31.53 1.23 Allowed Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.49 1.119 . . . . 0.0 109.319 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 185' ' ' PRO . . . . . 0.834 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.93 -17.43 19.75 Favored 'Trans proline' 0 C--N 1.36 1.172 0 O-C-N 124.509 1.794 . . . . 0.0 111.06 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.743 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 5.2 m-85 -98.33 -12.61 21.33 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.46 1.1 . . . . 0.0 111.019 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 187' ' ' VAL . . . . . 0.779 HG12 ' HA ' ' A' ' 139' ' ' ALA . 2.3 m -126.97 157.01 38.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.503 1.127 . . . . 0.0 109.385 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 188' ' ' GLU . . . . . 0.47 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 3.4 pt-20 -98.13 161.8 13.53 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.44 1.087 . . . . 0.0 110.297 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.471 0 O-C-N 124.51 1.131 . . . . 0.0 109.249 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 85.6 m . . . . . 0 N--CA 1.453 -0.317 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . 0.428 ' HA ' ' O ' ' A' ' 159' ' ' LEU . 14.6 m-85 -129.81 177.31 7.35 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.509 1.131 . . . . 0.0 110.963 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.516 HG23 ' N ' ' A' ' 138' ' ' ARG . 1.4 m -149.79 166.77 2.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.402 1.064 . . . . 0.0 109.284 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.516 ' N ' HG23 ' A' ' 137' ' ' VAL . 2.3 ttt-85 -128.15 116.27 19.68 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.463 1.102 . . . . 0.0 110.235 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.496 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -83.87 107.25 16.15 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.528 1.142 . . . . 0.0 109.283 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.515 ' C ' ' HG2' ' A' ' 155' ' ' LYS . 1.1 mp -88.54 26.52 1.45 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.59 1.181 . . . . 0.0 109.356 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.601 ' CD1' ' HA ' ' A' ' 186' ' ' TYR . 84.2 m-85 -153.4 146.61 24.7 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.444 1.09 . . . . 0.0 110.993 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.89 153.79 34.38 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.54 1.15 . . . . 0.0 109.304 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.639 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.512 0 O-C-N 124.527 1.142 . . . . 0.0 111.044 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.886 HD22 ' O ' ' A' ' 172' ' ' ALA . 15.5 tp . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.0 167.26 27.45 Favored 'Trans proline' 0 C--N 1.361 1.189 0 O-C-N 124.529 1.805 . . . . 0.0 111.056 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.639 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 4.7 p90 -178.05 -178.77 0.69 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.525 1.14 . . . . 0.0 110.983 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.47 142.44 47.15 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.492 1.12 . . . . 0.0 109.302 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' LYS . . . . . 0.515 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -46.0 119.34 2.22 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.504 1.127 . . . . 0.0 109.288 179.962 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.455 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 88.57 40.74 6.27 Favored Glycine 0 CA--C 1.53 0.999 0 O-C-N 124.541 1.151 . . . . 0.0 111.027 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . 0.451 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 37.0 t70 -111.14 167.8 9.99 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.481 0.754 . . . . 0.0 109.297 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.499 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 2.3 mp -116.68 149.93 18.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.505 1.128 . . . . 0.0 109.303 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.654 HD13 ' CG2' ' A' ' 182' ' ' ILE . 1.0 OUTLIER -141.74 146.01 35.5 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.494 1.121 . . . . 0.0 109.276 179.943 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.468 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.9 OUTLIER -93.68 101.77 13.92 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.478 1.111 . . . . 0.0 110.3 179.968 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 161' ' ' ILE . . . . . 0.555 HD11 ' HB3' ' A' ' 170' ' ' TRP . 9.4 tp -79.23 128.47 38.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.488 1.118 . . . . 0.0 109.343 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.21 -26.18 3.69 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.525 1.14 . . . . 0.0 110.254 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 163' ' ' ASP . . . . . 0.406 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 45.9 m-20 -137.39 140.91 41.67 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.485 1.116 . . . . 0.0 109.295 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . 0.591 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -146.79 69.34 12.11 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.542 1.151 . . . . 0.0 109.378 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . 0.404 ' HG2' ' OE1' ' A' ' 166' ' ' GLU . 18.4 Cg_endo -75.0 -44.08 0.36 Allowed 'Trans proline' 0 C--N 1.359 1.104 0 O-C-N 124.499 1.789 . . . . 0.0 111.037 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 166' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 169' ' ' TRP . 6.6 mp0 -81.03 171.02 15.49 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.503 1.127 . . . . 0.0 110.315 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . 0.425 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 12.5 pm0 -112.41 52.39 0.77 Allowed 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.459 1.099 . . . . 0.0 110.261 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.51 ' O ' HG23 ' A' ' 184' ' ' VAL . 0.1 OUTLIER 169.75 -31.68 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.517 1.136 . . . . 0.0 110.316 179.937 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 169' ' ' TRP . . . . . 0.452 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 73.3 m95 -125.52 101.4 6.91 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.562 1.164 . . . . 0.0 107.967 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 170' ' ' TRP . . . . . 0.83 ' CE2' HG21 ' A' ' 184' ' ' VAL . 10.2 m0 -106.86 174.71 5.77 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.534 1.146 . . . . 0.0 107.982 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . 0.46 ' O ' HD12 ' A' ' 161' ' ' ILE . 0.7 OUTLIER -109.06 113.48 26.39 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 124.522 1.139 . . . . 0.0 109.282 -179.998 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . 0.886 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -136.55 164.01 29.19 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.534 1.146 . . . . 0.0 109.373 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.581 ' O ' ' HB3' ' A' ' 159' ' ' LEU . 7.5 mp0 -89.32 153.38 20.92 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.466 1.104 . . . . 0.0 110.345 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 174' ' ' ASP . . . . . 0.518 ' N ' HD21 ' A' ' 151' ' ' LEU . 0.5 OUTLIER -88.1 -159.74 0.57 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.521 1.138 . . . . 0.0 109.353 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 94.4 p -81.71 9.85 7.12 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.472 1.108 . . . . 0.0 109.995 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -131.11 -5.34 3.89 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.511 1.132 . . . . 0.0 110.239 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . 0.512 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 100.96 -11.16 58.87 Favored Glycine 0 CA--C 1.532 1.094 0 O-C-N 124.547 1.154 . . . . 0.0 110.966 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . 0.534 ' O ' HD11 ' A' ' 151' ' ' LEU . 3.3 mttp -54.5 114.69 1.77 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.511 0.771 . . . . 0.0 109.234 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . 0.54 ' CG ' ' CD ' ' A' ' 173' ' ' GLU . 1.1 mtm180 -86.45 123.86 32.14 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.464 1.102 . . . . 0.0 110.279 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . 0.439 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.91 -169.16 19.2 Favored Glycine 0 CA--C 1.531 1.035 0 O-C-N 124.475 1.109 . . . . 0.0 111.022 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 181' ' ' MET . . . . . 0.452 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.1 OUTLIER -88.24 119.12 28.34 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.519 0.776 . . . . 0.0 111.044 179.971 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.685 HG12 ' HB3' ' A' ' 172' ' ' ALA . 1.6 pp -108.86 133.74 20.58 Favored Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.515 1.135 . . . . 0.0 109.318 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 183' ' ' PRO . . . . . 0.845 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.2 Cg_endo -75.05 126.37 9.9 Favored 'Trans proline' 0 C--N 1.359 1.114 0 O-C-N 124.45 1.763 . . . . 0.0 110.952 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.838 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 60.5 t -71.71 -29.76 1.39 Allowed Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 124.445 1.09 . . . . 0.0 109.238 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 185' ' ' PRO . . . . . 0.838 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -74.99 -29.43 8.25 Favored 'Trans proline' 0 C--N 1.359 1.13 0 O-C-N 124.461 1.769 . . . . 0.0 110.994 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.7 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 5.5 m-85 -100.33 -0.67 37.92 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.531 1.144 . . . . 0.0 110.966 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 187' ' ' VAL . . . . . 0.845 HG13 ' O ' ' A' ' 183' ' ' PRO . 1.4 m -137.11 160.73 36.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.51 1.131 . . . . 0.0 109.327 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 188' ' ' GLU . . . . . 0.465 ' O ' ' HB ' ' A' ' 137' ' ' VAL . 6.9 tp10 -116.76 149.94 39.1 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.538 1.148 . . . . 0.0 110.25 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.477 0 O-C-N 124.463 1.102 . . . . 0.0 109.284 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . 0.677 ' O ' ' CD1' ' A' ' 136' ' ' TYR . 3.6 p . . . . . 0 N--CA 1.453 -0.322 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . 0.677 ' CD1' ' O ' ' A' ' 135' ' ' CYS . 8.8 m-85 -149.38 179.98 7.52 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.419 1.074 . . . . 0.0 111.045 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.493 HG11 HG13 ' A' ' 161' ' ' ILE . 24.0 m -144.06 143.87 23.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 124.427 1.079 . . . . 0.0 109.307 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.606 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 28.0 ttm-85 -104.26 111.46 24.08 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.476 1.11 . . . . 0.0 110.306 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.759 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -79.63 107.25 12.25 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.526 1.142 . . . . 0.0 109.336 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.46 ' O ' ' HE2' ' A' ' 155' ' ' LYS . 7.4 mp -89.89 29.53 1.18 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.521 1.138 . . . . 0.0 109.278 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.606 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 42.7 m-85 -148.28 151.7 35.87 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.446 1.092 . . . . 0.0 111.011 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -93.82 133.17 37.5 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.558 1.161 . . . . 0.0 109.273 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.621 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 12.0 t80 . . . . . 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 0.0 111.027 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.96 HD23 HD11 ' A' ' 182' ' ' ILE . 10.5 tp . . . . . 0 N--CA 1.453 -0.286 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . 0.538 ' HA ' ' O ' ' A' ' 143' ' ' PHE . 18.4 Cg_endo -75.01 166.07 29.96 Favored 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.398 1.736 . . . . 0.0 111.018 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.621 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 3.5 p90 -166.18 -177.18 4.01 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.525 1.14 . . . . 0.0 111.015 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . 0.578 ' O ' ' C ' ' A' ' 155' ' ' LYS . 2.0 ttmt -133.82 129.79 37.02 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.476 1.11 . . . . 0.0 109.301 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' LYS . . . . . 0.578 ' C ' ' O ' ' A' ' 154' ' ' LYS . 12.5 ttmt -25.33 123.37 0.06 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.579 1.174 . . . . 0.0 109.373 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 74.36 49.94 10.96 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 124.49 1.119 . . . . 0.0 110.988 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . 0.452 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 28.8 t0 -113.41 165.2 12.69 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.516 0.774 . . . . 0.0 109.355 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.571 HD11 ' NH1' ' A' ' 138' ' ' ARG . 1.3 mp -118.36 148.63 21.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.47 1.106 . . . . 0.0 109.298 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.857 HD13 HD13 ' A' ' 182' ' ' ILE . 1.3 mt -147.14 138.78 24.17 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.527 1.142 . . . . 0.0 109.307 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.56 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.8 OUTLIER -87.63 106.2 17.86 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.572 1.17 . . . . 0.0 110.272 -179.95 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 161' ' ' ILE . . . . . 0.873 ' CD1' ' HB2' ' A' ' 172' ' ' ALA . 2.2 mm -82.98 125.98 40.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.486 1.116 . . . . 0.0 109.268 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 10.5 ttt180 -127.62 -26.21 3.02 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.524 1.14 . . . . 0.0 110.277 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 163' ' ' ASP . . . . . 0.491 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -126.65 140.52 52.35 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.55 1.156 . . . . 0.0 109.344 179.981 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . 0.5 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 1.7 mtmt -146.32 63.4 8.82 Favored Pre-proline 0 C--N 1.324 -0.502 0 O-C-N 124.487 1.117 . . . . 0.0 109.312 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . 0.43 ' HD3' ' N ' ' A' ' 164' ' ' LYS . 18.5 Cg_endo -74.98 6.96 3.07 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.491 1.785 . . . . 0.0 110.995 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 166' ' ' GLU . . . . . 0.467 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 5.5 mm-40 -135.66 176.04 9.04 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.557 1.16 . . . . 0.0 110.282 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . 0.539 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 4.2 mm-40 -113.73 35.79 3.92 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.539 1.149 . . . . 0.0 110.244 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.539 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 0.4 OUTLIER -174.93 -37.84 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.48 1.112 . . . . 0.0 110.361 179.974 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 169' ' ' TRP . . . . . 0.45 ' O ' ' HB2' ' A' ' 166' ' ' GLU . 76.6 m95 -113.56 104.77 12.59 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 170' ' ' TRP . . . . . 0.698 ' CE2' HG21 ' A' ' 184' ' ' VAL . 38.7 m0 -111.2 159.91 17.45 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . 0.534 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -96.91 114.3 25.91 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.43 1.081 . . . . 0.0 109.296 179.969 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . 1.04 ' HB3' HD12 ' A' ' 182' ' ' ILE . . . -128.64 167.69 16.83 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.506 1.128 . . . . 0.0 109.29 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.529 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 2.0 mp0 -97.48 157.28 16.09 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.48 1.112 . . . . 0.0 110.38 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 174' ' ' ASP . . . . . 0.453 ' OD1' ' N ' ' A' ' 177' ' ' GLY . 46.2 p-10 -95.14 -159.92 0.75 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.478 1.111 . . . . 0.0 109.291 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 44.6 t -81.32 12.29 3.71 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.562 1.163 . . . . 0.0 109.97 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -132.31 -3.72 3.44 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.443 1.09 . . . . 0.0 110.346 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . 0.518 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 97.29 -12.25 65.17 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.494 1.122 . . . . 0.0 111.003 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . 0.45 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 0.1 OUTLIER -54.78 115.17 2.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.492 0.76 . . . . 0.0 109.306 -179.965 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . 0.435 ' HG2' ' CD ' ' A' ' 173' ' ' GLU . 0.3 OUTLIER -88.72 127.78 35.6 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.487 1.117 . . . . 0.0 110.286 -179.973 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . 0.534 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -153.48 -171.77 21.0 Favored Glycine 0 CA--C 1.529 0.946 0 O-C-N 124.441 1.088 . . . . 0.0 111.019 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 181' ' ' MET . . . . . 0.445 ' O ' ' N ' ' A' ' 151' ' ' LEU . 0.0 OUTLIER -86.4 135.34 33.53 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.492 0.76 . . . . 0.0 111.039 179.939 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 1.04 HD12 ' HB3' ' A' ' 172' ' ' ALA . 30.4 mt -134.09 137.67 28.77 Favored Pre-proline 0 C--N 1.325 -0.466 0 O-C-N 124.422 1.076 . . . . 0.0 109.315 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 183' ' ' PRO . . . . . 0.73 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.1 Cg_endo -75.03 121.87 6.84 Favored 'Trans proline' 0 C--N 1.36 1.152 0 O-C-N 124.508 1.794 . . . . 0.0 111.027 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.84 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 24.6 t -69.5 -29.32 1.75 Allowed Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.536 1.147 . . . . 0.0 109.26 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 185' ' ' PRO . . . . . 0.84 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.98 -23.68 13.6 Favored 'Trans proline' 0 C--N 1.359 1.09 0 O-C-N 124.538 1.81 . . . . 0.0 111.012 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.73 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.6 m-85 -99.42 -3.12 34.46 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.521 1.138 . . . . 0.0 111.0 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 187' ' ' VAL . . . . . 0.759 HG12 ' HA ' ' A' ' 139' ' ' ALA . 5.2 m -130.34 162.41 38.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.542 1.151 . . . . 0.0 109.265 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 188' ' ' GLU . . . . . 0.484 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 1.0 OUTLIER -110.67 158.2 18.87 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.583 1.177 . . . . 0.0 110.286 179.993 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.512 0 O-C-N 124.505 1.128 . . . . 0.0 109.274 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . 0.43 ' O ' ' CD1' ' A' ' 136' ' ' TYR . 8.9 t . . . . . 0 N--CA 1.453 -0.296 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . 0.43 ' CD1' ' O ' ' A' ' 135' ' ' CYS . 36.3 m-85 -150.99 164.0 37.41 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.405 1.066 . . . . 0.0 111.062 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.754 HG12 ' HA ' ' A' ' 189' ' ' LYS . 15.4 m -138.61 165.72 24.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.573 1.171 . . . . 0.0 109.332 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.598 ' HA ' HD13 ' A' ' 158' ' ' ILE . 16.1 ttp180 -124.04 112.93 17.74 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.475 1.109 . . . . 0.0 110.321 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.554 ' O ' ' N ' ' A' ' 156' ' ' GLY . . . -83.36 103.93 13.12 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.498 1.123 . . . . 0.0 109.305 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.407 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 0.7 OUTLIER -88.87 27.82 1.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.449 1.093 . . . . 0.0 109.41 179.93 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.456 ' CD1' ' HA ' ' A' ' 186' ' ' TYR . 58.1 m-85 -147.86 151.3 35.69 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.497 1.123 . . . . 0.0 110.98 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -88.9 126.21 35.28 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.536 1.148 . . . . 0.0 109.317 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.626 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 3.0 t80 . . . . . 0 C--N 1.324 -0.51 0 O-C-N 124.445 1.09 . . . . 0.0 111.007 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.753 HD23 ' CG2' ' A' ' 182' ' ' ILE . 15.8 tp . . . . . 0 N--CA 1.452 -0.342 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.03 162.34 37.22 Favored 'Trans proline' 0 C--N 1.36 1.168 0 O-C-N 124.465 1.771 . . . . 0.0 110.984 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.626 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 17.9 p90 -178.69 177.32 0.89 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.478 1.111 . . . . 0.0 111.01 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.57 140.7 49.48 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.512 1.132 . . . . 0.0 109.311 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.1 OUTLIER -45.28 131.01 8.18 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.527 1.142 . . . . 0.0 109.313 179.887 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 85.85 22.71 48.63 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 124.441 1.088 . . . . 0.0 111.002 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . 0.407 ' O ' HD13 ' A' ' 158' ' ' ILE . 30.9 t70 -99.07 167.9 10.42 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.504 0.767 . . . . 0.0 109.269 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.598 HD13 ' HA ' ' A' ' 138' ' ' ARG . 51.5 mm -120.72 146.89 24.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.567 1.167 . . . . 0.0 109.306 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.632 HD13 ' CG2' ' A' ' 182' ' ' ILE . 0.9 OUTLIER -136.92 138.45 40.66 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.432 1.082 . . . . 0.0 109.347 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.42 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 5.0 mtm180 -87.67 96.41 10.42 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.513 1.133 . . . . 0.0 110.311 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 161' ' ' ILE . . . . . 0.853 HD11 ' HD2' ' A' ' 164' ' ' LYS . 0.0 OUTLIER -84.44 125.85 40.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.431 1.082 . . . . 0.0 109.296 -179.951 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . 0.453 ' CG ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -119.04 -21.76 7.54 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.58 1.175 . . . . 0.0 110.322 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 163' ' ' ASP . . . . . 0.634 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -136.6 149.87 48.26 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.472 1.107 . . . . 0.0 109.307 -179.993 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . 0.853 ' HD2' HD11 ' A' ' 161' ' ' ILE . 0.0 OUTLIER -155.48 74.17 5.35 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.488 1.118 . . . . 0.0 109.312 179.981 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 -38.34 1.64 Allowed 'Trans proline' 0 C--N 1.359 1.108 0 O-C-N 124.51 1.795 . . . . 0.0 111.086 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 166' ' ' GLU . . . . . 0.446 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.5 mm-40 -85.69 171.49 11.59 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.545 1.153 . . . . 0.0 110.271 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -110.49 50.42 0.81 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.589 1.181 . . . . 0.0 110.336 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 170.66 -32.19 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.435 1.085 . . . . 0.0 110.259 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -120.65 100.54 7.18 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.514 1.133 . . . . 0.0 107.974 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 170' ' ' TRP . . . . . 0.686 ' CE2' HG21 ' A' ' 184' ' ' VAL . 40.8 m0 -105.8 164.26 12.07 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.492 1.12 . . . . 0.0 107.991 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . 0.449 ' HB3' ' OD1' ' A' ' 163' ' ' ASP . 1.6 m-20 -98.91 114.08 26.52 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.441 1.088 . . . . 0.0 109.343 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . 0.654 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -139.0 166.31 24.83 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.466 1.103 . . . . 0.0 109.288 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.558 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 2.1 mp0 -95.8 157.45 15.89 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.493 1.121 . . . . 0.0 110.369 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 174' ' ' ASP . . . . . 0.517 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.1 OUTLIER -89.84 -163.46 1.01 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.515 1.135 . . . . 0.0 109.32 -179.993 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 60.8 p -80.31 9.65 5.53 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.489 1.118 . . . . 0.0 110.024 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -131.08 -4.92 3.91 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.522 1.139 . . . . 0.0 110.31 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . 0.509 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 103.14 -11.45 55.39 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 124.53 1.144 . . . . 0.0 111.008 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . 0.627 ' O ' HD11 ' A' ' 151' ' ' LEU . 2.6 mttt -52.51 111.7 0.69 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.483 0.755 . . . . 0.0 109.286 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 179' ' ' ARG . 0.1 OUTLIER -88.79 123.51 33.26 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.451 1.094 . . . . 0.0 110.291 -179.981 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . 0.446 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -155.57 -161.8 10.88 Favored Glycine 0 CA--C 1.531 1.034 0 O-C-N 124.535 1.147 . . . . 0.0 110.991 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.9 mmt -93.73 116.11 28.58 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.506 0.768 . . . . 0.0 110.956 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.884 HD13 HG21 ' A' ' 187' ' ' VAL . 2.2 pp -103.48 132.28 21.24 Favored Pre-proline 0 C--N 1.324 -0.518 0 O-C-N 124.551 1.157 . . . . 0.0 109.259 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 183' ' ' PRO . . . . . 0.834 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.6 Cg_endo -74.99 123.39 7.85 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.521 1.801 . . . . 0.0 111.025 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.838 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 69.7 t -71.36 -30.57 1.65 Allowed Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.464 1.102 . . . . 0.0 109.261 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 185' ' ' PRO . . . . . 0.838 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.99 -28.22 9.36 Favored 'Trans proline' 0 C--N 1.36 1.143 0 O-C-N 124.547 1.814 . . . . 0.0 110.988 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.618 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.8 m-85 -99.47 -5.07 30.01 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.47 1.106 . . . . 0.0 110.921 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 187' ' ' VAL . . . . . 0.884 HG21 HD13 ' A' ' 182' ' ' ILE . 1.5 m -132.13 162.96 38.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.492 1.12 . . . . 0.0 109.269 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 188' ' ' GLU . . . . . 0.471 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 3.8 tt0 -111.82 147.97 34.59 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.5 1.125 . . . . 0.0 110.32 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 189' ' ' LYS . . . . . 0.754 ' HA ' HG12 ' A' ' 137' ' ' VAL . 3.4 ptpp? . . . . . 0 C--N 1.324 -0.52 0 O-C-N 124.533 1.145 . . . . 0.0 109.284 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . 0.637 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 20.4 p . . . . . 0 N--CA 1.452 -0.364 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . 0.637 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 27.1 m-85 -149.8 157.32 43.09 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.561 1.163 . . . . 0.0 111.0 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.595 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 21.9 m -136.65 137.59 47.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.568 1.168 . . . . 0.0 109.234 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.59 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 7.1 ttt180 -101.51 111.01 23.12 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.444 1.09 . . . . 0.0 110.285 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.599 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -80.55 110.77 16.34 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.453 1.096 . . . . 0.0 109.349 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.663 ' H ' HD13 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -88.23 19.01 3.94 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.526 1.141 . . . . 0.0 109.296 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -141.7 172.2 13.01 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.541 1.15 . . . . 0.0 110.979 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -109.93 156.08 20.9 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.492 1.12 . . . . 0.0 109.283 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.585 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 65.3 t80 . . . . . 0 C--N 1.326 -0.45 0 O-C-N 124.572 1.17 . . . . 0.0 110.985 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.578 HD22 ' O ' ' A' ' 172' ' ' ALA . 24.8 tp . . . . . 0 N--CA 1.452 -0.335 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . 0.462 ' HA ' ' O ' ' A' ' 143' ' ' PHE . 18.3 Cg_endo -75.02 157.84 42.47 Favored 'Trans proline' 0 C--N 1.359 1.122 0 O-C-N 124.527 1.804 . . . . 0.0 110.952 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.585 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 25.8 p90 -166.43 -175.53 3.26 Favored 'General case' 0 C--N 1.327 -0.412 0 O-C-N 124.449 1.093 . . . . 0.0 110.95 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . 0.52 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -138.55 132.3 30.91 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.574 1.171 . . . . 0.0 109.326 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' LYS . . . . . 0.52 ' C ' ' O ' ' A' ' 154' ' ' LYS . 5.8 ttmt -31.15 130.76 0.11 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.526 1.141 . . . . 0.0 109.252 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 72.85 42.24 46.43 Favored Glycine 0 CA--C 1.53 1.005 0 O-C-N 124.496 1.123 . . . . 0.0 111.033 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . 0.716 ' C ' HD12 ' A' ' 158' ' ' ILE . 15.5 t70 -111.21 167.49 10.24 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.502 0.766 . . . . 0.0 109.305 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.716 HD12 ' C ' ' A' ' 157' ' ' ASP . 1.8 mp -122.81 146.16 28.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 O-C-N 124.499 1.124 . . . . 0.0 109.23 -179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.651 ' CD1' HD13 ' A' ' 182' ' ' ILE . 0.6 OUTLIER -142.07 138.69 31.92 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.481 1.113 . . . . 0.0 109.323 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.464 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.3 OUTLIER -91.49 105.07 17.49 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.522 1.139 . . . . 0.0 110.281 -179.976 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 161' ' ' ILE . . . . . 0.808 HD11 ' HG2' ' A' ' 164' ' ' LYS . 0.0 OUTLIER -85.79 126.48 40.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.469 1.105 . . . . 0.0 109.324 179.983 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.08 -25.92 6.08 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.52 1.137 . . . . 0.0 110.327 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 163' ' ' ASP . . . . . 0.605 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -137.23 157.4 46.74 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.532 1.145 . . . . 0.0 109.28 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . 0.808 ' HG2' HD11 ' A' ' 161' ' ' ILE . 5.5 mttt -142.66 78.82 15.67 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.526 1.141 . . . . 0.0 109.268 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.06 10.1 1.84 Allowed 'Trans proline' 0 C--N 1.36 1.141 0 O-C-N 124.528 1.804 . . . . 0.0 110.984 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 166' ' ' GLU . . . . . 0.402 ' H ' ' C ' ' A' ' 164' ' ' LYS . 26.1 mt-10 -151.06 174.39 13.23 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.545 1.153 . . . . 0.0 110.261 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -99.07 7.98 45.38 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.505 1.128 . . . . 0.0 110.287 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.508 ' O ' ' N ' ' A' ' 184' ' ' VAL . 57.5 mt-30 -147.99 -45.11 0.16 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.582 1.176 . . . . 0.0 110.34 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -98.45 96.89 8.31 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 170' ' ' TRP . . . . . 0.975 ' CE2' HG21 ' A' ' 184' ' ' VAL . 31.5 m0 -102.06 154.82 18.62 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.521 1.138 . . . . 0.0 107.964 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . 0.448 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -88.2 111.13 21.29 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.463 1.102 . . . . 0.0 109.325 179.933 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . 0.578 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -134.92 166.65 22.52 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.487 1.117 . . . . 0.0 109.251 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.57 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.6 OUTLIER -96.31 155.48 16.75 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.554 1.159 . . . . 0.0 110.291 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 174' ' ' ASP . . . . . 0.492 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.7 OUTLIER -94.57 -162.08 0.91 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.442 1.089 . . . . 0.0 109.263 -179.984 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 38.1 m -79.33 7.23 8.21 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.476 1.11 . . . . 0.0 109.978 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . 0.418 ' HB2' ' HG2' ' A' ' 178' ' ' LYS . 2.6 mt-10 -125.72 -4.92 7.02 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.548 1.155 . . . . 0.0 110.291 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . 0.508 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 96.7 -12.0 66.22 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.5 1.125 . . . . 0.0 111.032 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . 0.481 ' O ' HD11 ' A' ' 151' ' ' LEU . 0.1 OUTLIER -57.48 114.9 2.43 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.467 0.745 . . . . 0.0 109.29 -179.954 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . 0.452 ' HG3' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -88.94 127.34 35.65 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.52 1.137 . . . . 0.0 110.307 -179.992 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . 0.448 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -153.42 -169.74 18.81 Favored Glycine 0 CA--C 1.53 0.998 0 O-C-N 124.422 1.077 . . . . 0.0 111.001 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.9 mmt -93.55 116.38 28.89 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 124.47 0.747 . . . . 0.0 111.04 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.651 HD13 ' CD1' ' A' ' 159' ' ' LEU . 1.3 tp -117.12 141.37 28.37 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.492 1.12 . . . . 0.0 109.255 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 183' ' ' PRO . . . . . 0.755 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.07 128.92 11.81 Favored 'Trans proline' 0 C--N 1.361 1.186 0 O-C-N 124.492 1.786 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.975 HG21 ' CE2' ' A' ' 170' ' ' TRP . 10.4 t -72.75 -28.8 1.06 Allowed Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.472 1.108 . . . . 0.0 109.277 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 185' ' ' PRO . . . . . 0.854 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -75.02 -17.56 19.39 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.473 1.775 . . . . 0.0 110.989 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.755 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 9.9 m-85 -100.78 -6.63 24.63 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.524 1.14 . . . . 0.0 111.021 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 187' ' ' VAL . . . . . 0.599 HG12 ' HA ' ' A' ' 139' ' ' ALA . 2.6 m -133.98 157.68 42.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.568 1.168 . . . . 0.0 109.292 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 188' ' ' GLU . . . . . 0.595 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 1.3 tm-20 -98.78 152.62 19.49 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.508 1.13 . . . . 0.0 110.293 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 9.3 mtmm . . . . . 0 C--N 1.324 -0.502 0 O-C-N 124.573 1.17 . . . . 0.0 109.273 -179.974 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.452 -0.334 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . 0.425 ' HA ' ' O ' ' A' ' 159' ' ' LEU . 89.0 m-85 -138.54 178.73 6.93 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.448 1.093 . . . . 0.0 111.015 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.659 HG23 HD12 ' A' ' 159' ' ' LEU . 33.5 m -145.33 139.1 21.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.571 1.169 . . . . 0.0 109.271 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.644 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 12.2 ttm180 -101.35 114.84 29.2 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.442 1.089 . . . . 0.0 110.285 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.49 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -82.86 109.72 17.24 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.476 1.11 . . . . 0.0 109.279 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.804 HD22 ' H ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -89.92 23.97 2.58 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.511 1.132 . . . . 0.0 109.28 179.995 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.42 ' CA ' ' HG2' ' A' ' 155' ' ' LYS . 39.8 m-85 -143.82 155.47 44.14 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.48 1.113 . . . . 0.0 111.002 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.31 126.48 40.65 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.545 1.153 . . . . 0.0 109.339 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.578 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.6 OUTLIER . . . . . 0 C--N 1.326 -0.453 0 O-C-N 124.485 1.115 . . . . 0.0 110.981 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.801 ' HB3' HG23 ' A' ' 182' ' ' ILE . 7.7 tp . . . . . 0 N--CA 1.453 -0.296 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.99 -178.18 3.98 Favored 'Trans proline' 0 C--N 1.359 1.089 0 O-C-N 124.551 1.816 . . . . 0.0 111.012 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.578 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 1.6 p90 173.19 -177.89 0.07 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.53 1.144 . . . . 0.0 111.024 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . 0.416 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.4 OUTLIER -119.93 138.45 53.44 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.515 1.134 . . . . 0.0 109.301 179.98 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' LYS . . . . . 0.515 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.1 OUTLIER -39.06 123.94 1.39 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.469 1.106 . . . . 0.0 109.291 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.478 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 83.98 38.61 10.11 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.522 1.139 . . . . 0.0 110.999 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . 0.425 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 17.0 t70 -108.52 169.04 8.9 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.521 0.777 . . . . 0.0 109.301 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.49 ' C ' ' HG ' ' A' ' 159' ' ' LEU . 8.4 mm -122.22 149.41 25.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 O-C-N 124.472 1.107 . . . . 0.0 109.346 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.778 HD13 HG21 ' A' ' 182' ' ' ILE . 0.2 OUTLIER -143.78 141.21 30.31 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.543 1.152 . . . . 0.0 109.314 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.535 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.1 OUTLIER -86.66 96.73 10.23 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.456 1.098 . . . . 0.0 110.278 -179.97 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 161' ' ' ILE . . . . . 0.86 HD11 ' HB2' ' A' ' 170' ' ' TRP . 0.2 OUTLIER -82.71 125.61 39.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.41 1.069 . . . . 0.0 109.281 179.995 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -124.39 -22.06 4.78 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.476 1.11 . . . . 0.0 110.306 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 163' ' ' ASP . . . . . 0.481 ' C ' ' HG3' ' A' ' 164' ' ' LYS . 71.2 m-20 -125.46 125.31 43.12 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.52 1.137 . . . . 0.0 109.365 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . 0.602 ' HE3' HG21 ' A' ' 161' ' ' ILE . 2.2 mtpt -136.47 63.08 46.53 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.559 1.162 . . . . 0.0 109.277 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . 0.442 ' HD3' ' N ' ' A' ' 164' ' ' LYS . 18.2 Cg_endo -75.03 -50.89 0.12 Allowed 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.508 1.794 . . . . 0.0 110.967 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 166' ' ' GLU . . . . . 0.511 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 0.6 OUTLIER -73.2 177.32 5.17 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.49 1.119 . . . . 0.0 110.359 179.979 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -117.81 47.57 1.53 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.566 1.166 . . . . 0.0 110.292 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.453 ' NE2' ' HG3' ' A' ' 185' ' ' PRO . 0.0 OUTLIER 174.87 -32.56 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.491 1.119 . . . . 0.0 110.3 -179.976 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 169' ' ' TRP . . . . . 0.579 ' CE3' ' HG2' ' A' ' 181' ' ' MET . 70.0 m95 -119.1 104.92 10.9 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.493 1.121 . . . . 0.0 108.01 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 170' ' ' TRP . . . . . 0.86 ' HB2' HD11 ' A' ' 161' ' ' ILE . 53.9 m0 -110.63 154.56 23.62 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . 0.504 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.9 OUTLIER -95.26 117.86 31.01 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.434 1.084 . . . . 0.0 109.326 179.918 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . 0.794 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -141.03 161.42 37.9 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.476 1.11 . . . . 0.0 109.28 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.613 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.8 OUTLIER -90.54 155.63 18.75 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.45 1.094 . . . . 0.0 110.326 -179.966 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 174' ' ' ASP . . . . . 0.651 ' N ' HD21 ' A' ' 151' ' ' LEU . 0.4 OUTLIER -90.08 -161.41 0.79 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.449 1.093 . . . . 0.0 109.308 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 5.6 t -81.21 12.7 3.3 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.507 1.129 . . . . 0.0 109.994 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -132.23 -6.26 3.41 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.567 1.167 . . . . 0.0 110.318 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . 0.521 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 101.62 -12.98 58.15 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.476 1.11 . . . . 0.0 111.007 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . 0.588 ' O ' HD11 ' A' ' 151' ' ' LEU . 2.7 mtmt -52.75 113.28 1.03 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.545 0.791 . . . . 0.0 109.322 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . 0.466 ' CG ' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -89.24 125.02 34.91 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 124.531 1.145 . . . . 0.0 110.327 -179.979 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . 0.504 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.42 -165.96 14.5 Favored Glycine 0 CA--C 1.53 1.021 0 O-C-N 124.529 1.143 . . . . 0.0 110.954 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 181' ' ' MET . . . . . 0.579 ' HG2' ' CE3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -101.88 125.85 48.64 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.529 0.782 . . . . 0.0 111.004 179.976 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.843 HD12 ' O ' ' A' ' 182' ' ' ILE . 2.2 pp -121.89 149.3 53.34 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.54 1.15 . . . . 0.0 109.292 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 183' ' ' PRO . . . . . 0.894 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -74.95 125.87 9.63 Favored 'Trans proline' 0 C--N 1.359 1.124 0 O-C-N 124.591 1.837 . . . . 0.0 110.966 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.852 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 55.4 t -68.98 -29.43 1.91 Allowed Pre-proline 0 C--N 1.326 -0.436 0 O-C-N 124.492 1.12 . . . . 0.0 109.265 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 185' ' ' PRO . . . . . 0.852 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -75.04 -24.28 12.9 Favored 'Trans proline' 0 C--N 1.359 1.079 0 O-C-N 124.542 1.812 . . . . 0.0 110.995 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.894 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.0 m-85 -99.58 -0.18 40.97 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.525 1.141 . . . . 0.0 110.965 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 187' ' ' VAL . . . . . 0.65 HG22 ' O ' ' A' ' 183' ' ' PRO . 4.2 m -134.03 154.96 38.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 O-C-N 124.464 1.102 . . . . 0.0 109.313 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 188' ' ' GLU . . . . . 0.539 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.2 OUTLIER -106.11 159.53 16.01 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 0.0 110.275 -179.991 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.418 0 O-C-N 124.509 1.13 . . . . 0.0 109.32 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 10.4 p . . . . . 0 N--CA 1.453 -0.319 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . 0.418 ' CE1' ' HB2' ' A' ' 160' ' ' ARG . 43.0 m-85 -155.88 165.52 36.22 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.515 1.135 . . . . 0.0 111.013 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 159' ' ' LEU . 19.8 m -142.86 147.02 21.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.58 1.175 . . . . 0.0 109.27 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.719 ' O ' HD13 ' A' ' 140' ' ' LEU . 0.1 OUTLIER -103.08 111.55 23.96 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.523 1.139 . . . . 0.0 110.285 -179.981 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.57 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -82.12 104.39 12.42 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.501 1.126 . . . . 0.0 109.336 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.719 HD13 ' O ' ' A' ' 138' ' ' ARG . 0.0 OUTLIER -88.74 24.27 2.07 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.564 1.165 . . . . 0.0 109.33 -179.998 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.497 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 9.6 m-85 -146.93 145.86 29.93 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.485 1.116 . . . . 0.0 110.989 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.6 152.26 22.75 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.57 1.169 . . . . 0.0 109.285 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.57 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.3 OUTLIER . . . . . 0 C--N 1.325 -0.469 0 O-C-N 124.434 1.084 . . . . 0.0 110.959 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.841 ' O ' HG22 ' A' ' 182' ' ' ILE . 8.8 tp . . . . . 0 N--CA 1.453 -0.29 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' PRO . . . . . 0.424 ' CB ' ' O ' ' A' ' 143' ' ' PHE . 18.2 Cg_endo -75.08 179.03 6.51 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.491 1.785 . . . . 0.0 111.035 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.57 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 0.4 OUTLIER -177.58 -171.81 0.33 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.43 1.081 . . . . 0.0 111.033 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.82 139.96 53.44 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.545 1.153 . . . . 0.0 109.287 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' LYS . . . . . 0.494 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -44.26 115.53 0.86 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.543 1.152 . . . . 0.0 109.312 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.443 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 93.35 43.73 3.93 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 124.605 1.191 . . . . 0.0 111.025 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -115.53 170.94 8.05 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.458 0.74 . . . . 0.0 109.295 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 158' ' ' ILE . . . . . 0.529 HD13 ' HA ' ' A' ' 138' ' ' ARG . 48.8 mm -120.66 144.99 27.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.529 1.143 . . . . 0.0 109.376 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.648 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 0.5 OUTLIER -140.88 133.74 29.03 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.497 1.123 . . . . 0.0 109.286 -179.91 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.481 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 8.5 ttp85 -89.83 106.85 18.75 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.484 1.115 . . . . 0.0 110.298 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 161' ' ' ILE . . . . . 0.711 ' C ' HD12 ' A' ' 161' ' ' ILE . 0.5 OUTLIER -83.42 127.8 39.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 124.468 1.105 . . . . 0.0 109.259 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.47 -20.59 6.01 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 124.498 1.124 . . . . 0.0 110.275 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 163' ' ' ASP . . . . . 0.447 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 3.7 m-20 -135.63 148.76 49.11 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.517 1.135 . . . . 0.0 109.343 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . 0.569 ' HG3' ' CE2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -145.68 76.36 12.92 Favored Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.36 1.038 . . . . 0.0 109.334 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -74.89 -46.95 0.22 Allowed 'Trans proline' 0 C--N 1.36 1.183 0 O-C-N 124.504 1.792 . . . . 0.0 111.049 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 166' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -91.17 173.87 7.7 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.416 1.072 . . . . 0.0 110.278 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . 0.458 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 1.6 mm-40 -104.04 36.43 2.35 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.453 1.096 . . . . 0.0 110.358 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 184' ' ' VAL . 3.3 mt-30 -173.09 -39.06 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.58 1.175 . . . . 0.0 110.312 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 169' ' ' TRP . . . . . 0.483 ' CZ3' ' HD3' ' A' ' 183' ' ' PRO . 85.6 m95 -109.66 98.6 7.92 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.527 1.142 . . . . 0.0 107.994 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 170' ' ' TRP . . . . . 0.986 ' CE2' HG21 ' A' ' 184' ' ' VAL . 20.7 m0 -105.01 160.04 15.34 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.5 1.125 . . . . 0.0 108.041 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . 0.57 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -92.02 112.16 23.99 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.53 1.144 . . . . 0.0 109.283 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . 0.635 ' HB2' HG22 ' A' ' 161' ' ' ILE . . . -135.0 164.17 28.23 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.575 1.172 . . . . 0.0 109.283 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.648 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 18.6 mp0 -95.02 157.87 15.71 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.481 1.113 . . . . 0.0 110.229 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 174' ' ' ASP . . . . . 0.808 ' CG ' HD11 ' A' ' 151' ' ' LEU . 0.4 OUTLIER -90.21 -158.89 0.56 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.564 1.165 . . . . 0.0 109.295 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 24.6 m -83.34 10.67 8.1 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.539 1.15 . . . . 0.0 109.958 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -133.61 -5.23 2.89 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.553 1.158 . . . . 0.0 110.294 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . 0.527 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 106.58 -17.59 39.29 Favored Glycine 0 CA--C 1.53 1.031 0 O-C-N 124.502 1.126 . . . . 0.0 110.983 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . 0.514 ' O ' HD22 ' A' ' 151' ' ' LEU . 0.6 OUTLIER -42.87 109.43 0.14 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.495 0.762 . . . . 0.0 109.336 179.956 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . 0.472 ' HG2' ' OE2' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -91.3 123.19 34.55 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.494 1.121 . . . . 0.0 110.278 -179.986 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . 0.57 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -157.25 -162.89 11.93 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.5 1.125 . . . . 0.0 110.998 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 41.5 mtp -104.78 120.75 42.12 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.446 0.733 . . . . 0.0 110.999 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.841 HG22 ' O ' ' A' ' 151' ' ' LEU . 2.5 pp -120.88 150.89 53.93 Favored Pre-proline 0 C--N 1.325 -0.47 0 O-C-N 124.489 1.118 . . . . 0.0 109.369 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 183' ' ' PRO . . . . . 0.775 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.02 131.27 14.07 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.451 1.764 . . . . 0.0 110.995 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.986 HG21 ' CE2' ' A' ' 170' ' ' TRP . 53.9 t -74.43 -28.98 0.9 Allowed Pre-proline 0 C--N 1.324 -0.521 0 O-C-N 124.509 1.131 . . . . 0.0 109.272 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 185' ' ' PRO . . . . . 0.868 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.2 Cg_endo -74.99 -19.25 18.05 Favored 'Trans proline' 0 C--N 1.361 1.191 0 O-C-N 124.442 1.759 . . . . 0.0 111.026 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.775 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 8.5 m-85 -98.57 -1.36 41.22 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.532 1.145 . . . . 0.0 110.997 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 187' ' ' VAL . . . . . 0.57 HG12 ' HA ' ' A' ' 139' ' ' ALA . 7.5 m -134.68 156.37 39.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 124.534 1.146 . . . . 0.0 109.26 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 188' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 1.5 pp20? -108.55 168.12 9.55 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.489 1.118 . . . . 0.0 110.274 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 189' ' ' LYS . . . . . 0.417 ' O ' ' OE2' ' A' ' 188' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.475 0 O-C-N 124.555 1.159 . . . . 0.0 109.244 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.452 -0.329 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . 0.558 ' CE2' ' HB2' ' A' ' 160' ' ' ARG . 80.2 m-85 -152.71 169.23 23.24 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.541 1.15 . . . . 0.0 110.996 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.567 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 26.8 m -145.54 148.41 17.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.487 1.117 . . . . 0.0 109.306 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.504 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 5.6 ttp180 -104.34 111.47 24.12 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.514 1.134 . . . . 0.0 110.314 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.483 ' CB ' HG12 ' A' ' 187' ' ' VAL . . . -80.18 107.05 12.66 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.508 1.13 . . . . 0.0 109.34 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.404 ' O ' ' HG2' ' A' ' 155' ' ' LYS . 1.1 mt -88.33 21.8 2.72 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.5 1.125 . . . . 0.0 109.287 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.507 ' CD1' ' HA ' ' A' ' 186' ' ' TYR . 72.3 m-85 -141.55 138.86 32.99 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.487 1.117 . . . . 0.0 111.01 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.28 153.46 25.85 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.469 1.105 . . . . 0.0 109.319 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.618 ' CZ ' ' OD2' ' A' ' 150' ' ' ASP . 4.7 t80 -177.16 102.85 0.05 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.505 1.128 . . . . 0.0 110.991 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -134.66 101.85 5.08 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.47 1.106 . . . . 0.0 109.265 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -157.4 -128.53 1.05 Allowed Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.435 1.084 . . . . 0.0 111.017 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 171.32 84.65 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.488 0.758 . . . . 0.0 109.311 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -109.77 -75.08 0.63 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.498 1.124 . . . . 0.0 109.303 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -109.86 35.07 3.51 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.473 1.108 . . . . 0.0 110.327 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 65.88 17.72 10.9 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.47 1.106 . . . . 0.0 110.344 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.618 ' OD2' ' CZ ' ' A' ' 143' ' ' PHE . 3.8 t0 -58.15 134.8 56.79 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.455 1.097 . . . . 0.0 109.292 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.762 HD23 ' CG1' ' A' ' 182' ' ' ILE . 34.7 tp -66.55 111.86 7.91 Favored Pre-proline 0 C--N 1.326 -0.45 0 O-C-N 124.485 1.116 . . . . 0.0 109.273 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . 0.596 ' HD2' HD12 ' A' ' 151' ' ' LEU . 18.4 Cg_endo -75.03 170.2 20.93 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.535 1.808 . . . . 0.0 111.029 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.597 ' CE1' ' HB3' ' A' ' 143' ' ' PHE . 0.7 OUTLIER -173.83 -175.59 1.1 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.502 1.126 . . . . 0.0 110.966 -179.996 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . 0.439 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -131.56 135.87 47.36 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.505 1.128 . . . . 0.0 109.313 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.439 ' C ' ' O ' ' A' ' 154' ' ' LYS . 0.0 OUTLIER -37.54 110.88 0.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.511 1.132 . . . . 0.0 109.353 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 94.79 42.41 3.86 Favored Glycine 0 CA--C 1.529 0.955 0 O-C-N 124.496 1.122 . . . . 0.0 110.999 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . 0.431 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 17.6 t70 -111.68 165.88 11.65 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.496 0.762 . . . . 0.0 109.339 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.465 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 4.9 mp -119.89 140.16 44.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.504 1.128 . . . . 0.0 109.338 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.742 HD13 HD12 ' A' ' 182' ' ' ILE . 0.8 OUTLIER -137.07 134.64 36.72 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.5 1.125 . . . . 0.0 109.297 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.558 ' HB2' ' CE2' ' A' ' 136' ' ' TYR . 10.0 ttm180 -87.1 104.07 15.99 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.507 1.129 . . . . 0.0 110.28 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.795 HG22 ' HB2' ' A' ' 172' ' ' ALA . 0.8 OUTLIER -84.62 125.93 40.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.44 1.088 . . . . 0.0 109.286 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 5.9 ptt180 -121.43 -24.94 5.28 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.45 1.094 . . . . 0.0 110.279 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' ASP . . . . . 0.446 ' HB2' ' CB ' ' A' ' 171' ' ' ASN . 79.2 m-20 -126.4 131.82 51.66 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.471 1.107 . . . . 0.0 109.261 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.548 ' CG ' HD13 ' A' ' 161' ' ' ILE . 0.0 OUTLIER -133.46 69.62 76.96 Favored Pre-proline 0 C--N 1.325 -0.466 0 O-C-N 124.473 1.108 . . . . 0.0 109.248 179.998 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.02 -52.15 0.11 Allowed 'Trans proline' 0 C--N 1.359 1.12 0 O-C-N 124.512 1.796 . . . . 0.0 111.002 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' GLU . . . . . 0.444 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 4.1 mm-40 -76.73 175.1 9.71 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.478 1.111 . . . . 0.0 110.267 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.522 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 3.3 pt-20 -106.56 31.69 5.05 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.467 1.104 . . . . 0.0 110.321 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.522 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 3.1 mt-30 -172.35 -40.17 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.475 1.11 . . . . 0.0 110.316 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -106.04 104.57 14.3 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 0.0 107.981 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' TRP . . . . . 0.704 ' CE2' HG21 ' A' ' 184' ' ' VAL . 50.1 m0 -109.45 154.6 22.4 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.527 1.142 . . . . 0.0 107.988 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.468 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 1.0 OUTLIER -88.25 111.06 21.24 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.503 1.127 . . . . 0.0 109.355 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . 0.795 ' HB2' HG22 ' A' ' 161' ' ' ILE . . . -127.51 167.34 16.43 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.492 1.12 . . . . 0.0 109.292 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.51 ' CG ' ' O ' ' A' ' 177' ' ' GLY . 6.9 mp0 -101.39 156.28 17.55 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.473 1.108 . . . . 0.0 110.287 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . 0.654 ' HB3' HD11 ' A' ' 151' ' ' LEU . 45.2 p-10 -93.85 -160.19 0.75 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.444 1.09 . . . . 0.0 109.316 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 45.0 t -80.92 11.46 3.97 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.478 1.111 . . . . 0.0 109.996 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -132.22 -2.25 3.56 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.435 1.084 . . . . 0.0 110.337 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.51 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 96.01 -12.28 67.12 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.462 1.102 . . . . 0.0 110.985 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . 0.478 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 2.9 mtpp -52.67 113.25 1.01 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.474 0.749 . . . . 0.0 109.303 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . 0.441 ' HG2' ' CD ' ' A' ' 173' ' ' GLU . 0.5 OUTLIER -87.89 126.26 34.94 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.485 1.116 . . . . 0.0 110.304 -179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.468 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -152.72 -169.3 17.83 Favored Glycine 0 CA--C 1.53 1.002 0 O-C-N 124.522 1.139 . . . . 0.0 110.993 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' MET . . . . . 0.425 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 1.4 mmt -86.78 126.03 34.33 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.528 0.781 . . . . 0.0 111.024 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.762 ' CG1' HD23 ' A' ' 151' ' ' LEU . 18.1 mm -121.5 134.56 24.58 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.475 1.109 . . . . 0.0 109.313 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' PRO . . . . . 0.683 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.2 Cg_endo -75.01 121.13 6.38 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.543 1.812 . . . . 0.0 111.025 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.835 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 9.8 t -69.66 -30.28 2.04 Favored Pre-proline 0 C--N 1.325 -0.475 0 O-C-N 124.51 1.131 . . . . 0.0 109.299 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' PRO . . . . . 0.835 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -75.03 -23.96 13.24 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.527 1.804 . . . . 0.0 111.003 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.681 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.5 m-85 -100.32 -5.02 28.02 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.545 1.153 . . . . 0.0 110.989 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 187' ' ' VAL . . . . . 0.701 HG11 ' CG2' ' A' ' 182' ' ' ILE . 3.3 m -128.49 152.63 36.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.539 1.149 . . . . 0.0 109.273 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 188' ' ' GLU . . . . . 0.567 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.0 OUTLIER -107.98 166.08 10.98 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.491 1.119 . . . . 0.0 110.322 179.992 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.18 117.09 29.33 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.491 1.12 . . . . 0.0 109.325 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -110.01 -65.93 1.11 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.488 1.118 . . . . 0.0 110.996 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 191' ' ' GLY . . . . . 0.449 ' C ' ' H ' ' A' ' 136' ' ' TYR . . . . . . . . 0 CA--C 1.53 1.026 0 O-C-N 124.484 1.115 . . . . 0.0 111.052 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . 0.553 ' HB3' ' CE2' ' A' ' 136' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . 0.553 ' CE2' ' HB3' ' A' ' 135' ' ' CYS . 68.1 m-85 -151.3 173.9 13.94 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.475 1.109 . . . . 0.0 111.035 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.522 ' HB ' ' CG2' ' A' ' 187' ' ' VAL . 4.2 m -147.67 149.55 15.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 O-C-N 124.492 1.12 . . . . 0.0 109.302 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.83 HH21 HD21 ' A' ' 140' ' ' LEU . 16.4 ttp180 -105.25 107.49 18.5 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.501 1.126 . . . . 0.0 110.316 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.482 ' CB ' HG12 ' A' ' 187' ' ' VAL . . . -80.92 103.95 11.1 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.47 1.106 . . . . 0.0 109.371 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.83 HD21 HH21 ' A' ' 138' ' ' ARG . 2.9 mp -88.89 22.99 2.49 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.527 1.142 . . . . 0.0 109.332 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.429 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 36.4 m-85 -144.01 145.2 32.05 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.514 1.134 . . . . 0.0 111.009 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . 0.402 ' N ' ' HB2' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -87.63 152.66 21.99 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.563 1.164 . . . . 0.0 109.328 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.603 ' HB3' ' CZ ' ' A' ' 153' ' ' PHE . 5.8 t80 -179.89 153.78 0.54 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.469 1.105 . . . . 0.0 111.013 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . 0.453 ' O ' ' HB3' ' A' ' 152' ' ' PRO . 0.8 OUTLIER -111.41 -46.55 3.27 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.523 1.139 . . . . 0.0 109.332 179.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 98.91 137.14 9.66 Favored Glycine 0 CA--C 1.528 0.892 0 O-C-N 124.476 1.11 . . . . 0.0 111.007 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -138.02 51.44 1.88 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.471 0.748 . . . . 0.0 109.281 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 83.7 m-20 -128.3 -177.39 4.14 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.46 1.1 . . . . 0.0 109.269 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -92.12 28.99 1.72 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.51 1.131 . . . . 0.0 110.275 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 171.37 38.31 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.484 1.115 . . . . 0.0 110.307 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -86.75 175.0 8.46 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.571 1.169 . . . . 0.0 109.329 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.66 HD22 ' O ' ' A' ' 172' ' ' ALA . 11.6 tp -139.18 111.71 7.91 Favored Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.542 1.151 . . . . 0.0 109.344 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . 0.453 ' HB3' ' O ' ' A' ' 144' ' ' ASN . 18.2 Cg_endo -75.08 133.62 16.69 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.417 1.746 . . . . 0.0 110.967 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.603 ' CZ ' ' HB3' ' A' ' 143' ' ' PHE . 4.8 p90 -150.8 -179.05 6.95 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 0.0 111.023 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -130.94 147.16 52.54 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.447 1.092 . . . . 0.0 109.238 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.412 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -56.34 118.12 4.46 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.538 1.149 . . . . 0.0 109.365 179.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 99.72 35.57 4.56 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.472 1.108 . . . . 0.0 110.984 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -120.61 170.29 9.56 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.522 0.778 . . . . 0.0 109.286 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.486 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 5.2 mt -119.46 148.23 22.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 O-C-N 124.553 1.158 . . . . 0.0 109.268 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.644 HD23 ' HA ' ' A' ' 174' ' ' ASP . 0.4 OUTLIER -139.79 136.69 34.33 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.496 1.123 . . . . 0.0 109.28 -179.976 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.445 ' HB3' ' HB2' ' A' ' 173' ' ' GLU . 6.1 ttt-85 -87.69 100.96 13.21 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.554 1.159 . . . . 0.0 110.275 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.916 HD11 ' HG2' ' A' ' 164' ' ' LYS . 0.0 OUTLIER -86.1 130.55 36.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.566 1.166 . . . . 0.0 109.322 179.946 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -129.19 -24.49 2.85 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.5 1.125 . . . . 0.0 110.32 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' ASP . . . . . 0.427 ' HB2' ' CB ' ' A' ' 171' ' ' ASN . 8.7 m-20 -124.78 147.97 48.39 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.406 1.066 . . . . 0.0 109.305 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.916 ' HG2' HD11 ' A' ' 161' ' ' ILE . 10.9 mtmm -144.0 71.32 16.71 Favored Pre-proline 0 C--N 1.324 -0.508 0 O-C-N 124.535 1.147 . . . . 0.0 109.272 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -75.01 4.97 4.27 Favored 'Trans proline' 0 C--N 1.36 1.172 0 O-C-N 124.453 1.765 . . . . 0.0 111.05 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' GLU . . . . . 0.468 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 26.3 mm-40 -141.46 172.75 12.25 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.469 1.106 . . . . 0.0 110.316 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -100.07 16.38 24.25 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.521 1.138 . . . . 0.0 110.318 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.428 ' NE2' ' HG3' ' A' ' 185' ' ' PRO . 7.0 mt-30 -157.84 -43.19 0.06 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.53 1.144 . . . . 0.0 110.26 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' TRP . . . . . 0.502 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 90.0 m95 -100.18 101.03 11.96 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' TRP . . . . . 0.779 ' CE2' HG21 ' A' ' 184' ' ' VAL . 28.8 m0 -107.96 154.45 21.61 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.545 1.153 . . . . 0.0 108.026 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.449 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.5 OUTLIER -87.77 111.79 21.73 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.471 1.107 . . . . 0.0 109.264 -179.921 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . 0.66 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -132.81 163.7 28.49 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.556 1.16 . . . . 0.0 109.286 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.494 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.6 OUTLIER -95.98 158.88 15.25 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.493 1.12 . . . . 0.0 110.288 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . 0.644 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.2 OUTLIER -94.58 -166.18 1.43 Allowed 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.512 1.133 . . . . 0.0 109.261 -179.898 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.91 5.64 6.2 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.529 1.143 . . . . 0.0 110.042 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -124.64 -5.31 7.59 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.444 1.09 . . . . 0.0 110.264 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.488 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 98.34 -7.48 61.94 Favored Glycine 0 CA--C 1.53 0.979 0 O-C-N 124.429 1.081 . . . . 0.0 110.99 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . 0.635 ' O ' HD11 ' A' ' 151' ' ' LEU . 5.4 mtmt -56.76 112.77 1.4 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.481 0.753 . . . . 0.0 109.322 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.1 OUTLIER -87.8 123.37 32.52 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.49 1.119 . . . . 0.0 110.322 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.604 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -155.46 -162.93 11.66 Favored Glycine 0 CA--C 1.531 1.072 0 O-C-N 124.514 1.134 . . . . 0.0 110.959 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' MET . . . . . 0.502 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.2 OUTLIER -88.25 130.65 35.04 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.606 0.827 . . . . 0.0 111.005 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.639 HD12 HD13 ' A' ' 159' ' ' LEU . 23.0 mm -126.92 131.83 24.05 Favored Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 124.53 1.144 . . . . 0.0 109.255 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 183' ' ' PRO . . . . . 0.751 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.3 Cg_endo -75.02 123.19 7.69 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.485 1.782 . . . . 0.0 110.944 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.827 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 14.0 t -71.93 -31.08 1.64 Allowed Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.496 1.123 . . . . 0.0 109.331 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 185' ' ' PRO . . . . . 0.827 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.96 -21.01 16.38 Favored 'Trans proline' 0 C--N 1.36 1.145 0 O-C-N 124.508 1.794 . . . . 0.0 111.057 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.685 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.9 m-85 -97.72 -21.47 16.97 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.481 1.113 . . . . 0.0 110.984 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 187' ' ' VAL . . . . . 0.751 HG13 ' O ' ' A' ' 183' ' ' PRO . 1.4 m -116.35 157.93 17.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.474 1.109 . . . . 0.0 109.371 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 188' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.2 OUTLIER -102.24 163.61 12.14 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.428 1.08 . . . . 0.0 110.331 179.968 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . 0.61 ' NZ ' HG22 ' A' ' 184' ' ' VAL . 0.0 OUTLIER -88.88 111.33 21.95 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.573 1.17 . . . . 0.0 109.3 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -96.4 -39.98 9.33 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.545 1.153 . . . . 0.0 111.006 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.947 0 O-C-N 124.489 1.118 . . . . 0.0 111.018 -179.976 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 27.0 p . . . . . 0 N--CA 1.452 -0.343 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . 0.576 ' CE1' ' HB2' ' A' ' 160' ' ' ARG . 12.7 m-85 -130.21 164.64 24.07 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.489 1.118 . . . . 0.0 111.044 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.756 HG21 ' CG2' ' A' ' 187' ' ' VAL . 0.5 OUTLIER -147.69 165.06 6.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.547 1.154 . . . . 0.0 109.274 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.5 ' N ' HG23 ' A' ' 137' ' ' VAL . 2.5 ttm180 -125.49 118.68 26.31 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.498 1.124 . . . . 0.0 110.324 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.475 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -84.03 113.33 20.94 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.493 1.121 . . . . 0.0 109.287 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.8 mt -87.14 20.28 2.78 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.565 1.165 . . . . 0.0 109.329 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.446 ' CD2' ' CD2' ' A' ' 186' ' ' TYR . 17.8 t80 -142.8 166.78 23.72 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 124.467 1.105 . . . . 0.0 110.958 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -106.78 154.7 20.61 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.484 1.115 . . . . 0.0 109.321 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.603 ' CE1' ' OD1' ' A' ' 150' ' ' ASP . 11.0 t80 -178.55 102.3 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.495 1.122 . . . . 0.0 111.037 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . 0.401 ' HA ' ' HB3' ' A' ' 152' ' ' PRO . 10.8 p-10 -132.64 114.92 14.77 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.428 1.08 . . . . 0.0 109.302 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 129.05 79.36 0.23 Allowed Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.529 1.143 . . . . 0.0 111.008 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . 0.432 ' O ' ' N ' ' A' ' 148' ' ' GLU . 3.5 m-80 172.64 -72.41 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.461 0.742 . . . . 0.0 109.281 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . 0.437 ' O ' ' N ' ' A' ' 150' ' ' ASP . 0.7 OUTLIER 62.73 -81.7 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.49 1.119 . . . . 0.0 109.303 179.995 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.432 ' N ' ' O ' ' A' ' 146' ' ' ASN . 0.3 OUTLIER -49.6 -24.8 2.35 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.515 1.134 . . . . 0.0 110.23 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . 0.431 ' O ' ' HB3' ' A' ' 150' ' ' ASP . 1.5 tt0 -93.27 -24.49 18.14 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.567 1.167 . . . . 0.0 110.294 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.603 ' OD1' ' CE1' ' A' ' 143' ' ' PHE . 2.2 p30 170.38 143.53 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.451 1.095 . . . . 0.0 109.286 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.504 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 13.0 tp -61.03 124.61 80.91 Favored Pre-proline 0 C--N 1.325 -0.463 0 O-C-N 124.508 1.13 . . . . 0.0 109.307 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . 0.452 ' CB ' ' O ' ' A' ' 143' ' ' PHE . 18.3 Cg_endo -74.92 169.53 22.41 Favored 'Trans proline' 0 C--N 1.36 1.151 0 O-C-N 124.558 1.82 . . . . 0.0 111.039 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.465 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 2.0 p90 -174.86 173.13 2.79 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.522 1.139 . . . . 0.0 110.99 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . 0.495 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -123.39 127.3 48.27 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.529 1.143 . . . . 0.0 109.301 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.495 ' C ' ' O ' ' A' ' 154' ' ' LYS . 0.9 OUTLIER -32.58 107.51 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.544 0 O-C-N 124.542 1.151 . . . . 0.0 109.298 -179.975 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 99.79 39.5 3.36 Favored Glycine 0 CA--C 1.53 0.988 0 O-C-N 124.453 1.096 . . . . 0.0 110.975 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . 0.477 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 22.2 t70 -111.9 172.05 7.13 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.454 0.737 . . . . 0.0 109.32 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.742 HD13 ' O ' ' A' ' 137' ' ' VAL . 6.1 mm -123.64 149.31 27.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.502 1.126 . . . . 0.0 109.294 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.953 HD13 HG21 ' A' ' 182' ' ' ILE . 3.1 mt -145.86 140.07 26.78 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.456 1.098 . . . . 0.0 109.311 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.576 ' HB2' ' CE1' ' A' ' 136' ' ' TYR . 1.9 ttt180 -88.64 102.17 14.7 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.514 1.134 . . . . 0.0 110.302 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.998 HD12 ' HB2' ' A' ' 172' ' ' ALA . 0.1 OUTLIER -83.12 124.13 39.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.535 1.147 . . . . 0.0 109.287 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -118.91 -25.11 6.37 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.545 1.153 . . . . 0.0 110.335 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' ASP . . . . . 0.455 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 1.4 m-20 -131.74 157.77 42.92 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.53 1.144 . . . . 0.0 109.236 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.518 ' HB2' ' CG ' ' A' ' 170' ' ' TRP . 0.7 OUTLIER -165.13 65.29 1.1 Allowed Pre-proline 0 C--N 1.326 -0.432 0 O-C-N 124.497 1.123 . . . . 0.0 109.289 -179.956 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 6.46 3.37 Favored 'Trans proline' 0 C--N 1.359 1.131 0 O-C-N 124.473 1.775 . . . . 0.0 110.992 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' GLU . . . . . 0.446 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 6.5 mm-40 -131.21 171.04 13.76 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.457 1.098 . . . . 0.0 110.279 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.518 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 2.5 mt-10 -112.56 48.07 1.03 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.448 1.092 . . . . 0.0 110.277 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.518 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 1.3 mt-30 173.64 -32.12 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.487 1.117 . . . . 0.0 110.281 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' TRP . . . . . 0.436 ' O ' ' HB2' ' A' ' 166' ' ' GLU . 76.3 m95 -123.27 103.26 8.41 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.524 1.14 . . . . 0.0 107.994 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' TRP . . . . . 0.972 ' HB2' HD11 ' A' ' 161' ' ' ILE . 30.0 m0 -108.68 169.68 8.51 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.48 1.112 . . . . 0.0 108.002 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.512 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -104.96 115.87 31.0 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.5 1.125 . . . . 0.0 109.236 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . 0.998 ' HB2' HD12 ' A' ' 161' ' ' ILE . . . -133.88 167.97 19.6 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.485 1.116 . . . . 0.0 109.307 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.538 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 4.0 mp0 -100.44 158.67 15.73 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.533 1.146 . . . . 0.0 110.297 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . 0.496 ' OD1' ' N ' ' A' ' 177' ' ' GLY . 44.2 p-10 -94.55 -161.25 0.84 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.574 1.171 . . . . 0.0 109.298 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.73 14.06 2.85 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.528 1.143 . . . . 0.0 109.97 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -133.47 -5.34 2.94 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.474 1.109 . . . . 0.0 110.297 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.51 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 99.85 -12.72 60.91 Favored Glycine 0 CA--C 1.531 1.039 0 O-C-N 124.477 1.111 . . . . 0.0 110.921 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . 0.433 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 2.8 mttm -53.78 112.75 0.99 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.506 0.768 . . . . 0.0 109.298 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -88.51 128.08 35.54 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.402 1.064 . . . . 0.0 110.356 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.512 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -152.73 -167.87 16.03 Favored Glycine 0 CA--C 1.529 0.966 0 O-C-N 124.454 1.096 . . . . 0.0 111.039 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -96.75 118.91 34.22 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.522 0.778 . . . . 0.0 111.06 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.953 HG21 HD13 ' A' ' 159' ' ' LEU . 4.8 pt -112.77 141.39 25.32 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.505 1.128 . . . . 0.0 109.333 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 183' ' ' PRO . . . . . 0.775 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.1 Cg_endo -75.01 126.74 10.16 Favored 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.48 1.779 . . . . 0.0 111.058 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.828 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 48.8 t -71.98 -30.61 1.52 Allowed Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.498 1.124 . . . . 0.0 109.248 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 185' ' ' PRO . . . . . 0.828 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.94 -26.69 10.81 Favored 'Trans proline' 0 C--N 1.36 1.16 0 O-C-N 124.459 1.768 . . . . 0.0 111.005 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.775 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 7.2 m-85 -98.76 2.46 46.95 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.451 1.094 . . . . 0.0 110.986 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 187' ' ' VAL . . . . . 0.756 ' CG2' HG21 ' A' ' 137' ' ' VAL . 2.0 m -140.02 160.25 26.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 124.453 1.096 . . . . 0.0 109.365 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 188' ' ' GLU . . . . . 0.412 ' O ' ' HB ' ' A' ' 137' ' ' VAL . 0.9 OUTLIER -111.45 149.08 31.79 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.544 1.152 . . . . 0.0 110.249 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.75 107.7 18.77 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.553 1.158 . . . . 0.0 109.274 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -102.55 -23.4 13.89 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.459 1.099 . . . . 0.0 111.067 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 191' ' ' GLY . . . . . 0.448 ' C ' ' H ' ' A' ' 136' ' ' TYR . . . . . . . . 0 CA--C 1.53 0.98 0 O-C-N 124.439 1.087 . . . . 0.0 111.01 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . 0.491 ' HB3' ' CE2' ' A' ' 136' ' ' TYR . 1.3 m . . . . . 0 N--CA 1.453 -0.313 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . 0.558 ' CE1' ' HD2' ' A' ' 160' ' ' ARG . 34.6 m-85 -150.58 177.62 9.86 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.514 1.134 . . . . 0.0 111.007 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.877 HG21 HD11 ' A' ' 182' ' ' ILE . 9.9 m -143.85 141.04 25.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.479 1.112 . . . . 0.0 109.302 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.633 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 14.0 ttp180 -99.65 112.28 24.52 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.551 1.157 . . . . 0.0 110.291 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.489 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -80.07 112.37 17.31 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.579 1.174 . . . . 0.0 109.309 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.65 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.1 OUTLIER -91.15 22.9 3.51 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.586 1.179 . . . . 0.0 109.312 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.486 ' CG ' ' CD2' ' A' ' 186' ' ' TYR . 55.3 m-85 -147.36 156.24 42.72 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.549 1.156 . . . . 0.0 110.926 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.67 128.59 45.0 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.582 1.176 . . . . 0.0 109.27 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.622 ' HB3' ' CZ ' ' A' ' 153' ' ' PHE . 0.8 OUTLIER -164.15 123.35 1.95 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.468 1.105 . . . . 0.0 111.011 179.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . 0.463 ' HA ' ' HA ' ' A' ' 152' ' ' PRO . 0.9 OUTLIER -89.82 -58.11 2.63 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.527 1.142 . . . . 0.0 109.302 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 162.64 125.03 0.74 Allowed Glycine 0 CA--C 1.531 1.071 0 O-C-N 124.444 1.09 . . . . 0.0 110.974 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . 0.576 ' OD1' ' CZ ' ' A' ' 143' ' ' PHE . 41.4 p30 -178.2 36.86 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.567 0.804 . . . . 0.0 109.25 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -135.51 -72.58 0.46 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.491 1.119 . . . . 0.0 109.31 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -140.54 39.31 1.87 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.517 1.136 . . . . 0.0 110.312 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 74.49 20.61 2.46 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.467 1.104 . . . . 0.0 110.321 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.475 ' OD2' ' CD2' ' A' ' 143' ' ' PHE . 2.0 p-10 -45.27 163.44 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.404 1.065 . . . . 0.0 109.259 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.64 ' HB3' ' CG2' ' A' ' 182' ' ' ILE . 14.6 tp -80.9 132.6 56.79 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.554 1.159 . . . . 0.0 109.352 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 144' ' ' ASN . 18.2 Cg_endo -75.03 135.11 18.6 Favored 'Trans proline' 0 C--N 1.36 1.171 0 O-C-N 124.508 1.794 . . . . 0.0 111.04 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.622 ' CZ ' ' HB3' ' A' ' 143' ' ' PHE . 4.8 p90 -157.25 -178.59 7.47 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.469 1.105 . . . . 0.0 110.947 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.93 142.7 50.86 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.501 1.126 . . . . 0.0 109.273 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 4.7 ttpt -48.67 118.83 2.73 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.452 1.095 . . . . 0.0 109.29 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 91.82 42.99 4.6 Favored Glycine 0 CA--C 1.529 0.953 0 O-C-N 124.446 1.091 . . . . 0.0 110.981 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . 0.451 ' C ' HD12 ' A' ' 158' ' ' ILE . 17.8 t70 -121.91 171.11 9.16 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.468 0.746 . . . . 0.0 109.271 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.583 ' O ' HD23 ' A' ' 159' ' ' LEU . 2.8 mp -119.62 147.97 22.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.523 1.14 . . . . 0.0 109.279 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.906 HD12 HD13 ' A' ' 182' ' ' ILE . 3.4 mt -143.5 139.9 30.04 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.443 1.089 . . . . 0.0 109.237 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.558 ' HD2' ' CE1' ' A' ' 136' ' ' TYR . 8.3 ttt180 -84.59 101.37 12.06 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.564 1.165 . . . . 0.0 110.265 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.822 HD12 ' HB2' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -82.91 122.67 37.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 O-C-N 124.511 1.132 . . . . 0.0 109.244 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.24 -26.73 5.81 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.54 1.15 . . . . 0.0 110.293 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.14 154.17 39.0 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.537 1.148 . . . . 0.0 109.32 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.474 ' HB2' ' CE2' ' A' ' 170' ' ' TRP . 5.6 ptpp? -165.85 71.14 1.26 Allowed Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.544 1.152 . . . . 0.0 109.253 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.09 -38.38 1.57 Allowed 'Trans proline' 0 C--N 1.36 1.164 0 O-C-N 124.463 1.77 . . . . 0.0 110.946 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' GLU . . . . . 0.44 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.3 mt-10 -85.58 -177.65 6.47 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.492 1.12 . . . . 0.0 110.277 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -114.1 17.33 17.82 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.416 1.073 . . . . 0.0 110.233 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.453 ' O ' ' N ' ' A' ' 184' ' ' VAL . 33.5 mt-30 -152.13 -40.05 0.11 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.481 1.113 . . . . 0.0 110.288 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' TRP . . . . . 0.449 ' CZ3' ' HB3' ' A' ' 150' ' ' ASP . 73.9 m95 -107.54 111.18 23.33 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' TRP . . . . . 0.767 ' HB2' HD11 ' A' ' 161' ' ' ILE . 51.3 m0 -114.84 164.17 14.48 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.552 1.158 . . . . 0.0 108.063 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.411 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -102.57 121.76 43.02 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.546 1.153 . . . . 0.0 109.304 -179.967 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . 0.822 ' HB2' HD12 ' A' ' 161' ' ' ILE . . . -141.91 162.3 35.83 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.49 1.119 . . . . 0.0 109.312 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.519 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 2.2 mp0 -96.48 154.41 17.29 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.476 1.11 . . . . 0.0 110.246 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . 0.475 ' N ' HD21 ' A' ' 151' ' ' LEU . 0.2 OUTLIER -89.13 -162.01 0.82 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.485 1.116 . . . . 0.0 109.268 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 2.4 m -79.18 5.73 11.43 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.47 1.106 . . . . 0.0 109.973 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -123.8 -5.38 8.04 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.466 1.104 . . . . 0.0 110.327 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.501 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 97.48 -6.41 63.13 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.555 1.159 . . . . 0.0 110.969 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . 0.603 ' O ' HD11 ' A' ' 151' ' ' LEU . 0.9 OUTLIER -57.26 111.92 1.22 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.478 0.752 . . . . 0.0 109.292 -179.974 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . 0.434 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -87.02 125.57 34.18 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.46 1.1 . . . . 0.0 110.29 179.983 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.505 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -154.75 -173.97 24.2 Favored Glycine 0 CA--C 1.531 1.035 0 O-C-N 124.46 1.1 . . . . 0.0 110.98 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' MET . . . . . 0.45 ' O ' ' CA ' ' A' ' 150' ' ' ASP . 0.0 OUTLIER -96.67 128.06 43.25 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.526 0.78 . . . . 0.0 111.013 179.962 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.929 HD12 HG11 ' A' ' 187' ' ' VAL . 4.2 pt -128.38 156.65 76.56 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.448 1.093 . . . . 0.0 109.287 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 183' ' ' PRO . . . . . 0.807 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.1 Cg_endo -75.04 132.79 15.77 Favored 'Trans proline' 0 C--N 1.361 1.197 0 O-C-N 124.488 1.783 . . . . 0.0 111.003 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.825 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 39.2 t -78.38 -31.95 0.81 Allowed Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.525 1.141 . . . . 0.0 109.319 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 185' ' ' PRO . . . . . 0.825 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.99 -26.07 11.29 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.467 1.772 . . . . 0.0 110.983 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.779 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 2.9 m-85 -96.58 7.66 46.02 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.488 1.117 . . . . 0.0 110.958 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 187' ' ' VAL . . . . . 0.929 HG11 HD12 ' A' ' 182' ' ' ILE . 3.5 m -135.98 151.98 29.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 O-C-N 124.417 1.073 . . . . 0.0 109.322 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 188' ' ' GLU . . . . . 0.558 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 39.4 tt0 -101.85 153.25 20.0 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.499 1.124 . . . . 0.0 110.264 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 2.3 ptmm? -89.58 111.06 21.89 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.524 1.14 . . . . 0.0 109.272 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -154.56 104.94 2.59 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.444 1.09 . . . . 0.0 111.0 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.967 0 O-C-N 124.494 1.121 . . . . 0.0 111.009 -179.98 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . 0.414 ' O ' ' HG3' ' A' ' 160' ' ' ARG . 3.6 m . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -150.93 163.35 38.9 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.526 1.141 . . . . 0.0 111.044 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.615 HG22 ' O ' ' A' ' 159' ' ' LEU . 13.5 m -144.58 136.21 21.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.517 1.136 . . . . 0.0 109.296 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.527 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 6.6 ttp180 -103.27 110.9 23.05 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.474 1.108 . . . . 0.0 110.299 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.543 ' HB1' ' CD1' ' A' ' 153' ' ' PHE . . . -81.37 104.64 11.96 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.451 1.095 . . . . 0.0 109.334 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.413 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 1.7 mt -89.59 22.93 2.8 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.503 1.127 . . . . 0.0 109.218 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -140.52 149.7 42.79 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.5 1.125 . . . . 0.0 111.014 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.17 128.92 34.97 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.49 1.119 . . . . 0.0 109.312 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.598 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.4 OUTLIER -143.36 138.63 29.57 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.572 1.17 . . . . 0.0 111.007 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . 0.456 ' C ' ' HB3' ' A' ' 152' ' ' PRO . 2.3 t-20 -115.95 -32.73 5.32 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.463 1.102 . . . . 0.0 109.347 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 158.71 127.18 0.91 Allowed Glycine 0 CA--C 1.531 1.059 0 O-C-N 124.529 1.143 . . . . 0.0 111.011 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -135.98 6.73 3.15 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.565 0.803 . . . . 0.0 109.292 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . 0.534 ' O ' ' CB ' ' A' ' 148' ' ' GLU . 0.2 OUTLIER -133.87 -18.82 2.08 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.53 1.144 . . . . 0.0 109.234 -179.989 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.534 ' CB ' ' O ' ' A' ' 147' ' ' ASP . 1.2 pt-20 88.84 -22.56 0.12 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.42 1.075 . . . . 0.0 110.305 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -125.61 4.89 7.52 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.515 1.135 . . . . 0.0 110.374 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.416 ' HB2' ' O ' ' A' ' 181' ' ' MET . 17.1 p-10 -79.27 159.68 27.16 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 124.437 1.086 . . . . 0.0 109.248 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.633 HD21 ' O ' ' A' ' 178' ' ' LYS . 6.4 tp -91.96 113.75 59.95 Favored Pre-proline 0 C--N 1.326 -0.423 0 O-C-N 124.441 1.088 . . . . 0.0 109.309 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . 0.456 ' HB3' ' C ' ' A' ' 144' ' ' ASN . 18.3 Cg_endo -74.99 171.28 18.63 Favored 'Trans proline' 0 C--N 1.36 1.138 0 O-C-N 124.465 1.771 . . . . 0.0 111.04 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.598 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 8.7 p90 -174.08 178.88 2.02 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.433 1.083 . . . . 0.0 111.008 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.62 135.94 54.16 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.53 1.144 . . . . 0.0 109.31 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.3 OUTLIER -42.9 108.07 0.1 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.523 1.139 . . . . 0.0 109.358 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 105.7 34.23 3.35 Favored Glycine 0 CA--C 1.529 0.946 0 O-C-N 124.448 1.093 . . . . 0.0 111.018 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . 0.417 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 17.5 t0 -109.97 176.58 5.01 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.49 0.759 . . . . 0.0 109.308 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.467 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 51.7 mt -131.67 148.25 32.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.483 1.114 . . . . 0.0 109.288 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.926 HD13 HG21 ' A' ' 182' ' ' ILE . 2.3 mt -145.01 139.94 27.81 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.512 1.133 . . . . 0.0 109.409 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.544 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 14.0 ttt-85 -86.19 97.12 10.18 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.465 1.103 . . . . 0.0 110.311 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.54 HD11 ' HB3' ' A' ' 164' ' ' LYS . 0.0 OUTLIER -82.98 120.66 34.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.512 1.133 . . . . 0.0 109.284 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.11 -22.71 7.67 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.442 1.089 . . . . 0.0 110.373 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -122.05 137.4 54.82 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.458 1.098 . . . . 0.0 109.276 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.54 ' HB3' HD11 ' A' ' 161' ' ' ILE . 0.0 OUTLIER -147.92 66.95 9.92 Favored Pre-proline 0 C--N 1.325 -0.459 0 O-C-N 124.455 1.097 . . . . 0.0 109.292 179.967 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.0 -38.48 1.57 Allowed 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.523 1.801 . . . . 0.0 111.036 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' GLU . . . . . 0.469 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 8.8 mm-40 -88.08 176.21 7.39 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.469 1.106 . . . . 0.0 110.324 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.443 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 6.7 pt-20 -113.99 47.71 1.17 Allowed 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.524 1.14 . . . . 0.0 110.229 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.443 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 0.2 OUTLIER 174.41 -33.84 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.545 1.153 . . . . 0.0 110.351 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' TRP . . . . . 0.469 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 74.5 m95 -117.07 105.32 12.15 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' TRP . . . . . 0.748 ' O ' HD13 ' A' ' 182' ' ' ILE . 52.8 m0 -110.27 163.52 13.56 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.481 1.113 . . . . 0.0 107.997 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.582 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -101.78 119.32 38.6 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.394 1.059 . . . . 0.0 109.287 179.985 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . 0.605 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -136.78 167.52 21.29 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.53 1.144 . . . . 0.0 109.292 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.722 ' HG3' ' HA2' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -98.32 159.4 14.97 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.475 1.109 . . . . 0.0 110.301 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . 0.678 ' N ' ' HG2' ' A' ' 173' ' ' GLU . 42.8 p-10 -95.85 -157.03 0.55 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.581 1.176 . . . . 0.0 109.309 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 38.3 t -85.66 14.38 5.83 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.567 1.167 . . . . 0.0 110.09 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -136.78 -1.96 2.18 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.546 1.154 . . . . 0.0 110.334 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.722 ' HA2' ' HG3' ' A' ' 173' ' ' GLU . . . 100.03 -17.53 57.03 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 124.531 1.145 . . . . 0.0 111.113 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . 0.633 ' O ' HD21 ' A' ' 151' ' ' LEU . 5.3 mttm -49.62 108.28 0.19 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.584 0.814 . . . . 0.0 109.299 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 33.4 mtm180 -90.75 127.04 36.19 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.457 1.098 . . . . 0.0 110.305 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.582 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -149.92 -164.13 11.57 Favored Glycine 0 CA--C 1.53 1.012 0 O-C-N 124.488 1.117 . . . . 0.0 110.978 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' MET . . . . . 0.469 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -100.69 126.81 47.24 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.533 0.784 . . . . 0.0 111.021 -179.979 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.926 HG21 HD13 ' A' ' 159' ' ' LEU . 0.2 OUTLIER -126.43 150.87 71.64 Favored Pre-proline 0 C--N 1.324 -0.506 0 O-C-N 124.554 1.159 . . . . 0.0 109.324 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 183' ' ' PRO . . . . . 0.756 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.1 Cg_endo -75.1 131.34 14.07 Favored 'Trans proline' 0 C--N 1.361 1.194 0 O-C-N 124.496 1.787 . . . . 0.0 111.006 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.839 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 55.3 t -76.18 -31.21 0.96 Allowed Pre-proline 0 C--N 1.325 -0.482 0 O-C-N 124.418 1.074 . . . . 0.0 109.287 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 185' ' ' PRO . . . . . 0.839 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.95 -24.13 13.23 Favored 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.553 1.817 . . . . 0.0 111.005 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.756 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.6 m-85 -96.27 -5.02 41.2 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.463 1.102 . . . . 0.0 110.989 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 187' ' ' VAL . . . . . 0.752 HG13 ' O ' ' A' ' 183' ' ' PRO . 2.9 m -127.73 153.72 37.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.484 1.115 . . . . 0.0 109.259 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 188' ' ' GLU . . . . . 0.585 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 4.6 pt-20 -105.78 155.59 19.14 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.509 1.13 . . . . 0.0 110.287 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.25 110.0 19.89 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.483 1.114 . . . . 0.0 109.332 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -96.42 -64.7 1.02 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.471 1.107 . . . . 0.0 111.046 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.039 0 O-C-N 124.51 1.131 . . . . 0.0 110.98 -179.985 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . 0.652 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 1.5 p . . . . . 0 N--CA 1.452 -0.335 0 N-CA-C 108.361 -0.978 . . . . 0.0 108.361 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . 0.652 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 0.0 OUTLIER -151.12 177.4 10.23 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.469 1.106 . . . . 0.0 110.999 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.607 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 28.5 m -142.48 155.24 18.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 O-C-N 124.586 1.179 . . . . 0.0 109.289 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.479 ' HA ' ' O ' ' A' ' 157' ' ' ASP . 0.2 OUTLIER -107.84 114.35 28.23 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.466 1.104 . . . . 0.0 110.248 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.523 ' O ' ' N ' ' A' ' 156' ' ' GLY . . . -80.63 110.23 15.91 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.422 1.076 . . . . 0.0 109.263 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.411 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 4.3 mt -88.5 23.79 2.13 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.547 1.154 . . . . 0.0 109.236 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.404 ' O ' ' N ' ' A' ' 155' ' ' LYS . 23.8 t80 -140.58 168.83 18.87 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 124.485 1.116 . . . . 0.0 110.994 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -109.14 122.79 48.06 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.54 1.15 . . . . 0.0 109.325 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.557 ' O ' ' HA ' ' A' ' 152' ' ' PRO . 4.4 t80 -152.84 97.65 2.24 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.508 1.13 . . . . 0.0 111.004 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . 0.456 ' ND2' ' O ' ' A' ' 153' ' ' PHE . 9.7 m-80 -131.71 114.75 15.14 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.503 1.127 . . . . 0.0 109.303 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 81.75 103.7 0.38 Allowed Glycine 0 CA--C 1.53 1.009 0 O-C-N 124.442 1.089 . . . . 0.0 110.999 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . 0.447 ' OD1' ' CZ ' ' A' ' 143' ' ' PHE . 0.4 OUTLIER -151.65 -56.04 0.14 Allowed 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.517 0.775 . . . . 0.0 109.312 179.985 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . 0.414 ' OD1' ' ND2' ' A' ' 146' ' ' ASN . 0.0 OUTLIER -149.69 160.35 43.6 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.543 1.152 . . . . 0.0 109.292 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -79.48 40.37 0.43 Allowed 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.465 1.103 . . . . 0.0 110.273 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . 0.413 ' H ' ' C ' ' A' ' 147' ' ' ASP . 8.2 pt-20 -146.76 -31.05 0.35 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.532 1.145 . . . . 0.0 110.33 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.426 ' OD2' ' CE2' ' A' ' 143' ' ' PHE . 9.6 p-10 -85.25 151.08 24.34 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.44 1.087 . . . . 0.0 109.299 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.684 ' HB3' HG23 ' A' ' 182' ' ' ILE . 13.7 tp -96.04 128.34 37.54 Favored Pre-proline 0 C--N 1.324 -0.506 0 O-C-N 124.459 1.099 . . . . 0.0 109.318 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . 0.557 ' HA ' ' O ' ' A' ' 143' ' ' PHE . 18.3 Cg_endo -74.96 142.14 27.61 Favored 'Trans proline' 0 C--N 1.359 1.13 0 O-C-N 124.531 1.806 . . . . 0.0 111.048 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.475 ' CZ ' ' HB3' ' A' ' 143' ' ' PHE . 7.5 p90 -164.92 -180.0 6.12 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.505 1.128 . . . . 0.0 111.036 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . 0.423 ' O ' ' C ' ' A' ' 155' ' ' LYS . 1.8 ttmt -135.76 144.17 45.67 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.489 1.118 . . . . 0.0 109.277 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.423 ' C ' ' O ' ' A' ' 154' ' ' LYS . 2.8 tmpt? -38.32 135.49 0.74 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.473 1.108 . . . . 0.0 109.331 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 76.63 31.69 53.17 Favored Glycine 0 CA--C 1.529 0.912 0 O-C-N 124.433 1.083 . . . . 0.0 111.029 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . 0.479 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 6.6 t70 -105.47 165.99 10.75 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.48 0.753 . . . . 0.0 109.293 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.488 ' C ' ' HG ' ' A' ' 159' ' ' LEU . 18.7 mm -121.32 147.6 25.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.51 1.131 . . . . 0.0 109.328 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.856 HD13 HG21 ' A' ' 182' ' ' ILE . 0.6 OUTLIER -145.48 133.85 21.84 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.469 1.105 . . . . 0.0 109.33 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.477 ' HB3' ' HB2' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -87.62 105.08 17.1 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.575 1.172 . . . . 0.0 110.328 -179.983 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.565 HD13 ' C ' ' A' ' 161' ' ' ILE . 0.0 OUTLIER -83.47 129.23 37.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.567 1.167 . . . . 0.0 109.289 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . 0.431 ' HB3' ' OD1' ' A' ' 163' ' ' ASP . 4.7 ttt-85 -124.05 -22.11 4.9 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.513 1.133 . . . . 0.0 110.257 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' ASP . . . . . 0.59 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -138.26 158.3 44.56 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.489 1.118 . . . . 0.0 109.245 -179.952 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.552 ' HB2' ' CG ' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -155.19 76.14 5.2 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.466 1.103 . . . . 0.0 109.303 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.03 -1.17 10.88 Favored 'Trans proline' 0 C--N 1.361 1.213 0 O-C-N 124.534 1.808 . . . . 0.0 110.999 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' GLU . . . . . 0.481 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.1 mt-10 -128.03 171.9 11.44 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.492 1.12 . . . . 0.0 110.301 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -100.24 14.99 29.06 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.53 1.144 . . . . 0.0 110.261 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.444 ' O ' ' N ' ' A' ' 184' ' ' VAL . 8.6 mt-30 -155.31 -45.73 0.08 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.449 1.093 . . . . 0.0 110.291 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' TRP . . . . . 0.448 ' O ' ' HE1' ' A' ' 181' ' ' MET . 91.1 m95 -98.32 103.17 15.09 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' TRP . . . . . 0.7 ' CD2' HG21 ' A' ' 184' ' ' VAL . 36.0 m0 -107.91 154.7 21.22 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.977 -1.119 . . . . 0.0 107.977 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 1.2 t-20 -88.05 116.17 26.04 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.514 1.134 . . . . 0.0 109.294 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . 0.62 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -137.37 160.24 39.64 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.511 1.132 . . . . 0.0 109.216 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.576 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 2.6 mp0 -89.17 156.31 18.87 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.496 1.123 . . . . 0.0 110.279 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . 0.571 ' N ' HD21 ' A' ' 151' ' ' LEU . 0.4 OUTLIER -90.73 -162.07 0.87 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.478 1.111 . . . . 0.0 109.343 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 4.1 m -80.74 9.54 6.12 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.549 1.156 . . . . 0.0 109.996 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -132.04 -5.97 3.5 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.523 1.14 . . . . 0.0 110.338 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.502 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 103.69 -10.4 52.88 Favored Glycine 0 CA--C 1.53 0.979 0 O-C-N 124.557 1.161 . . . . 0.0 111.011 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . 0.578 ' O ' HD11 ' A' ' 151' ' ' LEU . 1.2 mttt -53.89 114.19 1.49 Allowed 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.478 0.752 . . . . 0.0 109.319 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . 0.557 ' CG ' ' CD ' ' A' ' 173' ' ' GLU . 5.6 mtm105 -88.07 126.58 35.18 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.48 1.113 . . . . 0.0 110.281 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.501 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -155.53 -172.42 23.09 Favored Glycine 0 CA--C 1.53 0.999 0 O-C-N 124.53 1.144 . . . . 0.0 111.043 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' MET . . . . . 0.448 ' HE1' ' O ' ' A' ' 169' ' ' TRP . 84.5 mmm -99.94 117.87 35.16 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.506 0.768 . . . . 0.0 111.009 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.856 HG21 HD13 ' A' ' 159' ' ' LEU . 1.1 pt -117.96 151.28 48.68 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.494 1.121 . . . . 0.0 109.337 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 183' ' ' PRO . . . . . 0.778 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -74.9 131.02 13.94 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.58 1.832 . . . . 0.0 110.987 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.84 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 4.0 t -76.76 -30.72 0.85 Allowed Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.522 1.139 . . . . 0.0 109.251 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 185' ' ' PRO . . . . . 0.84 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -75.03 -22.42 14.78 Favored 'Trans proline' 0 C--N 1.36 1.137 0 O-C-N 124.503 1.791 . . . . 0.0 111.013 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.778 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 11.6 m-85 -97.67 -4.89 36.47 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.443 1.089 . . . . 0.0 111.007 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 187' ' ' VAL . . . . . 0.641 HG22 ' HA ' ' A' ' 184' ' ' VAL . 4.0 m -127.3 151.31 33.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.556 1.16 . . . . 0.0 109.343 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 188' ' ' GLU . . . . . 0.607 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 2.4 mt-10 -101.84 144.42 30.52 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.468 1.105 . . . . 0.0 110.278 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . 0.557 ' HA ' HG12 ' A' ' 137' ' ' VAL . 0.0 OUTLIER -87.24 109.0 19.19 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.541 1.151 . . . . 0.0 109.27 179.977 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . 0.6 ' HB3' ' CD1' ' A' ' 136' ' ' TYR . 2.2 t80 -100.54 -25.92 14.02 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.51 1.131 . . . . 0.0 111.002 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 191' ' ' GLY . . . . . 0.623 ' O ' ' CE1' ' A' ' 136' ' ' TYR . . . . . . . . 0 CA--C 1.53 1.007 0 O-C-N 124.41 1.069 . . . . 0.0 111.018 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . 0.409 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 7.5 p . . . . . 0 N--CA 1.452 -0.35 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . 0.409 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 10.5 m-85 -150.88 167.17 28.34 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.463 1.102 . . . . 0.0 111.017 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.577 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 6.2 m -142.38 133.29 24.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.522 1.139 . . . . 0.0 109.306 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.524 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 23.6 ttp85 -101.57 110.18 22.12 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.509 1.131 . . . . 0.0 110.329 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.469 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -81.46 109.27 15.77 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.465 1.103 . . . . 0.0 109.317 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.502 HD12 ' O ' ' A' ' 138' ' ' ARG . 5.2 mp -89.44 23.3 2.61 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.526 1.141 . . . . 0.0 109.347 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -140.95 165.32 27.85 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.457 1.098 . . . . 0.0 110.972 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.81 127.52 53.15 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.518 1.136 . . . . 0.0 109.286 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.644 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 64.2 t80 -140.3 131.18 26.01 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.479 1.112 . . . . 0.0 110.968 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -138.88 126.73 22.23 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.56 1.163 . . . . 0.0 109.295 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . 0.458 ' O ' ' ND2' ' A' ' 146' ' ' ASN . . . -146.81 -131.61 2.22 Favored Glycine 0 CA--C 1.529 0.942 0 O-C-N 124.457 1.098 . . . . 0.0 111.006 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . 0.458 ' ND2' ' O ' ' A' ' 145' ' ' GLY . 3.9 p30 160.48 74.85 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.399 0.705 . . . . 0.0 109.316 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . 0.492 ' C ' ' H ' ' A' ' 149' ' ' GLU . 9.9 t70 -144.53 154.92 43.39 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.473 1.108 . . . . 0.0 109.305 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -77.65 25.19 0.2 Allowed 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.541 1.151 . . . . 0.0 110.332 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . 0.492 ' H ' ' C ' ' A' ' 147' ' ' ASP . 4.5 mt-10 -153.64 18.71 0.53 Allowed 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.469 1.106 . . . . 0.0 110.328 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.468 ' OD2' ' CB ' ' A' ' 147' ' ' ASP . 24.4 p30 -139.38 153.49 47.67 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.445 1.091 . . . . 0.0 109.239 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.732 ' HB3' HG23 ' A' ' 182' ' ' ILE . 13.8 tp -131.26 112.22 15.56 Favored Pre-proline 0 C--N 1.326 -0.451 0 O-C-N 124.449 1.093 . . . . 0.0 109.262 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.04 154.62 42.43 Favored 'Trans proline' 0 C--N 1.359 1.125 0 O-C-N 124.506 1.793 . . . . 0.0 111.062 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.644 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 4.8 p90 -164.69 -177.55 4.83 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.555 1.16 . . . . 0.0 111.043 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.43 138.44 51.46 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.538 1.149 . . . . 0.0 109.253 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -45.97 117.67 1.6 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.474 1.109 . . . . 0.0 109.283 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 96.48 35.42 5.45 Favored Glycine 0 CA--C 1.529 0.939 0 O-C-N 124.517 1.135 . . . . 0.0 110.985 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -113.86 173.23 6.53 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.508 0.769 . . . . 0.0 109.298 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.456 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 24.1 mt -127.62 149.85 32.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.43 1.081 . . . . 0.0 109.328 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.875 HD13 HG21 ' A' ' 182' ' ' ILE . 0.2 OUTLIER -143.33 139.46 30.1 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.563 1.164 . . . . 0.0 109.283 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.488 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 8.4 ttp180 -87.51 107.06 18.4 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.504 1.127 . . . . 0.0 110.324 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.845 HD12 ' O ' ' A' ' 171' ' ' ASN . 10.6 tp -84.45 128.17 39.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.445 1.091 . . . . 0.0 109.325 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.9 ttt180 -128.32 -24.29 3.12 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.506 1.129 . . . . 0.0 110.313 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -127.07 151.93 47.96 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.515 1.134 . . . . 0.0 109.244 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.547 ' HG3' ' CE2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -147.67 80.25 9.07 Favored Pre-proline 0 C--N 1.326 -0.455 0 O-C-N 124.48 1.112 . . . . 0.0 109.289 179.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 -45.91 0.26 Allowed 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.499 1.789 . . . . 0.0 110.99 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' GLU . . . . . . . . . . . . . 62.6 mm-40 -93.11 -173.2 3.19 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.484 1.115 . . . . 0.0 110.305 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -108.16 -11.39 15.27 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.471 1.107 . . . . 0.0 110.261 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -123.64 -32.52 3.33 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.533 1.146 . . . . 0.0 110.306 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -110.51 112.93 25.17 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.562 1.164 . . . . 0.0 107.977 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' TRP . . . . . 0.858 ' CE2' HG21 ' A' ' 184' ' ' VAL . 45.9 m0 -112.69 159.35 19.0 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.527 1.142 . . . . 0.0 107.992 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.845 ' O ' HD12 ' A' ' 161' ' ' ILE . 1.5 t30 -94.65 115.16 27.21 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.507 1.129 . . . . 0.0 109.3 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . 0.768 ' HB3' ' CD1' ' A' ' 182' ' ' ILE . . . -136.58 164.86 27.21 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.521 1.138 . . . . 0.0 109.292 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.615 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 6.5 mp0 -97.77 153.85 18.0 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.518 1.136 . . . . 0.0 110.295 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . 0.45 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.4 OUTLIER -85.97 -161.5 0.64 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.541 1.15 . . . . 0.0 109.305 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 1.5 t -81.27 11.93 3.94 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.505 1.128 . . . . 0.0 110.057 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -133.56 -4.53 2.93 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.505 1.128 . . . . 0.0 110.226 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.537 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 103.63 -15.3 53.11 Favored Glycine 0 CA--C 1.531 1.07 0 O-C-N 124.504 1.128 . . . . 0.0 110.994 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . 0.45 ' O ' HD11 ' A' ' 151' ' ' LEU . 2.2 mtpt -46.74 109.04 0.16 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.595 0.82 . . . . 0.0 109.358 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -89.21 123.5 33.5 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.533 1.146 . . . . 0.0 110.281 -179.946 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.502 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.57 -164.08 12.57 Favored Glycine 0 CA--C 1.53 0.982 0 O-C-N 124.5 1.125 . . . . 0.0 111.0 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' MET . . . . . 0.403 ' HB2' ' O ' ' A' ' 149' ' ' GLU . 1.0 OUTLIER -103.18 123.83 47.45 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.521 0.777 . . . . 0.0 111.002 179.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.875 HG21 HD13 ' A' ' 159' ' ' LEU . 0.1 OUTLIER -122.7 152.19 61.66 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.506 1.129 . . . . 0.0 109.315 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 183' ' ' PRO . . . . . 0.743 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.01 129.82 12.69 Favored 'Trans proline' 0 C--N 1.358 1.065 0 O-C-N 124.571 1.827 . . . . 0.0 110.95 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.858 HG21 ' CE2' ' A' ' 170' ' ' TRP . 3.6 t -76.29 -32.24 1.07 Allowed Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.407 1.067 . . . . 0.0 109.203 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 185' ' ' PRO . . . . . 0.822 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -75.1 -24.19 12.9 Favored 'Trans proline' 0 C--N 1.359 1.095 0 O-C-N 124.519 1.8 . . . . 0.0 111.012 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.743 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 9.1 m-85 -96.54 -1.41 47.16 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.53 1.144 . . . . 0.0 111.057 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 187' ' ' VAL . . . . . 0.737 HG22 ' O ' ' A' ' 183' ' ' PRO . 9.4 m -128.57 152.36 36.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 O-C-N 124.575 1.172 . . . . 0.0 109.313 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 188' ' ' GLU . . . . . 0.577 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 2.2 tt0 -97.8 151.76 19.86 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.421 1.076 . . . . 0.0 110.404 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.47 106.22 17.83 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.552 1.157 . . . . 0.0 109.305 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -85.36 -52.18 6.05 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.494 1.121 . . . . 0.0 110.992 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.005 0 O-C-N 124.565 1.166 . . . . 0.0 111.003 179.975 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . 0.437 ' O ' ' HG2' ' A' ' 160' ' ' ARG . 67.7 m . . . . . 0 N--CA 1.453 -0.318 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . 0.413 ' N ' ' C ' ' A' ' 191' ' ' GLY . 41.5 m-85 -156.35 167.0 31.78 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.509 1.131 . . . . 0.0 110.937 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.529 HG23 ' N ' ' A' ' 138' ' ' ARG . 0.5 OUTLIER -148.67 167.17 3.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.511 1.132 . . . . 0.0 109.282 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.529 ' N ' HG23 ' A' ' 137' ' ' VAL . 0.1 OUTLIER -128.41 117.03 20.67 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.47 1.106 . . . . 0.0 110.282 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -84.78 109.78 18.32 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.443 1.089 . . . . 0.0 109.304 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.402 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 1.4 mt -89.47 26.12 1.78 Allowed 'General case' 0 C--N 1.323 -0.55 0 O-C-N 124.544 1.153 . . . . 0.0 109.284 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.503 ' CD2' ' CD2' ' A' ' 186' ' ' TYR . 41.1 m-85 -144.3 150.43 37.86 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.489 1.118 . . . . 0.0 111.007 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -94.14 127.02 39.71 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.483 1.114 . . . . 0.0 109.286 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.592 ' CB ' ' CE1' ' A' ' 153' ' ' PHE . 5.0 t80 -142.81 130.66 21.61 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.41 1.069 . . . . 0.0 110.962 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -139.14 88.04 2.25 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.456 1.098 . . . . 0.0 109.329 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . 0.507 ' O ' ' CB ' ' A' ' 146' ' ' ASN . . . -116.19 -130.92 4.68 Favored Glycine 0 CA--C 1.53 1.024 0 O-C-N 124.468 1.105 . . . . 0.0 110.987 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . 0.507 ' CB ' ' O ' ' A' ' 145' ' ' GLY . 4.6 m-20 154.12 82.89 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.482 0.754 . . . . 0.0 109.274 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -132.98 163.31 29.48 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.481 1.113 . . . . 0.0 109.326 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -62.89 -13.26 32.07 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.502 1.126 . . . . 0.0 110.241 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . 0.426 ' O ' ' HB2' ' A' ' 181' ' ' MET . 17.4 mt-10 -141.27 49.09 1.65 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.564 1.165 . . . . 0.0 110.314 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.408 ' OD1' ' CZ ' ' A' ' 143' ' ' PHE . 1.4 t0 -147.07 149.69 33.56 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.439 1.087 . . . . 0.0 109.277 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.672 HD22 ' O ' ' A' ' 172' ' ' ALA . 14.8 tp -134.44 118.2 13.62 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.522 1.139 . . . . 0.0 109.29 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.11 162.63 36.55 Favored 'Trans proline' 0 C--N 1.36 1.138 0 O-C-N 124.54 1.81 . . . . 0.0 110.98 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.592 ' CE1' ' CB ' ' A' ' 143' ' ' PHE . 8.2 p90 -175.48 178.89 1.55 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.513 1.133 . . . . 0.0 111.003 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . 0.426 ' HD3' ' N ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -123.29 143.71 49.89 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.602 1.189 . . . . 0.0 109.242 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.426 ' N ' ' HD3' ' A' ' 154' ' ' LYS . 2.6 ttpt -53.72 114.23 1.48 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.44 1.088 . . . . 0.0 109.256 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 99.35 30.01 6.81 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.488 1.117 . . . . 0.0 111.035 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . 0.439 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 12.4 t70 -107.3 174.41 5.9 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.451 0.736 . . . . 0.0 109.365 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.525 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 32.7 mt -121.32 155.95 25.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 O-C-N 124.482 1.114 . . . . 0.0 109.308 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.728 HD13 HG21 ' A' ' 182' ' ' ILE . 3.2 mt -144.76 148.35 34.01 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.475 1.11 . . . . 0.0 109.289 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.53 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.3 OUTLIER -99.63 107.86 20.1 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.482 1.114 . . . . 0.0 110.291 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.686 HG12 ' HB2' ' A' ' 172' ' ' ALA . 1.6 mm -79.83 130.5 35.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.468 1.105 . . . . 0.0 109.292 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.6 ttt-85 -128.23 -25.5 2.97 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.494 1.121 . . . . 0.0 110.309 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -141.73 158.15 44.17 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.504 1.128 . . . . 0.0 109.285 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.558 ' HB3' ' CD1' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -142.4 77.58 17.34 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.554 1.158 . . . . 0.0 109.277 179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 -2.71 12.89 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.454 1.765 . . . . 0.0 110.981 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 169' ' ' TRP . 11.9 mt-10 -144.6 -171.76 3.67 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.503 1.127 . . . . 0.0 110.359 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -113.38 -16.84 12.4 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.466 1.104 . . . . 0.0 110.275 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.408 ' CD ' ' N ' ' A' ' 168' ' ' GLN . 4.0 mp0 -116.88 -24.59 7.58 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.491 1.12 . . . . 0.0 110.247 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' TRP . . . . . 0.443 ' O ' ' HE1' ' A' ' 181' ' ' MET . 85.9 m95 -125.37 105.58 9.2 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.551 1.157 . . . . 0.0 107.959 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' TRP . . . . . 0.567 ' CE3' HG22 ' A' ' 184' ' ' VAL . 34.4 m0 -103.19 164.36 11.68 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.503 1.127 . . . . 0.0 107.997 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.438 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.8 OUTLIER -99.39 97.48 8.52 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.448 1.092 . . . . 0.0 109.26 -179.949 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . 0.686 ' HB2' HG12 ' A' ' 161' ' ' ILE . . . -124.39 166.87 15.21 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.468 1.105 . . . . 0.0 109.302 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.528 ' CG ' ' O ' ' A' ' 177' ' ' GLY . 0.8 OUTLIER -96.07 159.17 15.1 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.468 1.105 . . . . 0.0 110.298 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . 0.576 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.4 OUTLIER -90.28 -160.39 0.69 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.464 1.102 . . . . 0.0 109.249 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 2.5 m -81.24 8.35 9.19 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.505 1.128 . . . . 0.0 109.985 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -128.08 -5.61 5.54 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.491 1.119 . . . . 0.0 110.341 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.528 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 101.06 -9.47 58.02 Favored Glycine 0 CA--C 1.53 0.994 0 O-C-N 124.472 1.108 . . . . 0.0 111.023 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . 0.468 ' O ' HD11 ' A' ' 151' ' ' LEU . 4.7 mtmt -53.74 111.8 0.8 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.469 0.746 . . . . 0.0 109.3 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . 0.444 ' CG ' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.61 122.31 30.35 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.476 1.11 . . . . 0.0 110.238 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.438 ' HA3' ' HB2' ' A' ' 151' ' ' LEU . . . -155.33 -164.98 13.63 Favored Glycine 0 CA--C 1.529 0.93 0 O-C-N 124.478 1.111 . . . . 0.0 111.023 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' MET . . . . . 0.443 ' HE1' ' O ' ' A' ' 169' ' ' TRP . 1.1 mmt -94.55 122.87 37.58 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.488 0.758 . . . . 0.0 110.983 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.728 HG21 HD13 ' A' ' 159' ' ' LEU . 18.0 pt -116.29 141.96 28.65 Favored Pre-proline 0 C--N 1.326 -0.454 0 O-C-N 124.495 1.122 . . . . 0.0 109.294 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 183' ' ' PRO . . . . . 0.839 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.3 Cg_endo -74.99 126.64 10.1 Favored 'Trans proline' 0 C--N 1.36 1.132 0 O-C-N 124.472 1.775 . . . . 0.0 111.044 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.819 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 90.6 t -74.08 -31.21 1.24 Allowed Pre-proline 0 C--N 1.325 -0.491 0 O-C-N 124.541 1.151 . . . . 0.0 109.276 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 185' ' ' PRO . . . . . 0.819 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -75.01 -28.17 9.38 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.493 1.786 . . . . 0.0 111.023 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.643 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.9 m-85 -98.07 2.86 49.18 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.532 1.145 . . . . 0.0 110.938 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 187' ' ' VAL . . . . . 0.839 HG13 ' O ' ' A' ' 183' ' ' PRO . 2.4 m -136.12 162.46 36.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.548 1.155 . . . . 0.0 109.29 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 188' ' ' GLU . . . . . 0.407 ' N ' ' O ' ' A' ' 138' ' ' ARG . 0.1 OUTLIER -116.35 155.3 28.7 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.505 1.128 . . . . 0.0 110.254 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.77 110.77 20.72 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.554 1.159 . . . . 0.0 109.316 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -93.82 -47.46 6.74 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.52 1.138 . . . . 0.0 110.99 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 191' ' ' GLY . . . . . 0.413 ' C ' ' N ' ' A' ' 136' ' ' TYR . . . . . . . . 0 CA--C 1.53 1.02 0 O-C-N 124.494 1.121 . . . . 0.0 111.055 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . 0.578 ' HB3' ' CD2' ' A' ' 136' ' ' TYR . 0.5 OUTLIER . . . . . 0 N--CA 1.452 -0.333 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . 0.578 ' CD2' ' HB3' ' A' ' 135' ' ' CYS . 0.4 OUTLIER -143.82 169.52 17.63 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.549 1.156 . . . . 0.0 110.971 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.821 HG12 ' HA ' ' A' ' 189' ' ' LYS . 33.3 m -140.3 161.83 24.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.475 1.109 . . . . 0.0 109.269 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.447 ' O ' HD13 ' A' ' 140' ' ' LEU . 30.5 ttm180 -118.35 113.69 21.8 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.563 1.165 . . . . 0.0 110.247 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.539 ' O ' ' N ' ' A' ' 156' ' ' GLY . . . -82.52 112.31 19.32 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.498 1.123 . . . . 0.0 109.282 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.639 HD22 ' H ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -87.68 21.05 2.71 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.531 1.144 . . . . 0.0 109.229 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.411 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -147.47 164.05 34.59 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.464 1.103 . . . . 0.0 110.996 179.96 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -102.78 156.79 17.4 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.542 1.151 . . . . 0.0 109.309 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.651 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 20.6 t80 -177.5 139.57 0.25 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.535 1.147 . . . . 0.0 110.969 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . 0.438 ' HA ' ' HB3' ' A' ' 152' ' ' PRO . 3.8 p-10 -112.07 -52.23 2.8 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.584 1.177 . . . . 0.0 109.327 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . 0.537 ' O ' ' CB ' ' A' ' 146' ' ' ASN . . . 77.47 -76.4 1.69 Allowed Glycine 0 CA--C 1.53 0.985 0 O-C-N 124.563 1.164 . . . . 0.0 111.023 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . 0.552 ' O ' ' CB ' ' A' ' 147' ' ' ASP . 3.8 m-20 152.76 -17.07 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.475 0.75 . . . . 0.0 109.275 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . 0.552 ' CB ' ' O ' ' A' ' 146' ' ' ASN . 0.6 OUTLIER 86.67 -162.89 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.555 1.159 . . . . 0.0 109.34 -179.93 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.446 ' C ' ' O ' ' A' ' 147' ' ' ASP . 8.0 tt0 35.2 38.56 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.566 1.166 . . . . 0.0 110.318 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 168.3 -25.68 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.457 1.098 . . . . 0.0 110.343 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.419 ' O ' ' HA ' ' A' ' 147' ' ' ASP . 2.8 m-20 -146.54 167.77 22.88 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.469 1.105 . . . . 0.0 109.313 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 1.082 HD23 HD11 ' A' ' 182' ' ' ILE . 14.5 tp -112.65 118.39 45.18 Favored Pre-proline 0 C--N 1.325 -0.459 0 O-C-N 124.527 1.142 . . . . 0.0 109.318 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . 0.44 ' HG3' ' OD1' ' A' ' 147' ' ' ASP . 18.3 Cg_endo -75.03 145.5 31.4 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.481 1.779 . . . . 0.0 110.975 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.651 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 5.9 p90 -157.5 -177.67 6.76 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.526 1.141 . . . . 0.0 110.999 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.29 140.06 43.11 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.525 1.141 . . . . 0.0 109.285 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 1.0 OUTLIER -43.61 131.13 5.25 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.493 1.12 . . . . 0.0 109.352 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.539 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 78.84 39.72 19.74 Favored Glycine 0 CA--C 1.53 0.997 0 O-C-N 124.548 1.155 . . . . 0.0 111.036 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . 0.42 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 25.2 t70 -116.98 165.66 13.09 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.487 0.757 . . . . 0.0 109.292 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.49 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 11.2 mm -116.9 147.81 20.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.553 1.158 . . . . 0.0 109.327 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.955 HD13 HD13 ' A' ' 182' ' ' ILE . 0.9 OUTLIER -141.84 138.1 31.92 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.434 1.084 . . . . 0.0 109.34 179.972 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.517 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.0 OUTLIER -87.45 102.25 14.37 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.477 1.11 . . . . 0.0 110.352 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 1.018 HD12 ' HB2' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -84.86 123.28 39.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.494 1.121 . . . . 0.0 109.279 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -122.77 -22.89 5.2 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.501 1.125 . . . . 0.0 110.273 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -131.31 152.55 50.46 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.491 1.12 . . . . 0.0 109.265 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.575 ' CB ' ' CG ' ' A' ' 170' ' ' TRP . 3.4 pttp -160.15 66.63 2.62 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 124.519 1.137 . . . . 0.0 109.276 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -75.05 4.26 4.92 Favored 'Trans proline' 0 C--N 1.361 1.191 0 O-C-N 124.445 1.761 . . . . 0.0 110.935 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' GLU . . . . . 0.474 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 9.2 mt-10 -127.65 177.92 6.47 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.567 1.167 . . . . 0.0 110.272 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.505 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 7.3 pt-20 -112.61 33.53 4.9 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.459 1.099 . . . . 0.0 110.302 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.505 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 3.4 mt-30 -175.66 -37.99 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.523 1.14 . . . . 0.0 110.309 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -108.43 100.22 9.53 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.554 1.159 . . . . 0.0 107.983 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' TRP . . . . . 0.814 ' HB2' HD11 ' A' ' 161' ' ' ILE . 37.3 m0 -108.15 153.75 22.71 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.518 1.136 . . . . 0.0 108.013 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 2.8 t30 -88.04 110.23 20.45 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.475 1.11 . . . . 0.0 109.27 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . 1.026 ' HB3' HD12 ' A' ' 182' ' ' ILE . . . -130.37 159.58 36.56 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.529 1.143 . . . . 0.0 109.385 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.557 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.8 OUTLIER -92.26 156.79 17.04 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.458 1.099 . . . . 0.0 110.292 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . 0.581 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.5 OUTLIER -91.08 -160.32 0.71 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.498 1.124 . . . . 0.0 109.335 179.968 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.94 8.45 8.35 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.525 1.141 . . . . 0.0 110.004 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -128.66 -5.07 5.23 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.466 1.104 . . . . 0.0 110.287 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.521 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 100.16 -11.01 60.23 Favored Glycine 0 CA--C 1.53 0.999 0 O-C-N 124.449 1.093 . . . . 0.0 111.05 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 10.7 mttp -52.6 111.75 0.7 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.583 0.813 . . . . 0.0 109.293 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.0 OUTLIER -87.19 124.28 33.12 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.523 1.14 . . . . 0.0 110.282 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.456 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -155.13 -168.05 17.73 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.51 1.131 . . . . 0.0 110.906 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -89.19 122.13 32.17 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.441 0.73 . . . . 0.0 111.095 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 1.082 HD11 HD23 ' A' ' 151' ' ' LEU . 62.0 mt -121.29 143.07 36.56 Favored Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.476 1.11 . . . . 0.0 109.265 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 183' ' ' PRO . . . . . 0.771 ' HD2' HG23 ' A' ' 182' ' ' ILE . 18.0 Cg_endo -75.1 133.12 16.06 Favored 'Trans proline' 0 C--N 1.361 1.193 0 O-C-N 124.466 1.772 . . . . 0.0 110.928 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.828 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 42.2 t -80.09 -31.82 0.67 Allowed Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.508 1.13 . . . . 0.0 109.295 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 185' ' ' PRO . . . . . 0.828 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -75.03 -28.14 9.36 Favored 'Trans proline' 0 C--N 1.361 1.208 0 O-C-N 124.443 1.759 . . . . 0.0 110.989 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.605 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 9.7 m-85 -96.9 12.29 32.83 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.418 1.074 . . . . 0.0 111.067 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 187' ' ' VAL . . . . . 0.673 HG13 ' O ' ' A' ' 183' ' ' PRO . 1.7 m -149.55 149.97 14.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.55 1.156 . . . . 0.0 109.257 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 188' ' ' GLU . . . . . 0.503 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.6 OUTLIER -98.36 138.22 35.92 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.48 1.113 . . . . 0.0 110.318 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . 0.821 ' HA ' HG12 ' A' ' 137' ' ' VAL . 1.0 OUTLIER -86.65 103.64 15.32 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.513 1.133 . . . . 0.0 109.283 -179.969 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . 0.457 ' HB3' ' CD1' ' A' ' 136' ' ' TYR . 1.2 t80 -87.72 -36.61 17.27 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.526 1.141 . . . . 0.0 110.979 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.024 0 O-C-N 124.514 1.134 . . . . 0.0 111.02 179.951 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . 0.401 ' O ' ' HG2' ' A' ' 160' ' ' ARG . 26.3 p . . . . . 0 N--CA 1.453 -0.312 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . 0.49 ' CE1' ' HB2' ' A' ' 160' ' ' ARG . 5.6 m-85 -155.48 171.69 19.5 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.608 1.193 . . . . 0.0 110.995 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.622 HG22 HG23 ' A' ' 161' ' ' ILE . 3.3 m -145.27 144.4 21.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.501 1.126 . . . . 0.0 109.327 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.738 ' O ' HD13 ' A' ' 140' ' ' LEU . 0.4 OUTLIER -106.31 112.91 26.13 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.543 1.152 . . . . 0.0 110.332 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.435 ' CB ' HG12 ' A' ' 187' ' ' VAL . . . -83.27 105.45 14.24 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.474 1.108 . . . . 0.0 109.276 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.738 HD13 ' O ' ' A' ' 138' ' ' ARG . 0.0 OUTLIER -88.3 26.98 1.31 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.513 1.133 . . . . 0.0 109.236 179.974 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.402 ' CA ' ' HG2' ' A' ' 155' ' ' LYS . 6.4 m-85 -144.58 157.2 44.32 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.511 1.132 . . . . 0.0 110.993 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -93.28 130.89 38.84 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.513 1.133 . . . . 0.0 109.282 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.613 ' HB2' ' CZ ' ' A' ' 153' ' ' PHE . 35.5 t80 -142.26 133.36 26.04 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.518 1.136 . . . . 0.0 110.981 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . 0.421 ' HA ' ' HB3' ' A' ' 152' ' ' PRO . 53.6 t-20 -159.15 109.5 1.99 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.545 1.153 . . . . 0.0 109.243 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 87.67 135.11 4.62 Favored Glycine 0 CA--C 1.53 0.984 0 O-C-N 124.492 1.12 . . . . 0.0 111.0 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . 0.505 ' HB2' ' CZ ' ' A' ' 143' ' ' PHE . 2.7 t30 -179.4 -52.56 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.471 0.748 . . . . 0.0 109.267 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . 0.449 ' CG ' ' HB3' ' A' ' 150' ' ' ASP . 0.0 OUTLIER -149.32 -175.19 4.89 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.506 1.129 . . . . 0.0 109.35 -179.95 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -83.54 -25.85 30.63 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.485 1.116 . . . . 0.0 110.312 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -110.83 23.49 14.11 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.442 1.089 . . . . 0.0 110.302 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.449 ' HB3' ' CG ' ' A' ' 147' ' ' ASP . 0.0 OUTLIER -85.73 151.5 23.8 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.533 1.146 . . . . 0.0 109.294 179.947 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.881 HD23 ' CG2' ' A' ' 182' ' ' ILE . 12.2 tp -110.8 101.76 50.37 Favored Pre-proline 0 C--N 1.326 -0.446 0 O-C-N 124.526 1.141 . . . . 0.0 109.272 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . 0.421 ' HB3' ' HA ' ' A' ' 144' ' ' ASN . 18.1 Cg_endo -75.03 150.24 37.72 Favored 'Trans proline' 0 C--N 1.361 1.191 0 O-C-N 124.503 1.791 . . . . 0.0 110.98 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.613 ' CZ ' ' HB2' ' A' ' 143' ' ' PHE . 21.1 p90 -160.45 178.45 9.55 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.51 1.131 . . . . 0.0 110.937 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . 0.415 ' O ' ' C ' ' A' ' 155' ' ' LYS . 1.1 ttpp -126.28 143.5 51.13 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.545 1.153 . . . . 0.0 109.319 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.527 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.1 OUTLIER -39.27 128.21 1.77 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.429 1.08 . . . . 0.0 109.267 -180.0 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.474 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 79.6 40.8 14.27 Favored Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.578 1.174 . . . . 0.0 111.033 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . 0.523 ' OD1' HD21 ' A' ' 159' ' ' LEU . 5.0 t70 -111.48 162.41 15.13 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.6 0.824 . . . . 0.0 109.277 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.483 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 75.7 mt -120.39 146.69 24.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.454 1.096 . . . . 0.0 109.271 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.949 HD13 HG21 ' A' ' 182' ' ' ILE . 0.9 OUTLIER -141.53 141.85 33.56 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.538 1.149 . . . . 0.0 109.342 179.978 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.49 ' HB2' ' CE1' ' A' ' 136' ' ' TYR . 9.8 ttm-85 -93.48 102.14 14.35 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.553 1.158 . . . . 0.0 110.319 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.838 HG22 ' HB2' ' A' ' 172' ' ' ALA . 0.7 OUTLIER -82.13 125.53 39.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 O-C-N 124.599 1.187 . . . . 0.0 109.278 -179.982 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -121.11 -22.25 6.17 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 124.446 1.091 . . . . 0.0 110.254 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -134.0 144.53 48.78 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.597 1.186 . . . . 0.0 109.268 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.551 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -141.09 80.73 16.66 Favored Pre-proline 0 C--N 1.325 -0.483 0 O-C-N 124.503 1.127 . . . . 0.0 109.317 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.06 -50.35 0.13 Allowed 'Trans proline' 0 C--N 1.359 1.104 0 O-C-N 124.514 1.797 . . . . 0.0 110.929 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' GLU . . . . . 0.425 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 2.0 mt-10 -82.23 179.62 7.74 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 0.0 110.299 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -104.84 9.37 34.82 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.542 1.152 . . . . 0.0 110.284 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -146.55 -42.59 0.19 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.507 1.129 . . . . 0.0 110.279 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' TRP . . . . . 0.402 ' HH2' ' CZ ' ' A' ' 143' ' ' PHE . 68.2 m95 -103.61 111.39 23.85 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.487 1.117 . . . . 0.0 108.002 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' TRP . . . . . 0.681 ' O ' HD13 ' A' ' 182' ' ' ILE . 50.2 m0 -113.71 164.66 13.42 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.54 1.15 . . . . 0.0 107.937 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.483 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -96.75 117.06 30.22 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.457 1.098 . . . . 0.0 109.265 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . 0.838 ' HB2' HG22 ' A' ' 161' ' ' ILE . . . -139.59 163.45 32.53 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.586 1.179 . . . . 0.0 109.284 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.574 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 2.7 mp0 -90.79 157.52 17.34 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.575 1.172 . . . . 0.0 110.31 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . 0.53 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 2.0 t0 -92.5 -160.67 0.76 Allowed 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.484 1.115 . . . . 0.0 109.364 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 43.1 t -81.13 6.68 13.05 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.484 1.115 . . . . 0.0 109.971 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -127.03 -3.64 6.37 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.523 1.139 . . . . 0.0 110.37 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.512 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 98.88 -11.34 62.47 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.435 1.084 . . . . 0.0 111.011 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . 0.69 ' O ' HD11 ' A' ' 151' ' ' LEU . 21.4 mttt -51.91 115.79 1.85 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.521 0.777 . . . . 0.0 109.302 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . 0.497 ' HG2' ' CG ' ' A' ' 173' ' ' GLU . 0.5 OUTLIER -86.69 122.05 30.05 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.527 1.142 . . . . 0.0 110.353 179.97 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.726 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -154.82 -166.82 15.71 Favored Glycine 0 CA--C 1.53 1.03 0 O-C-N 124.518 1.136 . . . . 0.0 110.975 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 5.3 ttm -100.4 131.84 46.11 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.533 0.784 . . . . 0.0 110.975 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.949 HG21 HD13 ' A' ' 159' ' ' LEU . 0.2 OUTLIER -126.14 145.79 53.61 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.545 1.153 . . . . 0.0 109.306 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 183' ' ' PRO . . . . . 0.767 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -74.97 123.59 8.01 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.505 1.792 . . . . 0.0 111.021 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.835 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 5.1 t -69.49 -29.87 1.95 Allowed Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.553 1.158 . . . . 0.0 109.303 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 185' ' ' PRO . . . . . 0.835 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.97 -25.23 12.11 Favored 'Trans proline' 0 C--N 1.361 1.209 0 O-C-N 124.491 1.785 . . . . 0.0 111.05 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.767 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 3.7 m-85 -99.92 0.12 40.59 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.461 1.101 . . . . 0.0 111.013 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 187' ' ' VAL . . . . . 0.712 HG13 ' O ' ' A' ' 183' ' ' PRO . 4.1 m -130.53 152.74 37.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.511 1.132 . . . . 0.0 109.329 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 188' ' ' GLU . . . . . 0.572 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.1 OUTLIER -105.01 166.7 10.2 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.581 1.175 . . . . 0.0 110.291 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.19 116.22 28.81 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.541 1.15 . . . . 0.0 109.295 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . 0.479 ' O ' ' C ' ' A' ' 191' ' ' GLY . 7.8 t80 -135.81 73.97 1.49 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.462 1.101 . . . . 0.0 111.005 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 191' ' ' GLY . . . . . 0.479 ' C ' ' O ' ' A' ' 190' ' ' TYR . . . . . . . . 0 CA--C 1.53 0.983 0 O-C-N 124.57 1.169 . . . . 0.0 110.951 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . 0.4 ' C ' ' CD1' ' A' ' 136' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.357 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . 0.528 ' N ' ' CD1' ' A' ' 136' ' ' TYR . 0.1 OUTLIER -149.72 167.13 27.32 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.437 1.086 . . . . 0.0 110.999 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.571 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 18.6 m -142.88 150.87 17.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.52 1.138 . . . . 0.0 109.299 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.548 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 17.2 ttt-85 -105.45 117.33 33.75 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.539 1.149 . . . . 0.0 110.305 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.566 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -82.08 110.59 17.45 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.535 1.147 . . . . 0.0 109.268 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.806 HD22 ' H ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -89.09 19.13 4.4 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.532 1.145 . . . . 0.0 109.302 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.458 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 9.6 m-85 -143.62 164.39 30.53 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.511 1.132 . . . . 0.0 110.926 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.53 155.79 17.1 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.433 1.083 . . . . 0.0 109.285 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.508 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 8.0 t80 -173.78 98.05 0.11 Allowed 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.578 1.174 . . . . 0.0 110.978 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -126.13 118.04 24.39 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.484 1.115 . . . . 0.0 109.304 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 73.68 115.44 0.07 OUTLIER Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.539 1.15 . . . . 0.0 111.031 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -157.25 -67.69 0.1 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.531 0.783 . . . . 0.0 109.323 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -139.67 169.06 18.42 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.446 1.092 . . . . 0.0 109.263 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -86.61 45.27 1.23 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.506 1.129 . . . . 0.0 110.288 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -162.95 -29.93 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.518 1.136 . . . . 0.0 110.363 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.564 ' OD1' ' CZ3' ' A' ' 169' ' ' TRP . 35.6 m-20 -75.42 130.47 39.02 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.507 1.129 . . . . 0.0 109.302 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.881 HD22 ' O ' ' A' ' 172' ' ' ALA . 13.1 tp -83.5 113.58 47.72 Favored Pre-proline 0 C--N 1.325 -0.467 0 O-C-N 124.48 1.112 . . . . 0.0 109.337 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . 0.505 ' HA ' ' O ' ' A' ' 143' ' ' PHE . 18.0 Cg_endo -75.07 159.02 41.59 Favored 'Trans proline' 0 C--N 1.359 1.118 0 O-C-N 124.557 1.82 . . . . 0.0 110.98 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.508 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 0.8 OUTLIER -167.69 -170.78 1.47 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.439 1.087 . . . . 0.0 110.979 -179.921 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -129.2 139.2 51.97 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.491 1.12 . . . . 0.0 109.296 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -46.5 116.93 1.43 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.563 1.165 . . . . 0.0 109.304 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 97.2 39.9 3.88 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.573 1.171 . . . . 0.0 111.041 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . 0.417 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 15.0 t70 -118.46 178.5 4.43 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.457 0.739 . . . . 0.0 109.316 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.502 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 10.5 mt -130.1 145.83 35.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.55 1.156 . . . . 0.0 109.338 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.536 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 0.3 OUTLIER -140.21 140.81 35.93 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.513 1.133 . . . . 0.0 109.251 179.972 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.544 ' HB3' ' HB2' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.94 101.07 13.06 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.533 1.145 . . . . 0.0 110.333 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 1.014 HD12 ' HB2' ' A' ' 172' ' ' ALA . 0.3 OUTLIER -83.03 127.6 39.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.422 1.076 . . . . 0.0 109.325 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 24.3 ptt85 -127.69 -22.91 3.51 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.443 1.089 . . . . 0.0 110.302 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' ASP . . . . . 0.41 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 0.9 OUTLIER -121.51 144.08 48.91 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.552 1.157 . . . . 0.0 109.279 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.577 ' HD3' ' CZ3' ' A' ' 170' ' ' TRP . 57.3 mttt -148.64 69.42 10.24 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.501 1.125 . . . . 0.0 109.299 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.96 -52.06 0.11 Allowed 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.486 1.782 . . . . 0.0 111.057 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' GLU . . . . . 0.462 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.3 mm-40 -80.95 178.23 8.55 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.489 1.118 . . . . 0.0 110.321 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.504 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 8.9 mm-40 -108.25 29.77 7.03 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.488 1.118 . . . . 0.0 110.259 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.504 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 2.1 mt-30 -167.93 -39.71 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.439 1.087 . . . . 0.0 110.311 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' TRP . . . . . 0.564 ' CZ3' ' OD1' ' A' ' 150' ' ' ASP . 78.8 m95 -105.25 106.3 16.74 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' TRP . . . . . 0.761 ' HB2' HD11 ' A' ' 161' ' ' ILE . 51.0 m0 -112.22 162.8 15.08 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.478 1.111 . . . . 0.0 108.006 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.508 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 1.1 t-20 -98.11 115.4 28.18 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.511 1.132 . . . . 0.0 109.326 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . 1.014 ' HB2' HD12 ' A' ' 161' ' ' ILE . . . -134.4 158.11 44.71 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.555 1.159 . . . . 0.0 109.291 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.544 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 1.3 mp0 -94.7 156.57 16.34 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.474 1.109 . . . . 0.0 110.272 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . 0.564 ' N ' HD21 ' A' ' 151' ' ' LEU . 0.5 OUTLIER -90.43 -162.17 0.87 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.522 1.139 . . . . 0.0 109.317 179.992 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.81 10.0 5.57 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.533 1.145 . . . . 0.0 109.992 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -128.08 -5.73 5.54 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.595 1.184 . . . . 0.0 110.274 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.512 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 99.97 -11.15 60.58 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.505 1.128 . . . . 0.0 110.997 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . 0.541 ' O ' HD11 ' A' ' 151' ' ' LEU . 8.5 mttt -53.23 111.79 0.76 Allowed 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.536 0.786 . . . . 0.0 109.327 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 177' ' ' GLY . 0.1 OUTLIER -89.75 127.36 35.94 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.479 1.112 . . . . 0.0 110.314 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.508 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.61 -168.56 18.15 Favored Glycine 0 CA--C 1.529 0.953 0 O-C-N 124.44 1.088 . . . . 0.0 110.967 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 181' ' ' MET . . . . . 0.464 ' O ' ' HA ' ' A' ' 150' ' ' ASP . 0.4 OUTLIER -103.46 126.27 50.51 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.446 0.733 . . . . 0.0 111.02 179.978 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.745 HG23 ' HB3' ' A' ' 151' ' ' LEU . 2.7 pp -130.42 155.68 80.67 Favored Pre-proline 0 C--N 1.324 -0.51 0 O-C-N 124.496 1.122 . . . . 0.0 109.288 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 183' ' ' PRO . . . . . 0.803 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.0 132.68 15.69 Favored 'Trans proline' 0 C--N 1.361 1.186 0 O-C-N 124.428 1.751 . . . . 0.0 110.993 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.855 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 19.6 t -75.26 -29.63 0.89 Allowed Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 124.501 1.126 . . . . 0.0 109.346 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 185' ' ' PRO . . . . . 0.855 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.0 Cg_endo -75.05 -20.09 17.1 Favored 'Trans proline' 0 C--N 1.361 1.19 0 O-C-N 124.469 1.773 . . . . 0.0 110.94 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.803 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 6.7 m-85 -97.94 2.81 49.46 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.487 1.117 . . . . 0.0 110.993 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 187' ' ' VAL . . . . . 0.566 HG12 ' HA ' ' A' ' 139' ' ' ALA . 6.3 m -137.89 155.1 29.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.479 1.112 . . . . 0.0 109.319 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 188' ' ' GLU . . . . . 0.571 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.8 OUTLIER -105.75 144.88 31.87 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.524 1.14 . . . . 0.0 110.275 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . 0.476 ' HA ' HG12 ' A' ' 137' ' ' VAL . 0.1 OUTLIER -86.64 107.89 18.38 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.517 1.136 . . . . 0.0 109.286 179.947 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . 0.41 ' HB3' ' CD2' ' A' ' 136' ' ' TYR . 1.3 t80 -97.81 -59.13 1.83 Allowed 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.539 1.149 . . . . 0.0 110.977 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.96 0 O-C-N 124.434 1.084 . . . . 0.0 111.034 179.973 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . 0.409 ' O ' ' HG3' ' A' ' 160' ' ' ARG . 20.1 p . . . . . 0 N--CA 1.452 -0.343 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . 0.455 ' CE1' ' HB2' ' A' ' 160' ' ' ARG . 2.1 m-85 -151.22 161.43 42.73 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.503 1.127 . . . . 0.0 110.967 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.525 ' O ' ' HA ' ' A' ' 158' ' ' ILE . 31.0 m -143.85 146.33 21.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.579 1.174 . . . . 0.0 109.331 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.48 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 5.4 ttp180 -108.64 112.34 24.63 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.492 1.12 . . . . 0.0 110.308 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.522 ' CB ' HG12 ' A' ' 187' ' ' VAL . . . -80.86 109.14 15.14 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.578 1.174 . . . . 0.0 109.348 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.428 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 3.1 mp -88.49 25.02 1.79 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.474 1.109 . . . . 0.0 109.262 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.405 ' O ' ' N ' ' A' ' 155' ' ' LYS . 20.2 t80 -139.18 168.25 20.26 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.445 1.09 . . . . 0.0 111.046 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -113.59 125.63 54.38 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.488 1.118 . . . . 0.0 109.325 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.66 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 1.9 t80 -160.26 151.25 19.04 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.562 1.164 . . . . 0.0 111.027 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . 0.484 ' HA ' ' HB3' ' A' ' 152' ' ' PRO . 21.7 p30 -138.7 150.01 45.72 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.523 1.139 . . . . 0.0 109.263 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -138.05 -124.14 2.23 Favored Glycine 0 CA--C 1.529 0.919 0 O-C-N 124.516 1.135 . . . . 0.0 111.007 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . 0.411 ' O ' ' CB ' ' A' ' 147' ' ' ASP . 11.7 p-10 -178.42 33.16 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.416 0.715 . . . . 0.0 109.311 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . 0.419 ' O ' ' HB2' ' A' ' 150' ' ' ASP . 0.3 OUTLIER 75.08 -152.01 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.488 1.118 . . . . 0.0 109.375 -179.925 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.581 ' O ' ' CB ' ' A' ' 149' ' ' GLU . 2.2 tp10 51.3 41.2 27.78 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.486 1.116 . . . . 0.0 110.282 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . 0.581 ' CB ' ' O ' ' A' ' 148' ' ' GLU . 1.9 mt-10 92.75 25.22 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.488 1.117 . . . . 0.0 110.327 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.419 ' HB2' ' O ' ' A' ' 147' ' ' ASP . 0.2 OUTLIER -143.31 127.54 17.64 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.527 1.142 . . . . 0.0 109.319 -179.979 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.782 HD12 ' HD2' ' A' ' 152' ' ' PRO . 31.5 tp -122.51 118.18 28.77 Favored Pre-proline 0 C--N 1.325 -0.484 0 O-C-N 124.459 1.099 . . . . 0.0 109.32 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . 0.782 ' HD2' HD12 ' A' ' 151' ' ' LEU . 18.1 Cg_endo -75.05 143.09 28.49 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.467 1.772 . . . . 0.0 110.966 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.66 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 16.7 p90 -157.03 173.16 17.44 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.507 1.129 . . . . 0.0 111.008 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -130.68 137.27 49.48 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.522 1.139 . . . . 0.0 109.33 179.912 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.8 OUTLIER -39.82 108.29 0.08 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.457 1.098 . . . . 0.0 109.298 179.959 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 103.07 33.72 4.21 Favored Glycine 0 CA--C 1.53 1.01 0 O-C-N 124.478 1.111 . . . . 0.0 111.002 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . 0.429 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 15.3 t70 -109.55 168.81 9.12 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.448 0.734 . . . . 0.0 109.296 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.525 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 9.1 mt -126.13 147.06 30.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.525 1.141 . . . . 0.0 109.296 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 1.09 HD13 HG21 ' A' ' 182' ' ' ILE . 4.2 mt -143.5 139.36 29.78 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.556 1.16 . . . . 0.0 109.326 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.518 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.2 OUTLIER -88.44 105.47 17.63 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.475 1.109 . . . . 0.0 110.322 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.868 HG22 ' HB2' ' A' ' 172' ' ' ALA . 1.1 pp -81.9 125.89 39.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.506 1.129 . . . . 0.0 109.252 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -121.67 -21.23 6.23 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.552 1.157 . . . . 0.0 110.273 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -131.84 137.69 48.18 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.528 1.142 . . . . 0.0 109.364 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.479 ' CG ' HD13 ' A' ' 161' ' ' ILE . 0.0 OUTLIER -140.15 72.44 33.08 Favored Pre-proline 0 C--N 1.324 -0.511 0 O-C-N 124.496 1.123 . . . . 0.0 109.251 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.04 -49.33 0.15 Allowed 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.465 1.771 . . . . 0.0 111.045 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' GLU . . . . . 0.469 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 5.9 mm-40 -79.38 174.4 11.61 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.469 1.105 . . . . 0.0 110.35 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.534 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 0.0 OUTLIER -105.57 32.17 4.48 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.491 1.119 . . . . 0.0 110.319 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.534 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 3.7 mt-30 -172.57 -37.47 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.444 1.09 . . . . 0.0 110.284 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' TRP . . . . . 0.461 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 83.1 m95 -107.38 107.52 18.46 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.451 1.094 . . . . 0.0 108.057 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' TRP . . . . . 0.604 ' CD2' HG21 ' A' ' 184' ' ' VAL . 51.3 m0 -113.29 158.98 19.85 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.548 1.155 . . . . 0.0 107.994 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.614 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -94.76 118.43 31.74 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.469 1.106 . . . . 0.0 109.336 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . 0.868 ' HB2' HG22 ' A' ' 161' ' ' ILE . . . -132.53 166.16 22.7 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.533 1.145 . . . . 0.0 109.287 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.696 ' HG2' ' N ' ' A' ' 174' ' ' ASP . 0.0 OUTLIER -98.13 160.04 14.55 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.581 1.176 . . . . 0.0 110.302 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . 0.696 ' N ' ' HG2' ' A' ' 173' ' ' GLU . 38.9 p-10 -97.44 -156.26 0.53 Allowed 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.506 1.129 . . . . 0.0 109.26 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.06 13.78 7.22 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.492 1.12 . . . . 0.0 110.054 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -136.52 -0.81 2.36 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.505 1.128 . . . . 0.0 110.251 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.663 ' HA2' ' HG3' ' A' ' 173' ' ' GLU . . . 99.27 -19.17 55.06 Favored Glycine 0 CA--C 1.529 0.948 0 O-C-N 124.448 1.092 . . . . 0.0 111.015 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . 0.439 ' HB2' ' CG ' ' A' ' 174' ' ' ASP . 0.1 OUTLIER -47.26 111.1 0.36 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.498 0.764 . . . . 0.0 109.313 179.986 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -93.08 126.81 38.36 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.544 1.152 . . . . 0.0 110.368 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.614 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -149.48 -164.6 11.78 Favored Glycine 0 CA--C 1.531 1.089 0 O-C-N 124.514 1.134 . . . . 0.0 110.979 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 181' ' ' MET . . . . . 0.461 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 16.7 tpp -97.4 128.52 44.27 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.562 0.801 . . . . 0.0 111.001 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 1.09 HG21 HD13 ' A' ' 159' ' ' LEU . 1.4 pp -127.51 144.54 51.3 Favored Pre-proline 0 C--N 1.325 -0.483 0 O-C-N 124.452 1.095 . . . . 0.0 109.317 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 183' ' ' PRO . . . . . 0.745 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.05 124.29 8.48 Favored 'Trans proline' 0 C--N 1.36 1.16 0 O-C-N 124.627 1.856 . . . . 0.0 110.933 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.831 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 37.5 t -71.16 -31.31 1.91 Allowed Pre-proline 0 C--N 1.324 -0.5 0 O-C-N 124.54 1.15 . . . . 0.0 109.322 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 185' ' ' PRO . . . . . 0.831 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -75.06 -23.66 13.48 Favored 'Trans proline' 0 C--N 1.36 1.133 0 O-C-N 124.475 1.776 . . . . 0.0 111.0 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.745 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.9 m-85 -98.23 -2.5 39.55 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.517 1.136 . . . . 0.0 111.005 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 187' ' ' VAL . . . . . 0.692 HG22 ' O ' ' A' ' 183' ' ' PRO . 7.2 m -127.54 153.6 36.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 O-C-N 124.482 1.114 . . . . 0.0 109.315 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 188' ' ' GLU . . . . . 0.505 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 6.0 mm-40 -101.11 160.64 14.22 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.604 1.19 . . . . 0.0 110.295 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.58 109.57 20.19 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.516 1.135 . . . . 0.0 109.296 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -94.61 -59.64 1.89 Allowed 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.531 1.144 . . . . 0.0 111.018 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.033 0 O-C-N 124.498 1.124 . . . . 0.0 111.015 -179.996 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . 0.657 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 13.4 p . . . . . 0 N--CA 1.452 -0.346 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . 0.657 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 0.1 OUTLIER -136.4 174.75 10.27 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.422 1.077 . . . . 0.0 110.999 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.985 HG12 ' HA ' ' A' ' 189' ' ' LYS . 21.1 m -138.49 156.91 30.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 O-C-N 124.588 1.18 . . . . 0.0 109.297 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.553 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 13.1 ttp180 -108.35 121.71 45.48 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.476 1.11 . . . . 0.0 110.318 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.516 ' C ' HD13 ' A' ' 140' ' ' LEU . . . -82.51 116.79 22.1 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.427 1.08 . . . . 0.0 109.315 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.661 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -93.33 25.8 3.22 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.477 1.111 . . . . 0.0 109.281 -179.973 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -150.65 163.54 38.26 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.511 1.132 . . . . 0.0 111.015 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.47 128.73 54.76 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.451 1.094 . . . . 0.0 109.332 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.578 ' HB2' ' CZ ' ' A' ' 153' ' ' PHE . 35.9 t80 -145.23 127.23 15.53 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.452 1.095 . . . . 0.0 110.947 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -144.49 96.08 2.81 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.497 1.123 . . . . 0.0 109.349 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -130.03 -135.98 3.96 Favored Glycine 0 CA--C 1.529 0.963 0 O-C-N 124.545 1.153 . . . . 0.0 110.961 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 163.61 90.07 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.512 0.772 . . . . 0.0 109.23 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -103.61 -61.92 1.36 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.476 1.11 . . . . 0.0 109.31 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 174.81 -43.88 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.502 1.126 . . . . 0.0 110.356 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . 0.434 ' O ' ' N ' ' A' ' 181' ' ' MET . 2.1 mp0 -121.43 4.04 10.22 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.535 1.147 . . . . 0.0 110.298 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.31 146.09 31.78 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.51 1.131 . . . . 0.0 109.321 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.792 HD22 ' O ' ' A' ' 172' ' ' ALA . 12.4 tp -117.83 115.54 36.91 Favored Pre-proline 0 C--N 1.325 -0.468 0 O-C-N 124.525 1.14 . . . . 0.0 109.328 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . 0.412 ' O ' ' OD1' ' A' ' 174' ' ' ASP . 18.3 Cg_endo -74.96 165.17 31.91 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.497 1.788 . . . . 0.0 110.949 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.578 ' CZ ' ' HB2' ' A' ' 143' ' ' PHE . 7.7 p90 -170.52 -174.82 1.73 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.493 1.121 . . . . 0.0 110.93 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 157' ' ' ASP . 0.0 OUTLIER -133.67 147.29 51.4 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.493 1.121 . . . . 0.0 109.259 -179.937 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.484 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -51.82 120.01 4.84 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.582 1.176 . . . . 0.0 109.253 179.966 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.475 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 86.08 41.07 7.23 Favored Glycine 0 CA--C 1.53 1.019 0 O-C-N 124.512 1.133 . . . . 0.0 110.979 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . 0.484 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 15.1 t70 -114.06 174.3 6.01 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.512 0.772 . . . . 0.0 109.31 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.768 ' O ' HD23 ' A' ' 159' ' ' LEU . 7.3 mm -121.82 154.85 26.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 O-C-N 124.47 1.106 . . . . 0.0 109.337 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.768 HD23 ' O ' ' A' ' 158' ' ' ILE . 6.2 mt -146.96 137.73 23.79 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.508 1.13 . . . . 0.0 109.302 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.584 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 5.0 ttm180 -87.06 109.02 19.13 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.56 1.162 . . . . 0.0 110.324 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.495 ' CD1' ' HB2' ' A' ' 172' ' ' ALA . 0.5 OUTLIER -79.99 125.38 38.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.563 1.165 . . . . 0.0 109.261 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -118.86 -25.03 6.41 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.516 1.135 . . . . 0.0 110.345 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -147.59 153.68 39.72 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.421 1.076 . . . . 0.0 109.227 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.562 ' HB2' ' CD2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -155.49 68.96 5.29 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.509 1.13 . . . . 0.0 109.268 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.95 -42.08 0.58 Allowed 'Trans proline' 0 C--N 1.359 1.103 0 O-C-N 124.535 1.808 . . . . 0.0 111.02 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' GLU . . . . . 0.491 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 10.7 mp0 -82.3 176.36 9.52 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.489 1.118 . . . . 0.0 110.321 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -114.94 48.98 1.08 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.478 1.112 . . . . 0.0 110.324 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.426 ' NE2' ' HG3' ' A' ' 185' ' ' PRO . 0.0 OUTLIER 171.96 -35.15 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.552 1.158 . . . . 0.0 110.255 -179.919 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' TRP . . . . . 0.514 ' CE3' ' HG2' ' A' ' 181' ' ' MET . 61.2 m95 -116.71 99.7 7.31 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.468 1.105 . . . . 0.0 108.028 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' TRP . . . . . 0.717 ' CE2' HG21 ' A' ' 184' ' ' VAL . 51.0 m0 -105.34 166.42 10.43 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.427 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.6 OUTLIER -103.51 108.85 20.29 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.48 1.112 . . . . 0.0 109.308 179.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . 0.792 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -134.82 166.24 23.42 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.488 1.118 . . . . 0.0 109.295 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.554 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.8 OUTLIER -90.48 155.94 18.55 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.479 1.112 . . . . 0.0 110.32 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . 0.428 ' HA ' HD22 ' A' ' 159' ' ' LEU . 0.2 OUTLIER -88.71 -161.88 0.8 Allowed 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.478 1.111 . . . . 0.0 109.293 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 40.7 t -79.68 8.01 7.4 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.536 1.148 . . . . 0.0 110.023 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -129.37 -4.52 4.86 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.489 1.118 . . . . 0.0 110.346 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.53 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 101.49 -11.64 58.14 Favored Glycine 0 CA--C 1.53 1.019 0 O-C-N 124.508 1.13 . . . . 0.0 111.014 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . 0.601 ' O ' HD11 ' A' ' 151' ' ' LEU . 4.3 mttm -52.58 113.43 1.06 Allowed 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.458 0.74 . . . . 0.0 109.28 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . 0.463 ' CG ' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.72 121.26 28.98 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.509 1.131 . . . . 0.0 110.316 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.562 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -155.15 -164.23 12.85 Favored Glycine 0 CA--C 1.531 1.032 0 O-C-N 124.475 1.11 . . . . 0.0 111.009 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 181' ' ' MET . . . . . 0.514 ' HG2' ' CE3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -96.45 124.32 40.4 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.535 0.785 . . . . 0.0 110.996 -179.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.79 HG22 ' HB3' ' A' ' 151' ' ' LEU . 0.2 OUTLIER -122.09 148.7 52.43 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.56 1.162 . . . . 0.0 109.32 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 183' ' ' PRO . . . . . 0.811 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.3 Cg_endo -75.04 129.38 12.25 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.503 1.791 . . . . 0.0 110.979 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.829 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 79.9 t -75.43 -31.91 1.14 Allowed Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.477 1.11 . . . . 0.0 109.243 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 185' ' ' PRO . . . . . 0.829 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.2 Cg_endo -75.06 -24.77 12.41 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.508 1.794 . . . . 0.0 110.964 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.776 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 5.4 m-85 -98.52 1.67 46.81 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.55 1.156 . . . . 0.0 110.992 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 187' ' ' VAL . . . . . 0.811 HG13 ' O ' ' A' ' 183' ' ' PRO . 2.5 m -135.06 145.82 31.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.438 1.086 . . . . 0.0 109.32 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 188' ' ' GLU . . . . . 0.567 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.5 OUTLIER -104.1 140.63 37.52 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.481 1.113 . . . . 0.0 110.256 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . 0.985 ' HA ' HG12 ' A' ' 137' ' ' VAL . 1.3 tmtm? -86.48 111.31 20.44 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.505 1.128 . . . . 0.0 109.308 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . 0.463 ' HB3' ' CD1' ' A' ' 136' ' ' TYR . 1.3 t80 -98.6 -40.01 8.42 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.474 1.109 . . . . 0.0 111.033 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 191' ' ' GLY . . . . . 0.623 ' O ' ' CE1' ' A' ' 136' ' ' TYR . . . . . . . . 0 CA--C 1.529 0.959 0 O-C-N 124.494 1.121 . . . . 0.0 111.044 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 160' ' ' ARG . 99.3 m . . . . . 0 N--CA 1.453 -0.316 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . 0.494 ' CE1' ' HD2' ' A' ' 160' ' ' ARG . 6.2 m-85 -152.9 167.55 28.73 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.509 1.131 . . . . 0.0 111.021 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.773 HG22 ' O ' ' A' ' 159' ' ' LEU . 16.6 m -142.93 137.26 26.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 O-C-N 124.496 1.122 . . . . 0.0 109.348 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.69 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 9.5 ttm180 -100.78 106.78 18.22 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.523 1.139 . . . . 0.0 110.269 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.779 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -80.36 104.47 10.93 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.486 1.116 . . . . 0.0 109.324 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.613 HD12 ' O ' ' A' ' 138' ' ' ARG . 6.5 mp -90.02 28.86 1.3 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.487 1.117 . . . . 0.0 109.36 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.475 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 34.0 m-85 -144.22 145.21 31.92 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.436 1.085 . . . . 0.0 111.011 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.09 131.62 35.86 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.452 1.095 . . . . 0.0 109.322 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.486 ' O ' ' CB ' ' A' ' 152' ' ' PRO . 2.5 t80 -153.89 95.78 1.9 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.521 1.138 . . . . 0.0 111.005 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -112.91 120.18 40.52 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 0.0 109.36 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . 0.577 ' O ' ' CB ' ' A' ' 146' ' ' ASN . . . -168.73 -130.06 1.15 Allowed Glycine 0 CA--C 1.531 1.038 0 O-C-N 124.557 1.161 . . . . 0.0 110.943 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . 0.577 ' CB ' ' O ' ' A' ' 145' ' ' GLY . 3.1 t-20 149.46 92.36 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.55 0.794 . . . . 0.0 109.241 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . 0.464 ' O ' ' HB2' ' A' ' 148' ' ' GLU . 0.2 OUTLIER -94.45 -75.26 0.51 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.539 1.149 . . . . 0.0 109.256 -179.984 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.518 ' O ' ' HB3' ' A' ' 149' ' ' GLU . 5.8 tp10 178.17 41.15 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.476 1.11 . . . . 0.0 110.258 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . 0.518 ' HB3' ' O ' ' A' ' 148' ' ' GLU . 8.0 pt-20 160.29 -21.96 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.499 1.124 . . . . 0.0 110.312 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -76.57 136.05 39.25 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.563 1.164 . . . . 0.0 109.3 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.785 HD21 ' O ' ' A' ' 178' ' ' LYS . 8.0 tp -106.28 110.49 63.96 Favored Pre-proline 0 C--N 1.324 -0.505 0 O-C-N 124.471 1.107 . . . . 0.0 109.328 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . 0.486 ' CB ' ' O ' ' A' ' 143' ' ' PHE . 18.0 Cg_endo -75.06 169.23 23.05 Favored 'Trans proline' 0 C--N 1.36 1.146 0 O-C-N 124.507 1.793 . . . . 0.0 110.915 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.475 ' CE1' ' O ' ' A' ' 141' ' ' PHE . 0.8 OUTLIER -172.87 -170.82 0.7 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.488 1.118 . . . . 0.0 110.949 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . 0.462 ' O ' ' HG3' ' A' ' 154' ' ' LYS . 0.0 OUTLIER -125.78 140.07 52.99 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.454 1.096 . . . . 0.0 109.296 179.972 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.522 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 1.3 tmmm? -45.85 117.02 1.35 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.507 1.129 . . . . 0.0 109.287 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.454 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 93.33 29.72 9.94 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.523 1.139 . . . . 0.0 110.99 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -100.55 169.36 9.12 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.519 0.776 . . . . 0.0 109.311 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.493 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 9.1 mt -122.24 147.06 26.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.556 1.16 . . . . 0.0 109.31 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.773 ' O ' HG22 ' A' ' 137' ' ' VAL . 0.2 OUTLIER -141.02 136.89 32.54 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.547 1.154 . . . . 0.0 109.316 179.978 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.494 ' HD2' ' CE1' ' A' ' 136' ' ' TYR . 0.2 OUTLIER -88.12 111.02 21.12 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.601 1.188 . . . . 0.0 110.309 179.96 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 1.045 HD12 ' HB2' ' A' ' 172' ' ' ALA . 0.5 OUTLIER -80.48 125.21 39.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.551 1.157 . . . . 0.0 109.36 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -116.74 -26.51 6.95 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.532 1.145 . . . . 0.0 110.3 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' ASP . . . . . 0.465 ' OD2' ' CB ' ' A' ' 171' ' ' ASN . 0.0 OUTLIER -149.11 157.3 43.27 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.461 1.101 . . . . 0.0 109.353 -179.978 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.54 ' HG3' ' CE2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -145.88 92.15 5.46 Favored Pre-proline 0 C--N 1.325 -0.46 0 O-C-N 124.464 1.102 . . . . 0.0 109.278 179.994 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.03 -49.71 0.14 Allowed 'Trans proline' 0 C--N 1.361 1.201 0 O-C-N 124.478 1.778 . . . . 0.0 111.061 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' A' ' 169' ' ' TRP . 12.5 mt-10 -88.92 -177.53 5.5 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.596 1.185 . . . . 0.0 110.306 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -106.52 -9.78 16.49 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.507 1.13 . . . . 0.0 110.315 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -120.29 -27.66 5.19 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.539 1.15 . . . . 0.0 110.29 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' TRP . . . . . 0.474 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 59.7 m95 -121.65 117.75 27.46 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.543 1.152 . . . . 0.0 107.95 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' TRP . . . . . 0.862 ' CE2' HG21 ' A' ' 184' ' ' VAL . 33.9 m0 -114.2 165.08 13.04 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.519 1.137 . . . . 0.0 107.947 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.467 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.4 OUTLIER -100.37 115.2 29.45 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.493 1.121 . . . . 0.0 109.295 -179.98 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . 1.045 ' HB2' HD12 ' A' ' 161' ' ' ILE . . . -136.79 168.44 19.53 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.521 1.138 . . . . 0.0 109.238 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.693 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.8 OUTLIER -97.38 154.57 17.37 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.483 1.114 . . . . 0.0 110.305 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . 0.546 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.1 OUTLIER -88.29 -163.97 1.05 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.551 1.157 . . . . 0.0 109.325 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 23.2 t -77.9 9.46 3.56 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.482 1.114 . . . . 0.0 109.982 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -128.66 -5.66 5.19 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.495 1.122 . . . . 0.0 110.276 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.539 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 99.9 -11.31 60.7 Favored Glycine 0 CA--C 1.53 1.028 0 O-C-N 124.445 1.091 . . . . 0.0 110.94 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . 0.785 ' O ' HD21 ' A' ' 151' ' ' LEU . 0.8 OUTLIER -53.39 112.47 0.9 Allowed 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.505 0.768 . . . . 0.0 109.306 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . 0.45 ' HG2' ' CD ' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -86.59 124.61 33.07 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.499 1.124 . . . . 0.0 110.322 -179.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.705 ' HA3' HD13 ' A' ' 151' ' ' LEU . . . -155.73 -165.44 14.39 Favored Glycine 0 CA--C 1.53 0.971 0 O-C-N 124.473 1.108 . . . . 0.0 111.019 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 181' ' ' MET . . . . . 0.474 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -99.64 131.29 45.73 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.479 0.753 . . . . 0.0 111.003 179.99 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.752 HG21 HD13 ' A' ' 159' ' ' LEU . 2.2 pp -132.62 148.88 71.35 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.466 1.104 . . . . 0.0 109.312 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 183' ' ' PRO . . . . . 0.743 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.3 Cg_endo -75.0 129.71 12.59 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.488 1.783 . . . . 0.0 111.045 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.862 HG21 ' CE2' ' A' ' 170' ' ' TRP . 54.6 t -74.5 -31.53 1.23 Allowed Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.49 1.119 . . . . 0.0 109.319 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 185' ' ' PRO . . . . . 0.834 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.93 -17.43 19.75 Favored 'Trans proline' 0 C--N 1.36 1.172 0 O-C-N 124.509 1.794 . . . . 0.0 111.06 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.743 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 5.2 m-85 -98.33 -12.61 21.33 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.46 1.1 . . . . 0.0 111.019 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 187' ' ' VAL . . . . . 0.779 HG12 ' HA ' ' A' ' 139' ' ' ALA . 2.3 m -126.97 157.01 38.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.503 1.127 . . . . 0.0 109.385 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 188' ' ' GLU . . . . . 0.47 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 3.4 pt-20 -98.13 161.8 13.53 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.44 1.087 . . . . 0.0 110.297 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.07 112.14 22.33 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.51 1.131 . . . . 0.0 109.249 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -122.52 166.16 15.24 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 124.546 1.153 . . . . 0.0 110.998 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.022 0 O-C-N 124.496 1.123 . . . . 0.0 110.971 179.983 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 85.6 m . . . . . 0 N--CA 1.453 -0.317 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . 0.428 ' HA ' ' O ' ' A' ' 159' ' ' LEU . 14.6 m-85 -129.81 177.31 7.35 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.509 1.131 . . . . 0.0 110.963 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.516 HG23 ' N ' ' A' ' 138' ' ' ARG . 1.4 m -149.79 166.77 2.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.402 1.064 . . . . 0.0 109.284 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.516 ' N ' HG23 ' A' ' 137' ' ' VAL . 2.3 ttt-85 -128.15 116.27 19.68 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.463 1.102 . . . . 0.0 110.235 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.496 ' HA ' ' HA ' ' A' ' 187' ' ' VAL . . . -83.87 107.25 16.15 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.528 1.142 . . . . 0.0 109.283 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.515 ' C ' ' HG2' ' A' ' 155' ' ' LYS . 1.1 mp -88.54 26.52 1.45 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.59 1.181 . . . . 0.0 109.356 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.601 ' CD1' ' HA ' ' A' ' 186' ' ' TYR . 84.2 m-85 -153.4 146.61 24.7 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.444 1.09 . . . . 0.0 110.993 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.89 153.79 34.38 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.54 1.15 . . . . 0.0 109.304 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.639 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -165.7 140.85 4.9 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.527 1.142 . . . . 0.0 111.044 179.948 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -131.7 -44.76 0.98 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.472 1.107 . . . . 0.0 109.269 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -166.15 121.9 1.02 Allowed Glycine 0 CA--C 1.53 1.03 0 O-C-N 124.45 1.094 . . . . 0.0 110.976 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . 0.577 ' HB2' ' CZ ' ' A' ' 143' ' ' PHE . 9.3 t30 -116.95 -47.8 2.68 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.474 0.75 . . . . 0.0 109.281 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . 0.515 ' O ' ' CB ' ' A' ' 148' ' ' GLU . 0.7 OUTLIER -113.83 -63.84 1.39 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.458 1.099 . . . . 0.0 109.273 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.515 ' CB ' ' O ' ' A' ' 147' ' ' ASP . 1.2 mt-10 159.81 -25.6 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.471 1.107 . . . . 0.0 110.39 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -112.54 -5.36 14.03 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.531 1.144 . . . . 0.0 110.288 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -65.27 153.45 41.04 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.568 1.167 . . . . 0.0 109.336 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.886 HD22 ' O ' ' A' ' 172' ' ' ALA . 15.5 tp -92.21 112.48 55.34 Favored Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.471 1.107 . . . . 0.0 109.291 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.0 167.26 27.45 Favored 'Trans proline' 0 C--N 1.361 1.189 0 O-C-N 124.529 1.805 . . . . 0.0 111.056 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.639 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 4.7 p90 -178.05 -178.77 0.69 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.525 1.14 . . . . 0.0 110.983 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.47 142.44 47.15 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.492 1.12 . . . . 0.0 109.302 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.515 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -46.0 119.34 2.22 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.504 1.127 . . . . 0.0 109.288 179.962 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.455 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 88.57 40.74 6.27 Favored Glycine 0 CA--C 1.53 0.999 0 O-C-N 124.541 1.151 . . . . 0.0 111.027 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . 0.451 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 37.0 t70 -111.14 167.8 9.99 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.481 0.754 . . . . 0.0 109.297 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.499 ' HA ' ' O ' ' A' ' 137' ' ' VAL . 2.3 mp -116.68 149.93 18.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.505 1.128 . . . . 0.0 109.303 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.654 HD13 ' CG2' ' A' ' 182' ' ' ILE . 1.0 OUTLIER -141.74 146.01 35.5 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.494 1.121 . . . . 0.0 109.276 179.943 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.468 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.9 OUTLIER -93.68 101.77 13.92 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.478 1.111 . . . . 0.0 110.3 179.968 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.555 HD11 ' HB3' ' A' ' 170' ' ' TRP . 9.4 tp -79.23 128.47 38.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.488 1.118 . . . . 0.0 109.343 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.21 -26.18 3.69 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.525 1.14 . . . . 0.0 110.254 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' ASP . . . . . 0.406 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 45.9 m-20 -137.39 140.91 41.67 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.485 1.116 . . . . 0.0 109.295 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.591 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -146.79 69.34 12.11 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.542 1.151 . . . . 0.0 109.378 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . 0.404 ' HG2' ' OE1' ' A' ' 166' ' ' GLU . 18.4 Cg_endo -75.0 -44.08 0.36 Allowed 'Trans proline' 0 C--N 1.359 1.104 0 O-C-N 124.499 1.789 . . . . 0.0 111.037 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 169' ' ' TRP . 6.6 mp0 -81.03 171.02 15.49 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.503 1.127 . . . . 0.0 110.315 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.425 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 12.5 pm0 -112.41 52.39 0.77 Allowed 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.459 1.099 . . . . 0.0 110.261 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.51 ' O ' HG23 ' A' ' 184' ' ' VAL . 0.1 OUTLIER 169.75 -31.68 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.517 1.136 . . . . 0.0 110.316 179.937 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' TRP . . . . . 0.452 ' HB3' ' CG ' ' A' ' 181' ' ' MET . 73.3 m95 -125.52 101.4 6.91 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.562 1.164 . . . . 0.0 107.967 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' TRP . . . . . 0.83 ' CE2' HG21 ' A' ' 184' ' ' VAL . 10.2 m0 -106.86 174.71 5.77 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.534 1.146 . . . . 0.0 107.982 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.46 ' O ' HD12 ' A' ' 161' ' ' ILE . 0.7 OUTLIER -109.06 113.48 26.39 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 124.522 1.139 . . . . 0.0 109.282 -179.998 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . 0.886 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -136.55 164.01 29.19 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.534 1.146 . . . . 0.0 109.373 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.581 ' O ' ' HB3' ' A' ' 159' ' ' LEU . 7.5 mp0 -89.32 153.38 20.92 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.466 1.104 . . . . 0.0 110.345 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . 0.518 ' N ' HD21 ' A' ' 151' ' ' LEU . 0.5 OUTLIER -88.1 -159.74 0.57 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.521 1.138 . . . . 0.0 109.353 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 94.4 p -81.71 9.85 7.12 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.472 1.108 . . . . 0.0 109.995 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -131.11 -5.34 3.89 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.511 1.132 . . . . 0.0 110.239 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.512 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 100.96 -11.16 58.87 Favored Glycine 0 CA--C 1.532 1.094 0 O-C-N 124.547 1.154 . . . . 0.0 110.966 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . 0.534 ' O ' HD11 ' A' ' 151' ' ' LEU . 3.3 mttp -54.5 114.69 1.77 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.511 0.771 . . . . 0.0 109.234 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . 0.54 ' CG ' ' CD ' ' A' ' 173' ' ' GLU . 1.1 mtm180 -86.45 123.86 32.14 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.464 1.102 . . . . 0.0 110.279 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.439 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.91 -169.16 19.2 Favored Glycine 0 CA--C 1.531 1.035 0 O-C-N 124.475 1.109 . . . . 0.0 111.022 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 181' ' ' MET . . . . . 0.452 ' CG ' ' HB3' ' A' ' 169' ' ' TRP . 0.1 OUTLIER -88.24 119.12 28.34 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.519 0.776 . . . . 0.0 111.044 179.971 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.685 HG12 ' HB3' ' A' ' 172' ' ' ALA . 1.6 pp -108.86 133.74 20.58 Favored Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.515 1.135 . . . . 0.0 109.318 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 183' ' ' PRO . . . . . 0.845 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.2 Cg_endo -75.05 126.37 9.9 Favored 'Trans proline' 0 C--N 1.359 1.114 0 O-C-N 124.45 1.763 . . . . 0.0 110.952 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.838 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 60.5 t -71.71 -29.76 1.39 Allowed Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 124.445 1.09 . . . . 0.0 109.238 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 185' ' ' PRO . . . . . 0.838 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -74.99 -29.43 8.25 Favored 'Trans proline' 0 C--N 1.359 1.13 0 O-C-N 124.461 1.769 . . . . 0.0 110.994 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.7 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 5.5 m-85 -100.33 -0.67 37.92 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.531 1.144 . . . . 0.0 110.966 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 187' ' ' VAL . . . . . 0.845 HG13 ' O ' ' A' ' 183' ' ' PRO . 1.4 m -137.11 160.73 36.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.51 1.131 . . . . 0.0 109.327 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 188' ' ' GLU . . . . . 0.465 ' O ' ' HB ' ' A' ' 137' ' ' VAL . 6.9 tp10 -116.76 149.94 39.1 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.538 1.148 . . . . 0.0 110.25 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.43 110.41 19.14 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.463 1.102 . . . . 0.0 109.284 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -124.31 70.83 1.11 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.491 1.119 . . . . 0.0 111.015 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.991 0 O-C-N 124.462 1.101 . . . . 0.0 111.037 -179.999 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . 0.677 ' O ' ' CD1' ' A' ' 136' ' ' TYR . 3.6 p . . . . . 0 N--CA 1.453 -0.322 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . 0.677 ' CD1' ' O ' ' A' ' 135' ' ' CYS . 8.8 m-85 -149.38 179.98 7.52 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.419 1.074 . . . . 0.0 111.045 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.493 HG11 HG13 ' A' ' 161' ' ' ILE . 24.0 m -144.06 143.87 23.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 124.427 1.079 . . . . 0.0 109.307 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.606 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 28.0 ttm-85 -104.26 111.46 24.08 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.476 1.11 . . . . 0.0 110.306 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.759 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -79.63 107.25 12.25 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.526 1.142 . . . . 0.0 109.336 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.46 ' O ' ' HE2' ' A' ' 155' ' ' LYS . 7.4 mp -89.89 29.53 1.18 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.521 1.138 . . . . 0.0 109.278 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.606 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 42.7 m-85 -148.28 151.7 35.87 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.446 1.092 . . . . 0.0 111.011 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -93.82 133.17 37.5 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.558 1.161 . . . . 0.0 109.273 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.621 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 12.0 t80 -161.0 85.03 0.67 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 0.0 111.027 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . 0.418 ' HA ' ' CB ' ' A' ' 152' ' ' PRO . 13.0 p-10 -126.11 92.37 3.57 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.498 1.124 . . . . 0.0 109.312 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 125.96 95.02 0.97 Allowed Glycine 0 CA--C 1.53 1.005 0 O-C-N 124.512 1.133 . . . . 0.0 110.995 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -158.87 -70.94 0.09 Allowed 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.506 0.768 . . . . 0.0 109.345 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -163.28 145.08 9.76 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.585 1.178 . . . . 0.0 109.295 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.58 -13.41 9.22 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.47 1.106 . . . . 0.0 110.285 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -78.19 -24.74 47.02 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.481 1.113 . . . . 0.0 110.292 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -109.73 128.28 55.17 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.496 1.123 . . . . 0.0 109.286 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.96 HD23 HD11 ' A' ' 182' ' ' ILE . 10.5 tp -75.4 116.54 55.68 Favored Pre-proline 0 C--N 1.324 -0.517 0 O-C-N 124.492 1.12 . . . . 0.0 109.32 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . 0.538 ' HA ' ' O ' ' A' ' 143' ' ' PHE . 18.4 Cg_endo -75.01 166.07 29.96 Favored 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.398 1.736 . . . . 0.0 111.018 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.621 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 3.5 p90 -166.18 -177.18 4.01 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.525 1.14 . . . . 0.0 111.015 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . 0.578 ' O ' ' C ' ' A' ' 155' ' ' LYS . 2.0 ttmt -133.82 129.79 37.02 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.476 1.11 . . . . 0.0 109.301 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.578 ' C ' ' O ' ' A' ' 154' ' ' LYS . 12.5 ttmt -25.33 123.37 0.06 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.579 1.174 . . . . 0.0 109.373 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . 74.36 49.94 10.96 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 124.49 1.119 . . . . 0.0 110.988 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . 0.452 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 28.8 t0 -113.41 165.2 12.69 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.516 0.774 . . . . 0.0 109.355 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.571 HD11 ' NH1' ' A' ' 138' ' ' ARG . 1.3 mp -118.36 148.63 21.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.47 1.106 . . . . 0.0 109.298 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.857 HD13 HD13 ' A' ' 182' ' ' ILE . 1.3 mt -147.14 138.78 24.17 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.527 1.142 . . . . 0.0 109.307 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.56 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.8 OUTLIER -87.63 106.2 17.86 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.572 1.17 . . . . 0.0 110.272 -179.95 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.873 ' CD1' ' HB2' ' A' ' 172' ' ' ALA . 2.2 mm -82.98 125.98 40.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.486 1.116 . . . . 0.0 109.268 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 10.5 ttt180 -127.62 -26.21 3.02 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.524 1.14 . . . . 0.0 110.277 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' ASP . . . . . 0.491 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -126.65 140.52 52.35 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.55 1.156 . . . . 0.0 109.344 179.981 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.5 ' HB3' ' CG ' ' A' ' 170' ' ' TRP . 1.7 mtmt -146.32 63.4 8.82 Favored Pre-proline 0 C--N 1.324 -0.502 0 O-C-N 124.487 1.117 . . . . 0.0 109.312 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . 0.43 ' HD3' ' N ' ' A' ' 164' ' ' LYS . 18.5 Cg_endo -74.98 6.96 3.07 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.491 1.785 . . . . 0.0 110.995 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' GLU . . . . . 0.467 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 5.5 mm-40 -135.66 176.04 9.04 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.557 1.16 . . . . 0.0 110.282 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.539 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 4.2 mm-40 -113.73 35.79 3.92 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.539 1.149 . . . . 0.0 110.244 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.539 ' CG ' ' O ' ' A' ' 167' ' ' GLU . 0.4 OUTLIER -174.93 -37.84 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.48 1.112 . . . . 0.0 110.361 179.974 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' TRP . . . . . 0.45 ' O ' ' HB2' ' A' ' 166' ' ' GLU . 76.6 m95 -113.56 104.77 12.59 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 170' ' ' TRP . . . . . 0.698 ' CE2' HG21 ' A' ' 184' ' ' VAL . 38.7 m0 -111.2 159.91 17.45 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.534 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -96.91 114.3 25.91 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.43 1.081 . . . . 0.0 109.296 179.969 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . 1.04 ' HB3' HD12 ' A' ' 182' ' ' ILE . . . -128.64 167.69 16.83 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.506 1.128 . . . . 0.0 109.29 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.529 ' HB2' ' HB3' ' A' ' 160' ' ' ARG . 2.0 mp0 -97.48 157.28 16.09 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.48 1.112 . . . . 0.0 110.38 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . 0.453 ' OD1' ' N ' ' A' ' 177' ' ' GLY . 46.2 p-10 -95.14 -159.92 0.75 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.478 1.111 . . . . 0.0 109.291 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 44.6 t -81.32 12.29 3.71 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.562 1.163 . . . . 0.0 109.97 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -132.31 -3.72 3.44 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.443 1.09 . . . . 0.0 110.346 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.518 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 97.29 -12.25 65.17 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.494 1.122 . . . . 0.0 111.003 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . 0.45 ' N ' ' OD1' ' A' ' 174' ' ' ASP . 0.1 OUTLIER -54.78 115.17 2.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.492 0.76 . . . . 0.0 109.306 -179.965 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . 0.435 ' HG2' ' CD ' ' A' ' 173' ' ' GLU . 0.3 OUTLIER -88.72 127.78 35.6 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.487 1.117 . . . . 0.0 110.286 -179.973 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.534 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -153.48 -171.77 21.0 Favored Glycine 0 CA--C 1.529 0.946 0 O-C-N 124.441 1.088 . . . . 0.0 111.019 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.4 135.34 33.53 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.492 0.76 . . . . 0.0 111.039 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 1.04 HD12 ' HB3' ' A' ' 172' ' ' ALA . 30.4 mt -134.09 137.67 28.77 Favored Pre-proline 0 C--N 1.325 -0.466 0 O-C-N 124.422 1.076 . . . . 0.0 109.315 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 183' ' ' PRO . . . . . 0.73 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.1 Cg_endo -75.03 121.87 6.84 Favored 'Trans proline' 0 C--N 1.36 1.152 0 O-C-N 124.508 1.794 . . . . 0.0 111.027 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.84 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 24.6 t -69.5 -29.32 1.75 Allowed Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.536 1.147 . . . . 0.0 109.26 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 185' ' ' PRO . . . . . 0.84 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -74.98 -23.68 13.6 Favored 'Trans proline' 0 C--N 1.359 1.09 0 O-C-N 124.538 1.81 . . . . 0.0 111.012 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.73 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.6 m-85 -99.42 -3.12 34.46 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.521 1.138 . . . . 0.0 111.0 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 187' ' ' VAL . . . . . 0.759 HG12 ' HA ' ' A' ' 139' ' ' ALA . 5.2 m -130.34 162.41 38.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.542 1.151 . . . . 0.0 109.265 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 188' ' ' GLU . . . . . 0.484 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 1.0 OUTLIER -110.67 158.2 18.87 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.583 1.177 . . . . 0.0 110.286 179.993 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.55 110.09 21.4 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.505 1.128 . . . . 0.0 109.274 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . 0.411 ' O ' ' HB2' ' A' ' 136' ' ' TYR . 41.3 t80 -161.48 126.02 3.44 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.491 1.119 . . . . 0.0 111.061 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 191' ' ' GLY . . . . . 0.575 ' HA3' ' CD2' ' A' ' 136' ' ' TYR . . . . . . . . 0 CA--C 1.531 1.037 0 O-C-N 124.567 1.167 . . . . 0.0 110.958 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . 0.43 ' O ' ' CD1' ' A' ' 136' ' ' TYR . 8.9 t . . . . . 0 N--CA 1.453 -0.296 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . 0.43 ' CD1' ' O ' ' A' ' 135' ' ' CYS . 36.3 m-85 -150.99 164.0 37.41 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.405 1.066 . . . . 0.0 111.062 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.754 HG12 ' HA ' ' A' ' 189' ' ' LYS . 15.4 m -138.61 165.72 24.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.573 1.171 . . . . 0.0 109.332 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.598 ' HA ' HD13 ' A' ' 158' ' ' ILE . 16.1 ttp180 -124.04 112.93 17.74 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.475 1.109 . . . . 0.0 110.321 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.554 ' O ' ' N ' ' A' ' 156' ' ' GLY . . . -83.36 103.93 13.12 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.498 1.123 . . . . 0.0 109.305 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.407 ' O ' ' HG3' ' A' ' 155' ' ' LYS . 0.7 OUTLIER -88.87 27.82 1.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.449 1.093 . . . . 0.0 109.41 179.93 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.456 ' CD1' ' HA ' ' A' ' 186' ' ' TYR . 58.1 m-85 -147.86 151.3 35.69 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.497 1.123 . . . . 0.0 110.98 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -88.9 126.21 35.28 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.536 1.148 . . . . 0.0 109.317 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.626 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 3.0 t80 -130.3 145.12 51.73 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.445 1.09 . . . . 0.0 111.007 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . 0.515 ' O ' ' HB3' ' A' ' 152' ' ' PRO . 11.9 t-20 -114.11 -35.0 5.18 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.5 1.125 . . . . 0.0 109.264 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . 0.424 ' HA2' ' CG ' ' A' ' 150' ' ' ASP . . . 142.59 141.45 3.88 Favored Glycine 0 CA--C 1.53 1.025 0 O-C-N 124.522 1.139 . . . . 0.0 110.963 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . 0.459 ' CG ' ' N ' ' A' ' 147' ' ' ASP . 12.2 p-10 -128.29 -47.41 1.32 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.486 0.756 . . . . 0.0 109.215 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . 0.561 ' H ' ' HB3' ' A' ' 150' ' ' ASP . 7.7 p-10 -108.03 169.21 8.76 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.643 1.214 . . . . 0.0 109.351 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 54.8 tt0 -63.39 -40.54 97.49 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.478 1.111 . . . . 0.0 110.331 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . 0.424 ' C ' ' OD2' ' A' ' 147' ' ' ASP . 38.1 mt-10 -94.82 23.56 5.39 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.47 1.107 . . . . 0.0 110.312 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.561 ' HB3' ' H ' ' A' ' 147' ' ' ASP . 0.6 OUTLIER -74.77 159.59 31.79 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.527 1.142 . . . . 0.0 109.353 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.753 HD23 ' CG2' ' A' ' 182' ' ' ILE . 15.8 tp -125.03 108.57 27.8 Favored Pre-proline 0 C--N 1.325 -0.48 0 O-C-N 124.491 1.12 . . . . 0.0 109.31 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . 0.515 ' HB3' ' O ' ' A' ' 144' ' ' ASN . 18.3 Cg_endo -75.03 162.34 37.22 Favored 'Trans proline' 0 C--N 1.36 1.168 0 O-C-N 124.465 1.771 . . . . 0.0 110.984 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.626 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 17.9 p90 -178.69 177.32 0.89 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.478 1.111 . . . . 0.0 111.01 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.57 140.7 49.48 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.512 1.132 . . . . 0.0 109.311 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 140' ' ' LEU . 0.1 OUTLIER -45.28 131.01 8.18 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.527 1.142 . . . . 0.0 109.313 179.887 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 85.85 22.71 48.63 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 124.441 1.088 . . . . 0.0 111.002 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . 0.407 ' O ' HD13 ' A' ' 158' ' ' ILE . 30.9 t70 -99.07 167.9 10.42 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.504 0.767 . . . . 0.0 109.269 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.598 HD13 ' HA ' ' A' ' 138' ' ' ARG . 51.5 mm -120.72 146.89 24.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.567 1.167 . . . . 0.0 109.306 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.632 HD13 ' CG2' ' A' ' 182' ' ' ILE . 0.9 OUTLIER -136.92 138.45 40.66 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.432 1.082 . . . . 0.0 109.347 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.42 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 5.0 mtm180 -87.67 96.41 10.42 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.513 1.133 . . . . 0.0 110.311 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.853 HD11 ' HD2' ' A' ' 164' ' ' LYS . 0.0 OUTLIER -84.44 125.85 40.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.431 1.082 . . . . 0.0 109.296 -179.951 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . 0.453 ' CG ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -119.04 -21.76 7.54 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.58 1.175 . . . . 0.0 110.322 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' ASP . . . . . 0.634 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -136.6 149.87 48.26 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.472 1.107 . . . . 0.0 109.307 -179.993 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.853 ' HD2' HD11 ' A' ' 161' ' ' ILE . 0.0 OUTLIER -155.48 74.17 5.35 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.488 1.118 . . . . 0.0 109.312 179.981 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 -38.34 1.64 Allowed 'Trans proline' 0 C--N 1.359 1.108 0 O-C-N 124.51 1.795 . . . . 0.0 111.086 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' GLU . . . . . 0.446 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 1.5 mm-40 -85.69 171.49 11.59 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.545 1.153 . . . . 0.0 110.271 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -110.49 50.42 0.81 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.589 1.181 . . . . 0.0 110.336 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 170.66 -32.19 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.435 1.085 . . . . 0.0 110.259 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -120.65 100.54 7.18 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.514 1.133 . . . . 0.0 107.974 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 170' ' ' TRP . . . . . 0.686 ' CE2' HG21 ' A' ' 184' ' ' VAL . 40.8 m0 -105.8 164.26 12.07 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.492 1.12 . . . . 0.0 107.991 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.449 ' HB3' ' OD1' ' A' ' 163' ' ' ASP . 1.6 m-20 -98.91 114.08 26.52 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.441 1.088 . . . . 0.0 109.343 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . 0.654 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -139.0 166.31 24.83 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.466 1.103 . . . . 0.0 109.288 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.558 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 2.1 mp0 -95.8 157.45 15.89 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.493 1.121 . . . . 0.0 110.369 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . 0.517 ' OD1' ' CD2' ' A' ' 159' ' ' LEU . 0.1 OUTLIER -89.84 -163.46 1.01 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.515 1.135 . . . . 0.0 109.32 -179.993 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 60.8 p -80.31 9.65 5.53 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.489 1.118 . . . . 0.0 110.024 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -131.08 -4.92 3.91 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.522 1.139 . . . . 0.0 110.31 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.509 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 103.14 -11.45 55.39 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 124.53 1.144 . . . . 0.0 111.008 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . 0.627 ' O ' HD11 ' A' ' 151' ' ' LEU . 2.6 mttt -52.51 111.7 0.69 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.483 0.755 . . . . 0.0 109.286 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 179' ' ' ARG . 0.1 OUTLIER -88.79 123.51 33.26 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.451 1.094 . . . . 0.0 110.291 -179.981 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.446 ' N ' HD13 ' A' ' 151' ' ' LEU . . . -155.57 -161.8 10.88 Favored Glycine 0 CA--C 1.531 1.034 0 O-C-N 124.535 1.147 . . . . 0.0 110.991 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 1.9 mmt -93.73 116.11 28.58 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.506 0.768 . . . . 0.0 110.956 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.884 HD13 HG21 ' A' ' 187' ' ' VAL . 2.2 pp -103.48 132.28 21.24 Favored Pre-proline 0 C--N 1.324 -0.518 0 O-C-N 124.551 1.157 . . . . 0.0 109.259 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 183' ' ' PRO . . . . . 0.834 ' O ' HG13 ' A' ' 187' ' ' VAL . 18.6 Cg_endo -74.99 123.39 7.85 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.521 1.801 . . . . 0.0 111.025 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.838 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 69.7 t -71.36 -30.57 1.65 Allowed Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.464 1.102 . . . . 0.0 109.261 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 185' ' ' PRO . . . . . 0.838 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.3 Cg_endo -74.99 -28.22 9.36 Favored 'Trans proline' 0 C--N 1.36 1.143 0 O-C-N 124.547 1.814 . . . . 0.0 110.988 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.618 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.8 m-85 -99.47 -5.07 30.01 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.47 1.106 . . . . 0.0 110.921 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 187' ' ' VAL . . . . . 0.884 HG21 HD13 ' A' ' 182' ' ' ILE . 1.5 m -132.13 162.96 38.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.492 1.12 . . . . 0.0 109.269 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 188' ' ' GLU . . . . . 0.471 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 3.8 tt0 -111.82 147.97 34.59 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.5 1.125 . . . . 0.0 110.32 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . 0.754 ' HA ' HG12 ' A' ' 137' ' ' VAL . 3.4 ptpp? -88.23 103.15 15.52 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.533 1.145 . . . . 0.0 109.284 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . 0.421 ' HB3' ' O ' ' A' ' 136' ' ' TYR . 20.7 t80 -88.54 -31.17 18.81 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.568 1.167 . . . . 0.0 110.96 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.962 0 O-C-N 124.474 1.109 . . . . 0.0 110.982 -179.984 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . 0.637 ' SG ' ' CD2' ' A' ' 136' ' ' TYR . 20.4 p . . . . . 0 N--CA 1.452 -0.364 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . 0.637 ' CD2' ' SG ' ' A' ' 135' ' ' CYS . 27.1 m-85 -149.8 157.32 43.09 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.561 1.163 . . . . 0.0 111.0 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.595 ' HA ' ' O ' ' A' ' 188' ' ' GLU . 21.9 m -136.65 137.59 47.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.568 1.168 . . . . 0.0 109.234 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.59 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 7.1 ttt180 -101.51 111.01 23.12 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.444 1.09 . . . . 0.0 110.285 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.599 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -80.55 110.77 16.34 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.453 1.096 . . . . 0.0 109.349 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.663 ' H ' HD13 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -88.23 19.01 3.94 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.526 1.141 . . . . 0.0 109.296 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -141.7 172.2 13.01 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.541 1.15 . . . . 0.0 110.979 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -109.93 156.08 20.9 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.492 1.12 . . . . 0.0 109.283 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.585 ' CB ' ' CZ ' ' A' ' 153' ' ' PHE . 65.3 t80 -175.3 104.42 0.08 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.572 1.17 . . . . 0.0 110.985 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 16.9 p-10 -129.01 87.7 2.6 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.523 1.139 . . . . 0.0 109.318 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -131.04 -131.5 3.29 Favored Glycine 0 CA--C 1.531 1.042 0 O-C-N 124.509 1.131 . . . . 0.0 110.99 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 164.99 88.71 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.514 0.773 . . . . 0.0 109.343 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.2 -60.73 1.82 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.412 1.07 . . . . 0.0 109.353 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 177.87 -43.39 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.486 1.116 . . . . 0.0 110.286 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 181' ' ' MET . 54.9 mt-10 -130.14 13.2 5.66 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.469 1.105 . . . . 0.0 110.309 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.18 155.72 24.81 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.478 1.111 . . . . 0.0 109.353 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.578 HD22 ' O ' ' A' ' 172' ' ' ALA . 24.8 tp -119.75 115.46 33.59 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.425 1.078 . . . . 0.0 109.316 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . 0.462 ' HA ' ' O ' ' A' ' 143' ' ' PHE . 18.3 Cg_endo -75.02 157.84 42.47 Favored 'Trans proline' 0 C--N 1.359 1.122 0 O-C-N 124.527 1.804 . . . . 0.0 110.952 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.585 ' CZ ' ' CB ' ' A' ' 143' ' ' PHE . 25.8 p90 -166.43 -175.53 3.26 Favored 'General case' 0 C--N 1.327 -0.412 0 O-C-N 124.449 1.093 . . . . 0.0 110.95 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . 0.52 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.0 OUTLIER -138.55 132.3 30.91 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.574 1.171 . . . . 0.0 109.326 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.52 ' C ' ' O ' ' A' ' 154' ' ' LYS . 5.8 ttmt -31.15 130.76 0.11 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.526 1.141 . . . . 0.0 109.252 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' A' ' 139' ' ' ALA . . . 72.85 42.24 46.43 Favored Glycine 0 CA--C 1.53 1.005 0 O-C-N 124.496 1.123 . . . . 0.0 111.033 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . 0.716 ' C ' HD12 ' A' ' 158' ' ' ILE . 15.5 t70 -111.21 167.49 10.24 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.502 0.766 . . . . 0.0 109.305 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.716 HD12 ' C ' ' A' ' 157' ' ' ASP . 1.8 mp -122.81 146.16 28.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 O-C-N 124.499 1.124 . . . . 0.0 109.23 -179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.651 ' CD1' HD13 ' A' ' 182' ' ' ILE . 0.6 OUTLIER -142.07 138.69 31.92 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.481 1.113 . . . . 0.0 109.323 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.464 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.3 OUTLIER -91.49 105.07 17.49 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.522 1.139 . . . . 0.0 110.281 -179.976 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.808 HD11 ' HG2' ' A' ' 164' ' ' LYS . 0.0 OUTLIER -85.79 126.48 40.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.469 1.105 . . . . 0.0 109.324 179.983 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.08 -25.92 6.08 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.52 1.137 . . . . 0.0 110.327 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' ASP . . . . . 0.605 ' N ' ' OD1' ' A' ' 163' ' ' ASP . 0.0 OUTLIER -137.23 157.4 46.74 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.532 1.145 . . . . 0.0 109.28 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.808 ' HG2' HD11 ' A' ' 161' ' ' ILE . 5.5 mttt -142.66 78.82 15.67 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.526 1.141 . . . . 0.0 109.268 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.06 10.1 1.84 Allowed 'Trans proline' 0 C--N 1.36 1.141 0 O-C-N 124.528 1.804 . . . . 0.0 110.984 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' GLU . . . . . 0.402 ' H ' ' C ' ' A' ' 164' ' ' LYS . 26.1 mt-10 -151.06 174.39 13.23 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.545 1.153 . . . . 0.0 110.261 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -99.07 7.98 45.38 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.505 1.128 . . . . 0.0 110.287 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.508 ' O ' ' N ' ' A' ' 184' ' ' VAL . 57.5 mt-30 -147.99 -45.11 0.16 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.582 1.176 . . . . 0.0 110.34 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -98.45 96.89 8.31 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 170' ' ' TRP . . . . . 0.975 ' CE2' HG21 ' A' ' 184' ' ' VAL . 31.5 m0 -102.06 154.82 18.62 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.521 1.138 . . . . 0.0 107.964 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.448 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -88.2 111.13 21.29 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.463 1.102 . . . . 0.0 109.325 179.933 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . 0.578 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -134.92 166.65 22.52 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.487 1.117 . . . . 0.0 109.251 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.57 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.6 OUTLIER -96.31 155.48 16.75 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.554 1.159 . . . . 0.0 110.291 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . 0.492 ' HA ' HD23 ' A' ' 159' ' ' LEU . 0.7 OUTLIER -94.57 -162.08 0.91 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.442 1.089 . . . . 0.0 109.263 -179.984 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 38.1 m -79.33 7.23 8.21 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.476 1.11 . . . . 0.0 109.978 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . 0.418 ' HB2' ' HG2' ' A' ' 178' ' ' LYS . 2.6 mt-10 -125.72 -4.92 7.02 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.548 1.155 . . . . 0.0 110.291 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.508 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 96.7 -12.0 66.22 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.5 1.125 . . . . 0.0 111.032 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . 0.481 ' O ' HD11 ' A' ' 151' ' ' LEU . 0.1 OUTLIER -57.48 114.9 2.43 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.467 0.745 . . . . 0.0 109.29 -179.954 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . 0.452 ' HG3' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -88.94 127.34 35.65 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.52 1.137 . . . . 0.0 110.307 -179.992 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.448 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -153.42 -169.74 18.81 Favored Glycine 0 CA--C 1.53 0.998 0 O-C-N 124.422 1.077 . . . . 0.0 111.001 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 181' ' ' MET . . . . . 0.45 ' N ' ' O ' ' A' ' 149' ' ' GLU . 1.9 mmt -93.55 116.38 28.89 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 124.47 0.747 . . . . 0.0 111.04 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.651 HD13 ' CD1' ' A' ' 159' ' ' LEU . 1.3 tp -117.12 141.37 28.37 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.492 1.12 . . . . 0.0 109.255 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 183' ' ' PRO . . . . . 0.755 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.07 128.92 11.81 Favored 'Trans proline' 0 C--N 1.361 1.186 0 O-C-N 124.492 1.786 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.975 HG21 ' CE2' ' A' ' 170' ' ' TRP . 10.4 t -72.75 -28.8 1.06 Allowed Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.472 1.108 . . . . 0.0 109.277 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 185' ' ' PRO . . . . . 0.854 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.4 Cg_endo -75.02 -17.56 19.39 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.473 1.775 . . . . 0.0 110.989 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.755 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 9.9 m-85 -100.78 -6.63 24.63 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.524 1.14 . . . . 0.0 111.021 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 187' ' ' VAL . . . . . 0.599 HG12 ' HA ' ' A' ' 139' ' ' ALA . 2.6 m -133.98 157.68 42.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.568 1.168 . . . . 0.0 109.292 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 188' ' ' GLU . . . . . 0.595 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 1.3 tm-20 -98.78 152.62 19.49 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.508 1.13 . . . . 0.0 110.293 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 9.3 mtmm -88.99 106.82 18.68 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.573 1.17 . . . . 0.0 109.273 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -90.91 -38.2 13.05 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.52 1.137 . . . . 0.0 111.05 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 191' ' ' GLY . . . . . 0.489 ' O ' ' SG ' ' A' ' 135' ' ' CYS . . . . . . . . 0 CA--C 1.53 0.997 0 O-C-N 124.548 1.155 . . . . 0.0 111.04 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.452 -0.334 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . 0.425 ' HA ' ' O ' ' A' ' 159' ' ' LEU . 89.0 m-85 -138.54 178.73 6.93 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.448 1.093 . . . . 0.0 111.015 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.659 HG23 HD12 ' A' ' 159' ' ' LEU . 33.5 m -145.33 139.1 21.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.571 1.169 . . . . 0.0 109.271 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.644 ' O ' ' HA ' ' A' ' 187' ' ' VAL . 12.2 ttm180 -101.35 114.84 29.2 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.442 1.089 . . . . 0.0 110.285 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.49 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -82.86 109.72 17.24 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.476 1.11 . . . . 0.0 109.279 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.804 HD22 ' H ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -89.92 23.97 2.58 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.511 1.132 . . . . 0.0 109.28 179.995 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.42 ' CA ' ' HG2' ' A' ' 155' ' ' LYS . 39.8 m-85 -143.82 155.47 44.14 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.48 1.113 . . . . 0.0 111.002 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.31 126.48 40.65 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.545 1.153 . . . . 0.0 109.339 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.578 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.6 OUTLIER -137.98 123.1 19.19 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.485 1.115 . . . . 0.0 110.981 -179.944 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . 0.503 ' C ' ' HB3' ' A' ' 152' ' ' PRO . 3.0 m-20 -86.23 -42.49 13.74 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.522 1.139 . . . . 0.0 109.35 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 126.31 138.22 4.8 Favored Glycine 0 CA--C 1.529 0.91 0 O-C-N 124.481 1.113 . . . . 0.0 111.056 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -114.05 -34.62 5.33 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.427 0.722 . . . . 0.0 109.311 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -136.59 165.57 25.56 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.48 1.113 . . . . 0.0 109.329 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -83.02 37.66 0.55 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.497 1.123 . . . . 0.0 110.24 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -133.68 -27.1 1.53 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.511 1.132 . . . . 0.0 110.267 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.58 122.31 38.19 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.508 1.13 . . . . 0.0 109.3 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.801 ' HB3' HG23 ' A' ' 182' ' ' ILE . 7.7 tp -76.05 114.27 35.72 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 124.532 1.145 . . . . 0.0 109.345 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . 0.503 ' HB3' ' C ' ' A' ' 144' ' ' ASN . 18.3 Cg_endo -74.99 -178.18 3.98 Favored 'Trans proline' 0 C--N 1.359 1.089 0 O-C-N 124.551 1.816 . . . . 0.0 111.012 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.578 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 1.6 p90 173.19 -177.89 0.07 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.53 1.144 . . . . 0.0 111.024 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . 0.416 ' O ' ' C ' ' A' ' 155' ' ' LYS . 0.4 OUTLIER -119.93 138.45 53.44 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.515 1.134 . . . . 0.0 109.301 179.98 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.515 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.1 OUTLIER -39.06 123.94 1.39 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.469 1.106 . . . . 0.0 109.291 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.478 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 83.98 38.61 10.11 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.522 1.139 . . . . 0.0 110.999 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . 0.425 ' O ' ' HA ' ' A' ' 138' ' ' ARG . 17.0 t70 -108.52 169.04 8.9 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.521 0.777 . . . . 0.0 109.301 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.49 ' C ' ' HG ' ' A' ' 159' ' ' LEU . 8.4 mm -122.22 149.41 25.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 O-C-N 124.472 1.107 . . . . 0.0 109.346 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.778 HD13 HG21 ' A' ' 182' ' ' ILE . 0.2 OUTLIER -143.78 141.21 30.31 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.543 1.152 . . . . 0.0 109.314 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.535 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 0.1 OUTLIER -86.66 96.73 10.23 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.456 1.098 . . . . 0.0 110.278 -179.97 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.86 HD11 ' HB2' ' A' ' 170' ' ' TRP . 0.2 OUTLIER -82.71 125.61 39.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.41 1.069 . . . . 0.0 109.281 179.995 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -124.39 -22.06 4.78 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.476 1.11 . . . . 0.0 110.306 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' ASP . . . . . 0.481 ' C ' ' HG3' ' A' ' 164' ' ' LYS . 71.2 m-20 -125.46 125.31 43.12 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.52 1.137 . . . . 0.0 109.365 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.602 ' HE3' HG21 ' A' ' 161' ' ' ILE . 2.2 mtpt -136.47 63.08 46.53 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.559 1.162 . . . . 0.0 109.277 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . 0.442 ' HD3' ' N ' ' A' ' 164' ' ' LYS . 18.2 Cg_endo -75.03 -50.89 0.12 Allowed 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.508 1.794 . . . . 0.0 110.967 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' GLU . . . . . 0.511 ' O ' ' NE1' ' A' ' 170' ' ' TRP . 0.6 OUTLIER -73.2 177.32 5.17 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.49 1.119 . . . . 0.0 110.359 179.979 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -117.81 47.57 1.53 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.566 1.166 . . . . 0.0 110.292 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.453 ' NE2' ' HG3' ' A' ' 185' ' ' PRO . 0.0 OUTLIER 174.87 -32.56 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.491 1.119 . . . . 0.0 110.3 -179.976 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 169' ' ' TRP . . . . . 0.579 ' CE3' ' HG2' ' A' ' 181' ' ' MET . 70.0 m95 -119.1 104.92 10.9 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.493 1.121 . . . . 0.0 108.01 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 170' ' ' TRP . . . . . 0.86 ' HB2' HD11 ' A' ' 161' ' ' ILE . 53.9 m0 -110.63 154.56 23.62 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.504 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.9 OUTLIER -95.26 117.86 31.01 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.434 1.084 . . . . 0.0 109.326 179.918 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . 0.794 ' O ' HD22 ' A' ' 151' ' ' LEU . . . -141.03 161.42 37.9 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.476 1.11 . . . . 0.0 109.28 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.613 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 0.8 OUTLIER -90.54 155.63 18.75 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.45 1.094 . . . . 0.0 110.326 -179.966 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . 0.651 ' N ' HD21 ' A' ' 151' ' ' LEU . 0.4 OUTLIER -90.08 -161.41 0.79 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.449 1.093 . . . . 0.0 109.308 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 5.6 t -81.21 12.7 3.3 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.507 1.129 . . . . 0.0 109.994 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -132.23 -6.26 3.41 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.567 1.167 . . . . 0.0 110.318 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.521 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 101.62 -12.98 58.15 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.476 1.11 . . . . 0.0 111.007 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . 0.588 ' O ' HD11 ' A' ' 151' ' ' LEU . 2.7 mtmt -52.75 113.28 1.03 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.545 0.791 . . . . 0.0 109.322 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . 0.466 ' CG ' ' HG3' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -89.24 125.02 34.91 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 124.531 1.145 . . . . 0.0 110.327 -179.979 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.504 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -154.42 -165.96 14.5 Favored Glycine 0 CA--C 1.53 1.021 0 O-C-N 124.529 1.143 . . . . 0.0 110.954 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 181' ' ' MET . . . . . 0.579 ' HG2' ' CE3' ' A' ' 169' ' ' TRP . 0.0 OUTLIER -101.88 125.85 48.64 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.529 0.782 . . . . 0.0 111.004 179.976 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.843 HD12 ' O ' ' A' ' 182' ' ' ILE . 2.2 pp -121.89 149.3 53.34 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.54 1.15 . . . . 0.0 109.292 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 183' ' ' PRO . . . . . 0.894 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -74.95 125.87 9.63 Favored 'Trans proline' 0 C--N 1.359 1.124 0 O-C-N 124.591 1.837 . . . . 0.0 110.966 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.852 ' N ' ' CD ' ' A' ' 185' ' ' PRO . 55.4 t -68.98 -29.43 1.91 Allowed Pre-proline 0 C--N 1.326 -0.436 0 O-C-N 124.492 1.12 . . . . 0.0 109.265 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 185' ' ' PRO . . . . . 0.852 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.1 Cg_endo -75.04 -24.28 12.9 Favored 'Trans proline' 0 C--N 1.359 1.079 0 O-C-N 124.542 1.812 . . . . 0.0 110.995 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.894 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 4.0 m-85 -99.58 -0.18 40.97 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.525 1.141 . . . . 0.0 110.965 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 187' ' ' VAL . . . . . 0.65 HG22 ' O ' ' A' ' 183' ' ' PRO . 4.2 m -134.03 154.96 38.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 O-C-N 124.464 1.102 . . . . 0.0 109.313 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 188' ' ' GLU . . . . . 0.539 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 0.2 OUTLIER -106.11 159.53 16.01 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 0.0 110.275 -179.991 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.69 110.72 21.21 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 124.509 1.13 . . . . 0.0 109.32 180.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -83.32 -56.89 3.51 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.505 1.128 . . . . 0.0 110.995 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.011 0 O-C-N 124.497 1.123 . . . . 0.0 110.98 -179.988 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 10.4 p . . . . . 0 N--CA 1.453 -0.319 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . 0.427 ' HB2' ' O ' ' A' ' 191' ' ' GLY . 43.0 m-85 -155.88 165.52 36.22 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.515 1.135 . . . . 0.0 111.013 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 159' ' ' LEU . 19.8 m -142.86 147.02 21.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.58 1.175 . . . . 0.0 109.27 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.719 ' O ' HD13 ' A' ' 140' ' ' LEU . 0.1 OUTLIER -103.08 111.55 23.96 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.523 1.139 . . . . 0.0 110.285 -179.981 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.57 ' HA ' HG12 ' A' ' 187' ' ' VAL . . . -82.12 104.39 12.42 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.501 1.126 . . . . 0.0 109.336 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.719 HD13 ' O ' ' A' ' 138' ' ' ARG . 0.0 OUTLIER -88.74 24.27 2.07 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.564 1.165 . . . . 0.0 109.33 -179.998 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.497 ' O ' ' CE1' ' A' ' 153' ' ' PHE . 9.6 m-85 -146.93 145.86 29.93 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.485 1.116 . . . . 0.0 110.989 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.6 152.26 22.75 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.57 1.169 . . . . 0.0 109.285 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.57 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 0.3 OUTLIER -168.48 126.56 1.1 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.434 1.084 . . . . 0.0 110.959 179.956 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . 0.459 ' HA ' ' CB ' ' A' ' 152' ' ' PRO . 15.1 t-20 -142.01 87.0 2.01 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.394 1.059 . . . . 0.0 109.307 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . 104.22 121.72 4.97 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.495 1.122 . . . . 0.0 111.026 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . 0.482 ' HB2' ' CE1' ' A' ' 143' ' ' PHE . 17.5 t-20 -146.35 -62.32 0.31 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.494 0.761 . . . . 0.0 109.326 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -144.77 -175.88 4.85 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.526 1.141 . . . . 0.0 109.338 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -87.05 35.56 0.7 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.433 1.083 . . . . 0.0 110.348 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -176.39 32.78 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.485 1.116 . . . . 0.0 110.283 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.601 ' OD2' ' CZ3' ' A' ' 169' ' ' TRP . 3.2 t70 -117.3 139.87 50.27 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.521 1.138 . . . . 0.0 109.326 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.841 ' O ' HG22 ' A' ' 182' ' ' ILE . 8.8 tp -100.55 107.34 48.03 Favored Pre-proline 0 C--N 1.325 -0.483 0 O-C-N 124.455 1.097 . . . . 0.0 109.258 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . 0.459 ' CB ' ' HA ' ' A' ' 144' ' ' ASN . 18.2 Cg_endo -75.08 179.03 6.51 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.491 1.785 . . . . 0.0 111.035 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.57 ' CE1' ' HB2' ' A' ' 143' ' ' PHE . 0.4 OUTLIER -177.58 -171.81 0.33 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.43 1.081 . . . . 0.0 111.033 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.82 139.96 53.44 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.545 1.153 . . . . 0.0 109.287 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.494 ' HG2' ' C ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -44.26 115.53 0.86 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.543 1.152 . . . . 0.0 109.312 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.443 ' N ' ' HD2' ' A' ' 155' ' ' LYS . . . 93.35 43.73 3.93 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 124.605 1.191 . . . . 0.0 111.025 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -115.53 170.94 8.05 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.458 0.74 . . . . 0.0 109.295 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.529 HD13 ' HA ' ' A' ' 138' ' ' ARG . 48.8 mm -120.66 144.99 27.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.529 1.143 . . . . 0.0 109.376 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.648 ' HA ' ' O ' ' A' ' 173' ' ' GLU . 0.5 OUTLIER -140.88 133.74 29.03 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.497 1.123 . . . . 0.0 109.286 -179.91 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.481 ' O ' ' HA ' ' A' ' 172' ' ' ALA . 8.5 ttp85 -89.83 106.85 18.75 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.484 1.115 . . . . 0.0 110.298 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.711 ' C ' HD12 ' A' ' 161' ' ' ILE . 0.5 OUTLIER -83.42 127.8 39.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 124.468 1.105 . . . . 0.0 109.259 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.47 -20.59 6.01 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 124.498 1.124 . . . . 0.0 110.275 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' ASP . . . . . 0.447 ' O ' ' HB3' ' A' ' 170' ' ' TRP . 3.7 m-20 -135.63 148.76 49.11 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.517 1.135 . . . . 0.0 109.343 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.569 ' HG3' ' CE2' ' A' ' 170' ' ' TRP . 0.0 OUTLIER -145.68 76.36 12.92 Favored Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.36 1.038 . . . . 0.0 109.334 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -74.89 -46.95 0.22 Allowed 'Trans proline' 0 C--N 1.36 1.183 0 O-C-N 124.504 1.792 . . . . 0.0 111.049 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -91.17 173.87 7.7 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.416 1.072 . . . . 0.0 110.278 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.458 ' O ' ' CG ' ' A' ' 168' ' ' GLN . 1.6 mm-40 -104.04 36.43 2.35 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.453 1.096 . . . . 0.0 110.358 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 184' ' ' VAL . 3.3 mt-30 -173.09 -39.06 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.58 1.175 . . . . 0.0 110.312 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 169' ' ' TRP . . . . . 0.601 ' CZ3' ' OD2' ' A' ' 150' ' ' ASP . 85.6 m95 -109.66 98.6 7.92 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.527 1.142 . . . . 0.0 107.994 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 170' ' ' TRP . . . . . 0.986 ' CE2' HG21 ' A' ' 184' ' ' VAL . 20.7 m0 -105.01 160.04 15.34 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.5 1.125 . . . . 0.0 108.041 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.57 ' HA ' ' O ' ' A' ' 180' ' ' GLY . 0.7 OUTLIER -92.02 112.16 23.99 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.53 1.144 . . . . 0.0 109.283 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . 0.635 ' HB2' HG22 ' A' ' 161' ' ' ILE . . . -135.0 164.17 28.23 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.575 1.172 . . . . 0.0 109.283 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.648 ' O ' ' HA ' ' A' ' 159' ' ' LEU . 18.6 mp0 -95.02 157.87 15.71 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.481 1.113 . . . . 0.0 110.229 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 174' ' ' ASP . . . . . 0.808 ' CG ' HD11 ' A' ' 151' ' ' LEU . 0.4 OUTLIER -90.21 -158.89 0.56 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.564 1.165 . . . . 0.0 109.295 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 175' ' ' SER . . . . . . . . . . . . . 24.6 m -83.34 10.67 8.1 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.539 1.15 . . . . 0.0 109.958 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 176' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -133.61 -5.23 2.89 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.553 1.158 . . . . 0.0 110.294 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . 0.527 ' O ' ' CG ' ' A' ' 173' ' ' GLU . . . 106.58 -17.59 39.29 Favored Glycine 0 CA--C 1.53 1.031 0 O-C-N 124.502 1.126 . . . . 0.0 110.983 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . 0.514 ' O ' HD22 ' A' ' 151' ' ' LEU . 0.6 OUTLIER -42.87 109.43 0.14 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.495 0.762 . . . . 0.0 109.336 179.956 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . 0.472 ' HG2' ' OE2' ' A' ' 173' ' ' GLU . 0.0 OUTLIER -91.3 123.19 34.55 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.494 1.121 . . . . 0.0 110.278 -179.986 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.57 ' O ' ' HA ' ' A' ' 171' ' ' ASN . . . -157.25 -162.89 11.93 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.5 1.125 . . . . 0.0 110.998 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 181' ' ' MET . . . . . . . . . . . . . 41.5 mtp -104.78 120.75 42.12 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.446 0.733 . . . . 0.0 110.999 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.841 HG22 ' O ' ' A' ' 151' ' ' LEU . 2.5 pp -120.88 150.89 53.93 Favored Pre-proline 0 C--N 1.325 -0.47 0 O-C-N 124.489 1.118 . . . . 0.0 109.369 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 183' ' ' PRO . . . . . 0.775 ' HG2' ' HB2' ' A' ' 186' ' ' TYR . 18.2 Cg_endo -75.02 131.27 14.07 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.451 1.764 . . . . 0.0 110.995 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.986 HG21 ' CE2' ' A' ' 170' ' ' TRP . 53.9 t -74.43 -28.98 0.9 Allowed Pre-proline 0 C--N 1.324 -0.521 0 O-C-N 124.509 1.131 . . . . 0.0 109.272 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 185' ' ' PRO . . . . . 0.868 ' CD ' ' N ' ' A' ' 184' ' ' VAL . 18.2 Cg_endo -74.99 -19.25 18.05 Favored 'Trans proline' 0 C--N 1.361 1.191 0 O-C-N 124.442 1.759 . . . . 0.0 111.026 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.775 ' HB2' ' HG2' ' A' ' 183' ' ' PRO . 8.5 m-85 -98.57 -1.36 41.22 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.532 1.145 . . . . 0.0 110.997 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 187' ' ' VAL . . . . . 0.57 HG12 ' HA ' ' A' ' 139' ' ' ALA . 7.5 m -134.68 156.37 39.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 124.534 1.146 . . . . 0.0 109.26 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 188' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 1.5 pp20? -108.55 168.12 9.55 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.489 1.118 . . . . 0.0 110.274 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . 0.417 ' O ' ' OE2' ' A' ' 188' ' ' GLU . 0.1 OUTLIER -86.75 116.09 24.62 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.555 1.159 . . . . 0.0 109.244 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 190' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -108.2 -34.43 6.84 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.486 1.116 . . . . 0.0 110.987 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 191' ' ' GLY . . . . . 0.427 ' O ' ' HB2' ' A' ' 136' ' ' TYR . . . . . . . . 0 CA--C 1.529 0.96 0 O-C-N 124.567 1.167 . . . . 0.0 110.99 179.983 . . . . . . . . 1 1 . 1 stop_ save_