data_2m1w_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 2m1w _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.3 p . . . . . 0 N--CA 1.453 -0.305 0 N-CA-C 109.239 -0.652 . . . . 73.32 109.239 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.41 ' O ' ' CD2' ' A' ' 78' ' ' PHE . 52.1 p90 -89.23 34.63 0.8 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.547 1.154 . . . . 72.24 110.981 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.442 HD21 ' N ' ' A' ' 81' ' ' PHE . 4.4 tt -39.99 150.9 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.54 1.15 . . . . 74.33 109.322 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.446 ' CD ' ' O ' ' A' ' 107' ' ' LYS . 5.0 mtpt -72.2 -60.68 2.11 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.544 1.153 . . . . 74.31 109.257 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.597 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.1 OUTLIER -167.22 152.15 7.23 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.491 1.12 . . . . 73.23 111.011 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.466 HG12 ' CB ' ' A' ' 128' ' ' ALA . 4.5 p -100.86 163.39 3.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.487 1.117 . . . . 74.54 109.307 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.464 ' CG2' ' HB ' ' A' ' 136' ' ' ILE . 5.3 mp -125.63 98.6 5.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.515 1.134 . . . . 72.11 109.316 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.402 ' O ' ' O ' ' A' ' 136' ' ' ILE . 4.8 mt -73.11 115.59 12.61 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.52 1.137 . . . . 74.23 109.304 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.574 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -138.87 174.48 10.48 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.535 1.147 . . . . 75.23 109.596 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -109.52 164.04 12.88 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.461 1.101 . . . . 61.42 109.248 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 87' ' ' GLU . 15.9 tt0 -67.53 -9.57 43.7 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.555 1.159 . . . . 74.11 110.343 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -84.02 -44.96 13.61 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.431 1.082 . . . . 65.3 109.254 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -120.85 43.67 2.71 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.473 1.108 . . . . 71.43 109.299 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.574 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -77.08 -22.6 52.58 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.478 1.111 . . . . 70.2 110.383 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -82.06 -28.08 32.61 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.568 1.168 . . . . 74.34 109.357 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -71.14 -56.32 6.34 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.494 1.121 . . . . 72.24 110.303 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.477 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -56.04 -33.83 65.33 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.499 1.124 . . . . 73.34 109.306 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.406 HD12 ' N ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -74.05 -45.63 48.32 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.491 1.12 . . . . 74.4 109.364 179.945 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.406 ' N ' HD12 ' A' ' 94' ' ' LEU . 10.3 tpt180 -48.29 -29.76 4.17 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.52 1.137 . . . . 74.1 110.308 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.452 ' O ' ' N ' ' A' ' 98' ' ' ASN . 2.2 t -81.87 -65.41 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.477 1.111 . . . . 60.4 109.339 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.441 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -40.11 -27.23 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.547 1.154 . . . . 72.44 110.379 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.452 ' N ' ' O ' ' A' ' 96' ' ' VAL . 1.3 t-20 -71.35 -53.06 15.45 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.483 1.114 . . . . 75.31 109.362 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.514 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -70.72 -21.73 62.51 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.539 1.149 . . . . 74.24 109.279 179.947 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.462 ' CD2' HG12 ' A' ' 206' ' ' VAL . 22.8 mt -63.72 -51.32 65.51 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.483 1.114 . . . . 74.51 109.261 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -81.24 51.74 1.67 Allowed 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.494 1.122 . . . . 72.14 110.254 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -171.06 -66.28 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.492 1.12 . . . . 73.13 109.314 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -47.93 -47.88 32.16 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.417 1.073 . . . . 71.32 109.249 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.638 ' CE2' ' CG1' ' A' ' 206' ' ' VAL . 1.1 m-85 -115.94 -30.17 6.13 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.445 1.09 . . . . 65.15 110.982 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.67 45.18 2.75 Favored Glycine 0 CA--C 1.53 1.024 0 O-C-N 124.442 1.089 . . . . 72.25 111.029 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 9.8 mm -85.47 78.69 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.578 0.81 . . . . 73.14 109.311 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.505 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -124.16 156.02 67.03 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.519 1.137 . . . . 75.41 109.259 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.505 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.98 156.64 99.9 Favored 'Cis proline' 0 C--N 1.36 1.167 0 C-N-CA 120.945 -2.523 . . . . 74.21 111.023 -0.123 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -133.27 124.21 3.65 Favored Glycine 0 CA--C 1.531 1.047 0 O-C-N 124.452 1.095 . . . . 74.01 110.992 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 1.7 tt -142.32 149.57 19.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.492 0.76 . . . . 74.34 109.314 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . 0.42 ' HB ' ' NE2' ' A' ' 85' ' ' HIS . 33.6 pt -99.61 163.49 2.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.472 1.107 . . . . 74.23 109.299 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -63.31 -19.09 64.29 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.508 1.13 . . . . 71.4 110.981 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -89.53 -8.13 53.44 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.519 1.137 . . . . 74.2 109.284 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -107.04 -20.09 13.42 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.571 1.169 . . . . 73.14 110.256 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.444 ' CE ' HG23 ' A' ' 82' ' ' VAL . 20.9 ttm -60.21 110.83 3.18 Favored Pre-proline 0 C--N 1.325 -0.5 0 O-C-N 124.441 1.088 . . . . 74.24 110.973 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 C--N 1.36 1.167 0 O-C-N 124.471 1.774 . . . . 64.35 111.03 179.988 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.2 pp . . . . . 0 N--CA 1.454 -0.273 0 N-CA-C 109.268 -0.641 . . . . 74.5 109.268 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.403 ' O ' ' N ' ' A' ' 129' ' ' VAL . 6.1 p-10 -74.5 -41.2 61.1 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.521 1.138 . . . . 72.55 109.267 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -47.05 -48.41 22.36 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.439 1.087 . . . . 73.11 109.265 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.466 ' CB ' HG12 ' A' ' 82' ' ' VAL . . . -59.56 -34.48 72.74 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.484 1.115 . . . . 74.01 109.332 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.499 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 68.8 t -92.84 30.8 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 O-C-N 124.507 1.129 . . . . 72.43 109.279 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -133.0 139.27 47.16 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.473 1.108 . . . . 74.34 109.286 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . 0.501 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 37.87 76.7 0.07 OUTLIER Glycine 0 CA--C 1.53 1.03 0 O-C-N 124.537 1.148 . . . . 71.51 110.982 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' SER . . . . . 0.4 ' O ' ' O ' ' A' ' 167' ' ' TYR . 0.6 OUTLIER -163.64 -175.46 4.17 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.499 0.764 . . . . 64.1 109.98 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . 0.55 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -110.46 -41.36 4.37 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.566 1.166 . . . . 73.22 109.292 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.575 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 0.4 OUTLIER -154.54 165.86 35.12 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 107.969 -1.123 . . . . 74.41 107.969 -179.967 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' THR . . . . . 0.405 ' CG2' ' O ' ' A' ' 128' ' ' ALA . 3.2 p -133.35 129.21 37.16 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.542 1.151 . . . . 74.32 110.399 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.464 ' HB ' ' CG2' ' A' ' 83' ' ' ILE . 11.4 mm -84.56 121.87 37.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.506 1.129 . . . . 75.55 109.288 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 6.7 mt -108.29 87.81 2.58 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.479 1.112 . . . . 75.33 109.311 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.554 ' O ' ' CD1' ' A' ' 143' ' ' PHE . 3.5 tp -62.27 88.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.5 1.125 . . . . 74.23 109.268 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.459 ' CD1' HG22 ' A' ' 185' ' ' THR . 19.3 mt -61.48 113.7 2.82 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.441 1.088 . . . . 73.35 109.343 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' THR . . . . . 0.456 ' HB ' ' CB ' ' A' ' 143' ' ' PHE . 5.7 m -140.32 154.4 46.77 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.525 1.14 . . . . 63.3 110.412 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 11.2 mp0 -47.34 -39.95 16.11 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.478 1.111 . . . . 73.14 110.332 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . 0.412 ' ND2' ' N ' ' A' ' 143' ' ' PHE . 2.4 p-10 -89.89 -53.6 4.42 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.53 1.144 . . . . 74.21 109.294 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.554 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 37.3 t80 -48.95 -21.49 0.67 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.486 1.116 . . . . 74.11 111.038 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.511 ' O ' ' CB ' ' A' ' 148' ' ' TRP . 3.0 tm? -78.49 -67.64 0.72 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.547 1.154 . . . . 74.23 109.303 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.461 ' N ' ' CD ' ' A' ' 145' ' ' ARG . 0.1 OUTLIER -55.52 -17.48 5.44 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.457 1.098 . . . . 73.52 110.362 179.934 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -70.19 -73.15 0.17 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.5 1.125 . . . . 72.4 109.297 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.468 ' O ' ' N ' ' A' ' 150' ' ' ASN . 0.9 OUTLIER -72.61 -48.11 42.38 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.503 1.127 . . . . 61.22 110.443 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.541 ' CE3' ' CD2' ' A' ' 151' ' ' PHE . 15.5 t-105 -44.39 -40.26 5.28 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.49 1.118 . . . . 74.54 108.001 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' CYS . . . . . 0.451 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 15.9 t -66.28 -45.74 79.41 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.483 1.114 . . . . 73.33 108.274 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' ASN . . . . . 0.468 ' N ' ' O ' ' A' ' 147' ' ' THR . 0.6 OUTLIER -54.07 -53.92 46.54 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.47 1.106 . . . . 65.34 109.291 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.625 ' CE1' ' CD1' ' A' ' 157' ' ' LEU . 9.8 m-30 -38.2 -60.26 0.79 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.502 1.126 . . . . 71.21 111.029 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -45.75 -38.54 7.13 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.474 1.109 . . . . 72.51 110.291 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.45 ' N ' ' O ' ' A' ' 150' ' ' ASN . 51.8 t80 -82.26 -23.91 35.05 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.435 1.084 . . . . 71.43 110.989 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.546 ' CZ ' ' OG ' ' A' ' 156' ' ' SER . 1.2 t80 -144.57 107.45 4.48 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.472 1.107 . . . . 74.21 110.949 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.1 t -73.18 -6.26 44.68 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.444 1.09 . . . . 64.11 110.431 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' SER . . . . . 0.546 ' OG ' ' CZ ' ' A' ' 154' ' ' TYR . 22.0 m -51.29 -52.55 44.15 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.434 1.083 . . . . 72.04 110.01 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.625 ' CD1' ' CE1' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -66.96 -40.26 87.45 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.49 1.119 . . . . 74.24 109.244 -179.96 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' MET . . . . . 0.562 ' HE1' ' CD2' ' A' ' 151' ' ' PHE . 2.1 mmt -53.24 -19.55 3.27 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.418 1.074 . . . . 72.2 110.994 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' ASN . . . . . 0.47 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 87.5 m-20 -75.18 -42.23 56.32 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.474 1.108 . . . . 74.23 109.326 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' SER . . . . . 0.506 ' O ' ' CG2' ' A' ' 170' ' ' VAL . 0.3 OUTLIER -64.54 -13.47 52.76 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.51 1.131 . . . . 75.32 110.023 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . 0.423 HG21 ' CE ' ' A' ' 158' ' ' MET . 89.0 t -74.85 -15.96 16.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.508 1.13 . . . . 74.34 109.311 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.14 2.83 19.5 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.506 1.129 . . . . 74.13 109.286 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.452 ' HD3' ' CG2' ' A' ' 192' ' ' ILE . 14.8 mmm-85 60.37 64.97 1.13 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.42 1.075 . . . . 73.31 110.29 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . 0.505 ' NE2' ' N ' ' A' ' 164' ' ' GLN . 0.9 OUTLIER -65.68 129.15 38.75 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.478 1.112 . . . . 73.24 110.271 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' HIS . . . . . 0.417 ' O ' ' O ' ' A' ' 166' ' ' LYS . 13.3 m-70 -74.03 -3.91 32.17 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.507 1.129 . . . . 74.21 109.624 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . 0.417 ' O ' ' O ' ' A' ' 165' ' ' HIS . 5.6 mptt -49.64 178.79 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.501 1.125 . . . . 72.42 109.334 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 167' ' ' TYR . . . . . 0.593 ' CE2' ' OD1' ' A' ' 168' ' ' ASN . 29.6 p90 -48.22 -47.66 35.52 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.452 1.095 . . . . 72.33 111.014 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . 0.593 ' OD1' ' CE2' ' A' ' 167' ' ' TYR . 3.2 p-10 -89.5 146.23 24.76 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.468 1.105 . . . . 70.41 109.345 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 169' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 8.3 t -128.11 169.02 14.56 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.505 1.128 . . . . 72.53 109.991 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.506 ' CG2' ' O ' ' A' ' 160' ' ' SER . 12.7 t -123.0 111.59 30.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 O-C-N 124.463 1.102 . . . . 53.44 109.336 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.7 mp -126.32 97.24 34.72 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.538 1.149 . . . . 75.32 109.269 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . 0.503 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.3 Cg_endo -75.0 106.92 2.37 Favored 'Trans proline' 0 C--N 1.36 1.141 0 O-C-N 124.507 1.793 . . . . 65.42 110.986 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 5.9 ttt -78.54 156.36 29.26 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.485 1.116 . . . . 73.32 110.997 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . 0.479 ' NH2' ' NH2' ' A' ' 182' ' ' ARG . 59.5 mtt85 -110.13 124.32 33.75 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.545 1.153 . . . . 73.51 110.327 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.95 156.11 43.21 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.505 1.792 . . . . 73.31 111.008 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . 0.468 ' CD1' ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -104.17 -47.0 4.28 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.478 1.111 . . . . 75.32 109.248 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -72.77 -21.46 61.0 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.496 1.123 . . . . 72.23 109.314 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 178' ' ' ASN . . . . . 0.428 ' ND2' ' CG2' ' A' ' 140' ' ' THR . 5.5 t-20 -107.0 109.11 62.93 Favored Pre-proline 0 C--N 1.324 -0.528 0 O-C-N 124.576 1.173 . . . . 74.55 109.265 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.06 115.34 4.25 Favored 'Trans proline' 0 C--N 1.359 1.11 0 O-C-N 124.518 1.799 . . . . 71.03 111.007 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . 0.42 HD21 ' CB ' ' A' ' 184' ' ' ARG . 0.6 OUTLIER -138.02 96.9 10.08 Favored Pre-proline 0 C--N 1.326 -0.453 0 O-C-N 124.491 1.119 . . . . 74.31 109.237 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.97 166.97 28.09 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.461 1.769 . . . . 74.23 110.969 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . 0.479 ' NH2' ' NH2' ' A' ' 174' ' ' ARG . 0.1 OUTLIER -56.98 -31.41 65.01 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.579 1.174 . . . . 74.12 110.34 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -57.15 -17.0 9.09 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.473 1.108 . . . . 70.53 110.317 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 184' ' ' ARG . . . . . 0.42 ' CB ' HD21 ' A' ' 180' ' ' LEU . 23.3 mmt85 -109.24 -14.18 14.52 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.49 1.119 . . . . 74.43 110.299 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 185' ' ' THR . . . . . 0.459 HG22 ' CD1' ' A' ' 139' ' ' LEU . 86.3 m -89.94 143.19 29.64 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.487 1.117 . . . . 73.21 110.395 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 186' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 185' ' ' THR . 18.5 Cg_endo -74.95 144.54 30.57 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.52 1.8 . . . . 74.45 110.989 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 187' ' ' PHE . . . . . 0.468 ' O ' ' CG2' ' A' ' 191' ' ' THR . 22.5 p90 -60.84 -13.0 12.69 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.411 1.069 . . . . 74.11 110.981 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . 0.407 ' O ' ' CD1' ' A' ' 192' ' ' ILE . . . -86.25 -54.6 4.35 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.553 1.158 . . . . 74.13 109.26 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 20.2 mt -74.14 -15.46 61.03 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.448 1.092 . . . . 74.21 109.299 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -84.75 -23.56 29.2 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.468 1.105 . . . . 72.12 110.248 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 191' ' ' THR . . . . . 0.468 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 39.8 p -101.9 21.19 15.06 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 124.571 1.169 . . . . 73.34 110.403 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.452 ' CG2' ' HD3' ' A' ' 163' ' ' ARG . 19.9 mt -124.64 154.69 32.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.492 1.12 . . . . 74.31 109.248 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -63.76 98.04 0.18 Allowed 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.517 1.136 . . . . 73.53 109.375 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . 0.503 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -92.39 151.77 20.08 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.585 1.178 . . . . 71.41 109.323 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 195' ' ' LEU . . . . . 0.467 HD21 ' CD1' ' A' ' 209' ' ' ILE . 0.3 OUTLIER -86.8 147.56 25.77 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.495 1.122 . . . . 72.44 109.316 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -143.77 141.02 30.22 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.478 1.111 . . . . 71.44 110.321 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . 0.514 ' HA ' ' CG ' ' A' ' 202' ' ' PHE . 2.1 pt-20 -113.19 -17.47 12.35 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.494 1.121 . . . . 71.41 110.296 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . 0.45 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -92.32 2.58 56.55 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 124.472 1.107 . . . . 73.53 110.363 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 36.3 t -99.16 165.32 11.77 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.499 1.124 . . . . 74.21 109.959 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 14.8 mtm180 -75.85 -27.48 57.85 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.525 1.141 . . . . 74.44 110.35 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -95.86 20.28 50.6 Favored Glycine 0 CA--C 1.528 0.892 0 O-C-N 124.537 1.148 . . . . 74.35 111.029 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 202' ' ' PHE . . . . . 0.627 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 0.1 OUTLIER -58.21 -43.22 98.1 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.45 0.736 . . . . 72.22 110.932 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 203' ' ' PRO . . . . . 0.627 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.5 Cg_endo -74.98 -30.32 7.32 Favored 'Trans proline' 0 C--N 1.359 1.108 0 O-C-N 124.529 1.805 . . . . 75.14 110.984 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.04 -65.56 0.67 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.53 1.144 . . . . 71.34 110.352 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -52.05 -39.4 59.58 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.481 1.113 . . . . 74.14 110.28 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 206' ' ' VAL . . . . . 0.638 ' CG1' ' CE2' ' A' ' 104' ' ' PHE . 47.3 t -60.84 -28.3 42.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.557 1.161 . . . . 62.22 109.308 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -83.06 -50.32 8.63 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.474 1.109 . . . . 70.31 110.241 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -61.18 -64.07 1.08 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.466 1.104 . . . . 70.44 110.261 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 209' ' ' ILE . . . . . 0.578 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 44.9 mt -47.07 -56.44 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 124.501 1.126 . . . . 72.34 109.263 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 210' ' ' PHE . . . . . 0.578 ' CE1' ' CG2' ' A' ' 209' ' ' ILE . 2.4 m-85 -101.2 67.58 1.18 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.598 1.186 . . . . 74.33 110.962 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.7 145.33 38.19 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.485 1.115 . . . . 72.22 110.311 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' A' ' 215' ' ' TYR . 34.0 tt0 -49.45 -55.07 14.45 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.511 1.132 . . . . 75.42 110.326 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.94 -23.83 0.88 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.463 1.102 . . . . 65.32 109.918 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 20.0 t -95.66 -30.56 4.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 O-C-N 124.527 1.142 . . . . 74.44 109.322 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 215' ' ' TYR . . . . . 0.455 ' N ' ' O ' ' A' ' 212' ' ' GLU . 6.6 t80 -62.12 -25.11 67.55 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.467 1.104 . . . . 75.33 110.965 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . 0.413 ' O ' ' N ' ' A' ' 219' ' ' GLN . 3.9 mmtp -73.73 -61.65 1.77 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.504 1.128 . . . . 74.31 109.303 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 71.4 m -46.93 -48.54 21.39 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.487 1.117 . . . . 72.51 110.383 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -64.54 -25.08 67.83 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.469 1.106 . . . . 75.32 110.284 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 219' ' ' GLN . . . . . 0.446 ' O ' ' NE2' ' A' ' 219' ' ' GLN . 31.6 tp60 -83.64 -28.85 28.14 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.494 1.121 . . . . 74.13 110.256 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 220' ' ' THR . . . . . 0.457 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 3.0 m -85.11 -28.35 25.64 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.568 1.167 . . . . 75.34 110.426 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 221' ' ' ILE . . . . . 0.419 HG21 ' N ' ' A' ' 167' ' ' TYR . 46.2 mt -76.54 -32.76 21.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.473 1.108 . . . . 74.51 109.28 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 222' ' ' TRP . . . . . 0.501 ' CD1' ' HA2' ' A' ' 131' ' ' GLY . 18.2 t90 -74.29 -58.33 3.37 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.523 1.139 . . . . 61.55 107.989 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . 0.457 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -51.26 -22.63 2.84 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.551 1.157 . . . . 75.41 109.325 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 . . . . . 0 C--N 1.325 -0.47 0 O-C-N 124.528 1.142 . . . . 72.11 110.3 179.986 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.412 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.4 p . . . . . 0 N--CA 1.453 -0.282 0 N-CA-C 109.285 -0.635 . . . . 73.42 109.285 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.532 ' O ' ' CD2' ' A' ' 78' ' ' PHE . 10.1 p90 -89.61 28.27 1.34 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.55 1.157 . . . . 74.24 110.977 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.415 ' C ' ' O ' ' A' ' 78' ' ' PHE . 4.3 tp -39.52 140.59 0.46 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.537 1.148 . . . . 74.05 109.268 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.488 ' CD ' ' O ' ' A' ' 107' ' ' LYS . 3.2 mtpt -75.99 -64.25 1.13 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.495 1.122 . . . . 72.11 109.26 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.603 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.1 OUTLIER -161.54 149.33 15.03 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.457 1.098 . . . . 74.33 111.001 -179.959 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.534 ' CG1' ' CG2' ' A' ' 135' ' ' THR . 7.7 p -97.81 169.62 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 O-C-N 124.441 1.088 . . . . 75.32 109.292 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.454 HD13 ' CE1' ' A' ' 81' ' ' PHE . 5.0 mp -132.63 92.2 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.49 1.119 . . . . 74.42 109.267 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.518 HD22 ' CG ' ' A' ' 112' ' ' PHE . 8.2 mt -70.17 117.81 12.2 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.49 1.119 . . . . 74.01 109.28 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.593 ' CE1' ' OG1' ' A' ' 90' ' ' THR . 0.0 OUTLIER -140.35 174.6 10.35 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.513 1.133 . . . . 70.12 109.583 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -102.78 164.36 11.68 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.52 1.138 . . . . 64.13 109.235 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.453 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 21.9 tt0 -69.78 -6.78 34.48 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.586 1.179 . . . . 74.25 110.262 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -89.9 -46.07 8.8 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.435 1.085 . . . . 73.34 109.252 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -114.57 44.12 1.79 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.409 1.068 . . . . 72.21 109.28 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.593 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -78.85 -22.99 45.26 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.512 1.132 . . . . 73.04 110.432 179.948 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -82.51 -30.2 29.97 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.459 1.099 . . . . 72.53 109.356 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.411 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -70.22 -57.54 4.78 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.478 1.111 . . . . 75.21 110.226 -179.958 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.534 ' CB ' ' CD2' ' A' ' 138' ' ' LEU . . . -55.19 -35.24 64.62 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.508 1.13 . . . . 73.22 109.298 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.4 -44.32 62.65 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.526 1.141 . . . . 71.21 109.335 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 15.2 tpp180 -48.3 -29.49 3.93 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.479 1.112 . . . . 73.41 110.303 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.458 ' C ' ' N ' ' A' ' 98' ' ' ASN . 2.1 t -81.02 -64.62 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.497 1.123 . . . . 73.41 109.282 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.429 ' HG3' ' N ' ' A' ' 98' ' ' ASN . 0.0 OUTLIER -41.04 -26.21 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.512 1.132 . . . . 72.52 110.309 -179.968 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.458 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.1 t-20 -72.4 -58.09 3.67 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.449 1.093 . . . . 74.43 109.333 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.518 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -64.92 -22.28 66.97 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.503 1.127 . . . . 73.21 109.265 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.425 ' N ' HD21 ' A' ' 99' ' ' LEU . 22.2 mt -62.99 -57.3 11.18 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.481 1.113 . . . . 72.35 109.301 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.46 58.44 1.01 Allowed 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.47 1.106 . . . . 62.25 110.318 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -178.66 -62.99 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.496 1.123 . . . . 74.1 109.36 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.416 ' HB3' ' CD2' ' A' ' 104' ' ' PHE . 19.9 t0 -51.86 -49.77 62.26 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 62.13 109.303 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.568 ' CE2' HG12 ' A' ' 206' ' ' VAL . 0.9 OUTLIER -114.47 -26.54 7.9 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.565 1.165 . . . . 74.02 111.018 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.436 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 93.54 45.63 3.41 Favored Glycine 0 CA--C 1.529 0.957 0 O-C-N 124.476 1.11 . . . . 63.33 111.017 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 12.1 mm -84.42 69.34 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.442 0.731 . . . . 63.12 109.252 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.506 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -115.58 156.35 46.21 Favored Pre-proline 0 C--N 1.325 -0.499 0 O-C-N 124.483 1.114 . . . . 73.53 109.296 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.521 ' HD3' ' CE2' ' A' ' 78' ' ' PHE . 18.5 Cg_endo -74.92 157.96 99.27 Favored 'Cis proline' 0 C--N 1.36 1.181 0 C-N-CA 121.077 -2.468 . . . . 74.45 110.957 0.073 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -122.86 133.01 8.9 Favored Glycine 0 CA--C 1.532 1.096 0 O-C-N 124.535 1.147 . . . . 70.23 110.986 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -154.64 135.02 4.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.534 0.785 . . . . 72.52 109.354 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . 0.403 HD12 ' NE2' ' A' ' 85' ' ' HIS . 38.2 pt -91.07 176.46 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.449 1.093 . . . . 73.21 109.292 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.518 ' CG ' HD22 ' A' ' 84' ' ' LEU . 2.2 t80 -78.71 -19.2 52.96 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.503 1.127 . . . . 74.51 110.995 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -90.08 -3.59 57.85 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.521 1.138 . . . . 73.15 109.279 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -110.49 -26.41 9.52 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.515 1.134 . . . . 64.12 110.239 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.444 ' CE ' HG22 ' A' ' 82' ' ' VAL . 6.1 ttm -38.55 111.1 0.6 Allowed Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.525 1.141 . . . . 73.53 110.991 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 C--N 1.36 1.153 0 O-C-N 124.533 1.807 . . . . 73.21 111.004 179.988 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.503 ' O ' ' CB ' ' A' ' 128' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.332 0 N-CA-C 109.299 -0.63 . . . . 64.22 109.299 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -45.31 -59.23 2.77 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.509 1.13 . . . . 74.52 109.321 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -44.65 -39.25 4.9 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.536 1.147 . . . . 74.42 109.285 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.503 ' CB ' ' O ' ' A' ' 125' ' ' LEU . . . -50.38 -50.49 51.31 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.504 1.128 . . . . 70.54 109.297 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.507 ' O ' ' CB ' ' A' ' 168' ' ' ASN . 34.6 m -92.48 31.16 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.438 1.086 . . . . 73.04 109.218 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -114.08 149.18 35.9 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.492 1.12 . . . . 75.23 109.254 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 39.66 70.03 0.38 Allowed Glycine 0 CA--C 1.531 1.063 0 O-C-N 124.54 1.15 . . . . 73.21 110.983 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -163.6 179.77 6.98 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.545 0.791 . . . . 65.43 110.063 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . 0.589 ' CB ' ' CE3' ' A' ' 134' ' ' TRP . . . -102.49 -43.06 5.75 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.526 1.141 . . . . 73.52 109.279 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.589 ' CE3' ' CB ' ' A' ' 133' ' ' ALA . 0.7 OUTLIER -154.99 169.89 23.03 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.534 1.146 . . . . 73.32 108.05 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' THR . . . . . 0.534 ' CG2' ' CG1' ' A' ' 82' ' ' VAL . 1.2 p -137.99 158.32 44.57 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 65.05 110.374 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.426 ' CG1' HG13 ' A' ' 83' ' ' ILE . 10.5 mm -110.98 142.26 23.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.53 1.144 . . . . 72.53 109.257 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.48 ' CD2' ' N ' ' A' ' 137' ' ' LEU . 0.5 OUTLIER -134.69 96.46 3.56 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.462 1.101 . . . . 74.32 109.31 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.534 ' CD2' ' CB ' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.43 96.72 0.08 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.547 1.154 . . . . 75.31 109.278 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.23 102.81 0.24 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.468 1.105 . . . . 71.31 109.291 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' THR . . . . . 0.443 ' O ' ' N ' ' A' ' 144' ' ' LEU . 2.6 m -130.47 155.59 46.19 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.446 1.091 . . . . 63.21 110.397 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -64.42 -36.39 84.0 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.546 1.154 . . . . 63.55 110.313 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -84.1 -25.93 29.35 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.469 1.106 . . . . 74.44 109.366 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.441 ' CB ' ' HB ' ' A' ' 140' ' ' THR . 52.9 t80 -85.67 -19.93 30.17 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.479 1.112 . . . . 63.34 111.06 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.463 ' C ' ' CD1' ' A' ' 144' ' ' LEU . 2.0 tm? -66.23 -67.23 0.46 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.495 1.122 . . . . 70.41 109.299 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.45 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 22.4 mmt180 -55.17 -19.69 8.49 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.481 1.113 . . . . 74.31 110.355 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -71.96 -67.2 0.55 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.475 1.11 . . . . 74.03 109.318 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.453 ' O ' ' N ' ' A' ' 150' ' ' ASN . 3.1 p -66.84 -54.62 20.54 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.542 1.151 . . . . 75.12 110.4 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.511 ' CZ3' ' HE1' ' A' ' 158' ' ' MET . 3.3 t-105 -43.08 -36.54 1.67 Allowed 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.518 1.136 . . . . 75.11 108.029 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' CYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 43.7 t -78.64 -45.33 21.77 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.61 1.194 . . . . 74.12 108.354 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' ASN . . . . . 0.453 ' N ' ' O ' ' A' ' 147' ' ' THR . 6.3 t-20 -56.51 -21.83 28.7 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.432 1.082 . . . . 75.15 109.319 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.436 ' O ' ' N ' ' A' ' 154' ' ' TYR . 10.7 m-30 -77.06 -51.78 10.46 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.558 1.161 . . . . 75.14 111.027 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 38.6 tt0 -42.46 -40.9 2.74 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.475 1.109 . . . . 75.15 110.3 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -88.81 -23.63 22.8 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.465 1.103 . . . . 74.45 110.924 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.436 ' N ' ' O ' ' A' ' 151' ' ' PHE . 6.8 t80 -135.17 87.91 2.37 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.481 1.113 . . . . 71.4 111.116 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.84 -4.65 29.19 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.525 1.141 . . . . 75.42 110.416 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.68 -34.39 62.23 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.521 1.138 . . . . 73.13 109.994 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.466 HD11 ' CD2' ' A' ' 125' ' ' LEU . 0.9 OUTLIER -83.06 -31.43 27.37 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.49 1.119 . . . . 74.04 109.242 -179.967 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' MET . . . . . 0.511 ' HE1' ' CZ3' ' A' ' 148' ' ' TRP . 3.5 mmt -58.94 -37.42 76.68 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.493 1.121 . . . . 73.44 110.956 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -84.11 -9.62 58.44 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.453 1.095 . . . . 75.41 109.359 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' SER . . . . . 0.48 ' CB ' HG23 ' A' ' 170' ' ' VAL . 0.3 OUTLIER -82.8 -31.37 28.21 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.43 1.082 . . . . 73.41 110.037 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . 0.48 ' O ' ' CD1' ' A' ' 192' ' ' ILE . 29.8 m -62.18 -18.04 19.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 124.45 1.094 . . . . 73.34 109.248 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 42.0 m-20 -78.8 0.59 26.37 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.558 1.161 . . . . 62.35 109.234 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.417 ' NE ' HG22 ' A' ' 192' ' ' ILE . 0.0 OUTLIER 50.55 49.96 19.8 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.478 1.111 . . . . 53.12 110.281 179.974 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -50.63 -177.98 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.497 1.123 . . . . 75.43 110.312 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 22.1 p80 -93.26 39.58 1.05 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.548 1.155 . . . . 73.41 109.572 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.7 tptt -94.71 179.33 5.29 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.536 1.147 . . . . 74.0 109.317 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 167' ' ' TYR . . . . . . . . . . . . . 24.4 p90 -84.95 44.27 1.06 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.489 1.118 . . . . 72.02 110.979 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . 0.507 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 19.5 p30 -170.51 142.31 2.06 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 64.42 109.352 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 169' ' ' SER . . . . . 0.481 ' O ' ' N ' ' A' ' 135' ' ' THR . 1.4 t -128.14 128.4 44.77 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.555 1.159 . . . . 72.34 109.982 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.48 HG23 ' CB ' ' A' ' 160' ' ' SER . 8.9 t -95.59 107.18 19.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.507 1.129 . . . . 72.03 109.319 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.7 mp -121.48 106.31 37.92 Favored Pre-proline 0 C--N 1.324 -0.512 0 O-C-N 124.511 1.132 . . . . 72.43 109.338 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . 0.503 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -74.98 116.24 4.53 Favored 'Trans proline' 0 C--N 1.359 1.118 0 O-C-N 124.52 1.8 . . . . 61.24 111.016 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 3.6 ttt -92.46 152.46 19.67 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.492 1.12 . . . . 74.11 110.997 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 3.6 tpp180 -104.78 116.81 60.27 Favored Pre-proline 0 C--N 1.325 -0.47 0 O-C-N 124.52 1.138 . . . . 71.11 110.301 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.05 153.85 41.84 Favored 'Trans proline' 0 C--N 1.36 1.183 0 O-C-N 124.47 1.774 . . . . 72.2 110.999 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . 0.6 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -87.31 -43.79 11.9 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.463 1.102 . . . . 74.2 109.307 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -71.81 -27.21 62.77 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.51 1.131 . . . . 74.24 109.284 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -110.85 97.86 35.63 Favored Pre-proline 0 C--N 1.326 -0.445 0 O-C-N 124.435 1.085 . . . . 72.43 109.307 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.95 121.38 6.56 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.562 1.822 . . . . 74.4 111.081 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . 0.467 HD22 ' CB ' ' A' ' 184' ' ' ARG . 0.4 OUTLIER -128.9 96.49 29.15 Favored Pre-proline 0 C--N 1.324 -0.527 0 O-C-N 124.575 1.172 . . . . 72.53 109.327 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.04 171.54 18.12 Favored 'Trans proline' 0 C--N 1.359 1.124 0 O-C-N 124.554 1.818 . . . . 73.05 110.971 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 7.6 ptp85 -59.66 -23.41 63.03 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.531 1.145 . . . . 73.22 110.278 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -70.05 -29.23 66.2 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.459 1.099 . . . . 64.31 110.337 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 184' ' ' ARG . . . . . 0.467 ' CB ' HD22 ' A' ' 180' ' ' LEU . 27.7 mmt180 -95.41 -18.74 20.47 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.542 1.151 . . . . 74.43 110.31 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 185' ' ' THR . . . . . . . . . . . . . 19.9 m -80.9 143.95 54.5 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.516 1.135 . . . . 75.33 110.381 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.08 155.61 42.55 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.475 1.776 . . . . 72.21 110.927 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 187' ' ' PHE . . . . . 0.503 ' O ' ' CG2' ' A' ' 191' ' ' THR . 9.2 p90 -69.4 -7.1 34.62 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.513 1.133 . . . . 72.3 111.04 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.97 -53.14 4.11 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.523 1.139 . . . . 74.03 109.3 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.468 ' CD2' ' HG3' ' A' ' 172' ' ' PRO . 53.2 mt -68.3 -42.4 79.52 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.424 1.078 . . . . 75.24 109.281 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -63.82 -10.96 23.12 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.512 1.132 . . . . 74.22 110.327 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 191' ' ' THR . . . . . 0.503 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 36.2 p -113.6 18.31 17.66 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.429 1.08 . . . . 75.03 110.393 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.48 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 4.9 mt -136.37 142.46 38.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.462 1.101 . . . . 73.0 109.265 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 193' ' ' ASN . . . . . 0.405 ' N ' HG22 ' A' ' 192' ' ' ILE . 34.2 t30 -48.23 124.31 7.64 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.515 1.135 . . . . 70.54 109.319 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . 0.503 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -121.09 155.05 35.28 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.463 1.102 . . . . 70.23 109.311 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 195' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -82.27 134.22 35.27 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.538 1.149 . . . . 75.34 109.278 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -112.72 131.47 55.65 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.455 1.097 . . . . 72.41 110.259 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . 0.469 ' HG3' ' CD2' ' A' ' 176' ' ' LEU . 3.8 tp10 -113.42 -25.37 8.83 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.491 1.119 . . . . 61.44 110.369 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -96.98 3.95 51.77 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.515 1.135 . . . . 65.11 110.299 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 19.5 t -97.26 174.27 6.8 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.545 1.153 . . . . 75.12 109.966 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -83.47 -32.89 25.77 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.54 1.15 . . . . 75.12 110.253 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -87.71 19.34 33.67 Favored Glycine 0 CA--C 1.529 0.941 0 O-C-N 124.568 1.167 . . . . 71.42 111.034 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 202' ' ' PHE . . . . . 0.615 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 0.1 OUTLIER -56.8 -43.42 99.36 Favored Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.454 0.738 . . . . 72.42 110.98 -179.971 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 203' ' ' PRO . . . . . 0.615 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.0 Cg_endo -75.02 -28.91 8.73 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.486 1.782 . . . . 63.21 110.964 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -64.69 -65.1 0.72 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.449 1.093 . . . . 60.34 110.405 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -50.38 -44.31 54.78 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.458 1.099 . . . . 71.42 110.318 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 206' ' ' VAL . . . . . 0.568 HG12 ' CE2' ' A' ' 104' ' ' PHE . 72.5 t -56.2 -29.44 27.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.453 1.096 . . . . 70.52 109.363 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -82.8 -51.54 7.57 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.517 1.136 . . . . 52.02 110.297 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 11.6 mpt_? -58.21 -62.52 1.77 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.543 1.152 . . . . 74.33 110.377 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 209' ' ' ILE . . . . . 0.531 ' O ' ' CE2' ' A' ' 134' ' ' TRP . 84.6 mt -49.85 -51.29 16.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.516 1.135 . . . . 72.42 109.306 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 210' ' ' PHE . . . . . 0.568 ' HA ' ' CH2' ' A' ' 134' ' ' TRP . 1.2 m-85 -101.49 61.71 0.92 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.494 1.121 . . . . 74.54 111.016 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.94 145.85 37.62 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.507 1.13 . . . . 73.02 110.334 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . 0.452 ' O ' ' N ' ' A' ' 215' ' ' TYR . 32.4 tt0 -49.43 -55.02 14.55 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.506 1.129 . . . . 73.42 110.306 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.04 -23.59 1.24 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.495 1.122 . . . . 74.45 110.083 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 38.9 t -96.22 -27.49 4.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.538 1.149 . . . . 70.52 109.321 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 215' ' ' TYR . . . . . 0.452 ' N ' ' O ' ' A' ' 212' ' ' GLU . 3.4 t80 -63.87 -28.72 70.04 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.495 1.122 . . . . 75.23 111.01 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . 0.439 ' O ' ' N ' ' A' ' 220' ' ' THR . 64.2 mmtt -60.0 -65.28 0.71 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.547 1.154 . . . . 73.51 109.352 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 217' ' ' THR . . . . . 0.422 HG22 ' CD1' ' A' ' 221' ' ' ILE . 34.7 m -40.58 -62.94 0.7 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.546 1.154 . . . . 73.43 110.398 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 93.4 mm-40 -50.15 -63.31 1.15 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.52 1.137 . . . . 70.24 110.342 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 219' ' ' GLN . . . . . 0.409 ' NE2' ' HB3' ' A' ' 223' ' ' LYS . 34.1 tp60 -52.99 -20.2 3.24 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.561 1.163 . . . . 74.12 110.274 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 220' ' ' THR . . . . . 0.439 ' N ' ' O ' ' A' ' 216' ' ' LYS . 0.9 OUTLIER -87.49 -29.69 21.18 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.476 1.11 . . . . 74.44 110.435 -179.939 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 221' ' ' ILE . . . . . 0.422 ' CD1' HG22 ' A' ' 217' ' ' THR . 10.0 mt -78.86 -35.24 17.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.485 1.116 . . . . 72.15 109.305 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 222' ' ' TRP . . . . . 0.412 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 25.1 t90 -69.91 -55.0 10.86 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.492 1.12 . . . . 74.45 108.047 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . 0.409 ' HB3' ' NE2' ' A' ' 219' ' ' GLN . 0.0 OUTLIER -58.67 -22.03 55.9 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.467 1.104 . . . . 75.24 109.356 179.927 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 220' ' ' THR . 67.9 mt-10 . . . . . 0 C--N 1.325 -0.485 0 O-C-N 124.539 1.149 . . . . 74.24 110.354 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.502 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.3 p . . . . . 0 N--CA 1.453 -0.29 0 N-CA-C 109.334 -0.617 . . . . 71.31 109.334 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.461 ' CD2' ' OH ' ' A' ' 215' ' ' TYR . 2.3 t80 -88.87 24.29 2.1 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.535 1.147 . . . . 74.2 111.046 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.453 HD11 ' CG2' ' A' ' 110' ' ' ILE . 3.6 tp -40.35 159.33 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.464 1.102 . . . . 75.33 109.302 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.457 ' NZ ' ' O ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -106.24 -49.42 3.36 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.47 1.106 . . . . 73.24 109.292 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.597 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -167.07 132.26 2.07 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.513 1.133 . . . . 74.54 110.968 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.52 ' CG2' ' CE ' ' A' ' 115' ' ' MET . 3.1 p -90.14 158.17 2.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.487 1.117 . . . . 50.12 109.293 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.439 HG13 ' CG1' ' A' ' 136' ' ' ILE . 5.0 mp -113.56 94.58 3.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 O-C-N 124.46 1.1 . . . . 62.02 109.276 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.474 HD21 ' CG ' ' A' ' 112' ' ' PHE . 5.0 mt -70.25 118.03 12.56 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.523 1.14 . . . . 73.44 109.362 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.469 ' HB3' ' CB ' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -136.62 173.74 11.38 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.532 1.145 . . . . 71.31 109.566 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -111.19 163.66 13.68 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.458 1.099 . . . . 72.21 109.291 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.415 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 10.3 tt0 -65.46 -10.7 36.45 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.562 1.164 . . . . 72.01 110.36 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -85.38 -44.89 12.39 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.501 1.126 . . . . 75.54 109.311 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -119.31 43.3 2.64 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.525 1.14 . . . . 73.35 109.364 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.421 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -71.84 -42.92 66.36 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.51 1.131 . . . . 71.34 110.358 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -64.49 -40.23 95.28 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.46 1.1 . . . . 62.53 109.277 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.408 ' CD ' ' C ' ' A' ' 92' ' ' GLU . 0.5 OUTLIER -53.28 -69.72 0.11 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.527 1.142 . . . . 75.24 110.298 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.469 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -43.03 -32.14 0.63 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.565 1.166 . . . . 74.3 109.329 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.5 -57.25 6.84 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.468 1.105 . . . . 74.21 109.27 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.11 -35.25 0.54 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.594 1.183 . . . . 73.02 110.355 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.46 HG22 ' CE ' ' A' ' 173' ' ' MET . 0.9 OUTLIER -79.31 -65.82 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 O-C-N 124.466 1.104 . . . . 72.21 109.307 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.442 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -42.21 -24.78 0.06 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.515 1.135 . . . . 74.34 110.329 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.448 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -74.32 -59.06 2.9 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.561 1.163 . . . . 74.02 109.306 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.509 ' O ' ' CB ' ' A' ' 103' ' ' ASP . 0.0 OUTLIER -62.47 -22.58 66.34 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.421 1.076 . . . . 73.43 109.271 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.443 ' CD2' HG13 ' A' ' 206' ' ' VAL . 39.0 mt -73.65 -39.21 64.64 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.533 1.146 . . . . 73.12 109.311 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.84 46.77 1.42 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.579 1.174 . . . . 71.22 110.318 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -175.8 -60.39 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.543 1.152 . . . . 72.32 109.253 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.509 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 49.0 t0 -40.45 -63.17 0.67 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.541 1.15 . . . . 73.23 109.324 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.568 ' CE2' HG11 ' A' ' 206' ' ' VAL . 4.9 m-85 -103.02 -14.62 16.38 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.465 1.103 . . . . 73.43 111.017 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.82 39.23 7.14 Favored Glycine 0 CA--C 1.53 1.009 0 O-C-N 124.514 1.134 . . . . 64.53 110.952 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.407 ' CG2' ' HD3' ' A' ' 80' ' ' LYS . 11.0 mm -75.57 72.21 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 O-C-N 124.516 0.774 . . . . 72.55 109.349 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.525 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -118.38 151.79 49.99 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.476 1.11 . . . . 74.04 109.363 179.996 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.525 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.0 147.46 89.33 Favored 'Cis proline' 0 C--N 1.36 1.169 0 C-N-CA 121.01 -2.496 . . . . 73.42 110.977 0.023 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -124.34 135.04 9.4 Favored Glycine 0 CA--C 1.531 1.068 0 O-C-N 124.431 1.082 . . . . 72.11 110.942 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.453 ' CG2' HD11 ' A' ' 79' ' ' LEU . 9.9 tt -156.94 153.94 6.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.499 0.764 . . . . 75.34 109.332 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 8.7 pt -95.98 -177.06 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.549 1.156 . . . . 65.43 109.319 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.474 ' CG ' HD21 ' A' ' 84' ' ' LEU . 5.4 t80 -80.92 -19.08 45.06 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.54 1.15 . . . . 63.15 110.959 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.434 ' HB2' ' CE1' ' A' ' 85' ' ' HIS . . . -91.6 -12.87 33.05 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.496 1.122 . . . . 62.43 109.294 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -97.62 -24.53 15.49 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.475 1.109 . . . . 72.22 110.324 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.52 ' CE ' ' CG2' ' A' ' 82' ' ' VAL . 7.4 ttm -46.03 143.93 3.2 Favored Pre-proline 0 C--N 1.324 -0.511 0 O-C-N 124.421 1.076 . . . . 73.34 111.007 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo . . . . . 0 C--N 1.36 1.157 0 O-C-N 124.527 1.804 . . . . 70.03 110.95 -179.952 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.331 0 N-CA-C 109.323 -0.621 . . . . 74.35 109.323 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -67.86 -15.36 63.58 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.462 1.101 . . . . 75.22 109.284 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.407 ' O ' ' ND2' ' A' ' 130' ' ' ASN . 66.7 m-20 -62.3 -27.6 69.15 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.536 1.148 . . . . 74.15 109.402 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.465 ' CB ' ' HG ' ' A' ' 84' ' ' LEU . . . -93.14 -13.12 28.85 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.495 1.122 . . . . 75.24 109.352 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.5 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 71.1 t -92.86 30.44 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 124.593 1.183 . . . . 74.42 109.247 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.407 ' ND2' ' O ' ' A' ' 127' ' ' ASP . 28.3 p30 -135.81 151.18 49.81 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.553 1.158 . . . . 74.53 109.306 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 42.87 64.53 1.64 Allowed Glycine 0 CA--C 1.53 0.972 0 O-C-N 124.582 1.176 . . . . 64.13 111.005 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -163.61 -174.29 3.64 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.48 0.753 . . . . 63.32 109.96 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . 0.568 ' HB2' ' CE3' ' A' ' 134' ' ' TRP . . . -113.71 -35.91 5.04 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.539 1.149 . . . . 73.23 109.302 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.575 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 0.6 OUTLIER -159.07 163.58 36.15 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.556 1.16 . . . . 73.5 108.039 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 28.4 p -131.42 135.47 47.19 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.532 1.145 . . . . 75.52 110.383 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.439 ' CG1' HG13 ' A' ' 83' ' ' ILE . 36.4 mm -84.31 136.99 21.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.485 1.116 . . . . 73.55 109.314 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 21.2 mt -129.7 99.08 5.01 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.582 1.176 . . . . 65.13 109.338 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.444 HD23 ' CB ' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.26 88.19 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.573 1.171 . . . . 72.45 109.295 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 18.6 mt -56.93 99.19 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.495 1.122 . . . . 71.44 109.322 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' THR . . . . . 0.46 ' O ' ' CB ' ' A' ' 144' ' ' LEU . 10.1 m -124.03 177.31 5.86 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.531 1.144 . . . . 72.44 110.458 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -80.32 -33.7 37.31 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.435 1.085 . . . . 74.25 110.23 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -89.58 -20.84 23.26 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.492 1.12 . . . . 65.05 109.334 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -89.8 -46.34 8.65 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.554 1.159 . . . . 71.4 111.078 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.495 ' C ' ' CD1' ' A' ' 144' ' ' LEU . 1.5 tm? -46.88 -61.08 2.02 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.469 1.106 . . . . 73.31 109.242 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 9.9 mmt85 -60.59 -20.69 61.28 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.488 1.117 . . . . 72.41 110.27 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -71.89 -66.43 0.64 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.568 1.167 . . . . 73.04 109.26 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.439 ' O ' ' N ' ' A' ' 150' ' ' ASN . 16.5 p -69.37 -54.52 14.03 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.457 1.098 . . . . 72.44 110.38 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.471 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 24.1 t-105 -42.17 -38.05 1.62 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.962 -1.125 . . . . 72.44 107.962 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' CYS . . . . . 0.446 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 53.3 t -79.02 -45.33 20.42 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.524 1.14 . . . . 71.12 108.295 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' ASN . . . . . 0.439 ' N ' ' O ' ' A' ' 147' ' ' THR . 3.0 t30 -57.91 -17.78 18.88 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.484 1.115 . . . . 74.31 109.306 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.464 ' CD2' ' HE2' ' A' ' 158' ' ' MET . 9.7 m-30 -83.06 -46.35 12.93 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 75.41 111.004 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -49.21 -33.51 12.67 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.48 1.113 . . . . 73.21 110.287 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -97.29 -19.83 18.28 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.45 1.094 . . . . 75.12 111.023 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.47 ' CE1' ' CB ' ' A' ' 156' ' ' SER . 0.4 OUTLIER -128.59 94.94 3.99 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.535 1.147 . . . . 74.4 111.006 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' THR . . . . . 0.401 ' O ' ' N ' ' A' ' 158' ' ' MET . 3.5 t -64.53 -21.23 66.63 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.526 1.141 . . . . 75.15 110.355 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' SER . . . . . 0.47 ' CB ' ' CE1' ' A' ' 154' ' ' TYR . 18.8 t -40.13 -48.16 2.46 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.503 1.127 . . . . 64.4 109.997 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.29 -42.95 71.38 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.519 1.137 . . . . 73.45 109.323 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' MET . . . . . 0.464 ' HE2' ' CD2' ' A' ' 151' ' ' PHE . 24.9 mmt -55.2 -20.71 11.32 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.55 1.156 . . . . 72.41 110.982 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 20.1 m-80 -86.3 -30.78 22.0 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.623 1.202 . . . . 74.24 109.275 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -82.22 -17.48 45.93 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.518 1.136 . . . . 75.43 110.026 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . 0.497 ' O ' ' CD1' ' A' ' 192' ' ' ILE . 6.6 t -61.85 -30.6 48.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.48 1.113 . . . . 73.25 109.297 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' ASN . . . . . 0.482 ' O ' ' C ' ' A' ' 163' ' ' ARG . 15.5 t-20 -82.41 4.53 23.73 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.59 1.181 . . . . 75.41 109.263 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.482 ' C ' ' O ' ' A' ' 162' ' ' ASN . 0.0 OUTLIER 32.42 49.77 0.16 Allowed 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.498 1.124 . . . . 75.24 110.289 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -52.37 -173.74 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.508 1.13 . . . . 72.41 110.292 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -84.18 60.74 6.11 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.504 1.127 . . . . 72.14 109.528 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . 0.491 ' HG3' ' CD1' ' A' ' 167' ' ' TYR . 0.1 OUTLIER -121.51 157.66 30.17 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.544 1.152 . . . . 74.31 109.28 179.976 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 167' ' ' TYR . . . . . 0.565 ' CD2' ' N ' ' A' ' 168' ' ' ASN . 52.1 p90 -54.65 -47.17 73.87 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.54 1.15 . . . . 74.33 110.999 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . 0.565 ' N ' ' CD2' ' A' ' 167' ' ' TYR . 12.7 p30 -87.07 126.18 34.6 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.439 1.087 . . . . 74.14 109.279 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 169' ' ' SER . . . . . 0.416 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 3.1 t -121.86 176.91 5.51 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.494 1.121 . . . . 55.12 110.011 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 3.2 t -134.16 117.26 24.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.464 1.103 . . . . 74.12 109.291 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.6 mp -128.13 97.45 29.04 Favored Pre-proline 0 C--N 1.325 -0.481 0 O-C-N 124.518 1.136 . . . . 74.51 109.252 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . 0.426 ' HG3' ' CD2' ' A' ' 189' ' ' LEU . 18.6 Cg_endo -74.95 107.1 2.4 Favored 'Trans proline' 0 C--N 1.359 1.126 0 O-C-N 124.51 1.795 . . . . 71.44 111.003 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 173' ' ' MET . . . . . 0.46 ' CE ' HG22 ' A' ' 96' ' ' VAL . 5.8 ttt -82.52 157.66 23.46 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.427 1.079 . . . . 72.05 110.982 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 29.4 mmm-85 -108.98 113.67 59.08 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.498 1.124 . . . . 74.11 110.314 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.99 146.39 32.61 Favored 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.451 1.764 . . . . 72.15 111.013 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . 0.561 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -82.32 -40.77 20.97 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.534 1.146 . . . . 73.54 109.251 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -72.18 -28.63 63.34 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 124.535 1.147 . . . . 72.24 109.293 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 178' ' ' ASN . . . . . 0.457 ' OD1' ' CG2' ' A' ' 140' ' ' THR . 4.7 m-80 -110.77 99.2 41.06 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.53 1.144 . . . . 73.41 109.255 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 135.49 19.15 Favored 'Trans proline' 0 C--N 1.359 1.111 0 O-C-N 124.449 1.763 . . . . 54.25 111.019 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . 0.475 ' CD1' ' OG1' ' A' ' 185' ' ' THR . 0.4 OUTLIER -141.2 96.99 7.0 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.463 1.102 . . . . 73.12 109.364 179.973 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.01 171.35 18.51 Favored 'Trans proline' 0 C--N 1.359 1.121 0 O-C-N 124.529 1.804 . . . . 62.5 110.978 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . 0.5 ' CG ' ' OE1' ' A' ' 190' ' ' GLN . 50.0 mtm-85 -62.74 -23.57 67.25 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.55 1.156 . . . . 75.55 110.305 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -72.02 -5.17 33.13 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.499 1.125 . . . . 60.51 110.279 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 -128.94 4.95 5.38 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.478 1.111 . . . . 65.33 110.274 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 185' ' ' THR . . . . . 0.475 ' OG1' ' CD1' ' A' ' 180' ' ' LEU . 51.5 m -110.97 143.8 29.05 Favored Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.49 1.119 . . . . 74.0 110.36 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 186' ' ' PRO . . . . . 0.446 ' HB3' ' CZ2' ' A' ' 148' ' ' TRP . 18.3 Cg_endo -75.05 146.91 33.03 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.556 1.819 . . . . 73.21 111.018 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 187' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -63.05 -11.49 19.79 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.447 1.092 . . . . 73.44 111.031 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -87.78 -54.03 4.46 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.51 1.131 . . . . 71.02 109.313 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.426 ' CD2' ' HG3' ' A' ' 172' ' ' PRO . 23.0 mt -73.31 -19.0 61.14 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.504 1.127 . . . . 74.15 109.311 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 190' ' ' GLN . . . . . 0.5 ' OE1' ' CG ' ' A' ' 182' ' ' ARG . 6.7 tt0 -84.84 -2.2 57.45 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.485 1.115 . . . . 64.11 110.297 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 191' ' ' THR . . . . . . . . . . . . . 41.2 p -126.38 1.83 7.0 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.509 1.13 . . . . 73.51 110.399 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.497 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 12.9 mt -94.25 163.94 2.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.547 1.154 . . . . 74.24 109.309 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 193' ' ' ASN . . . . . 0.491 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 58.8 t30 -78.07 57.53 1.81 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.52 1.138 . . . . 71.34 109.319 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.11 177.16 0.36 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.485 1.116 . . . . 73.32 109.324 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 195' ' ' LEU . . . . . 0.445 ' CD1' ' HE1' ' A' ' 173' ' ' MET . 0.2 OUTLIER -108.29 152.89 24.01 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.523 1.139 . . . . 64.52 109.26 -179.932 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . 0.418 ' N ' HD12 ' A' ' 195' ' ' LEU . 99.1 mt-10 -144.47 137.09 26.69 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.535 1.147 . . . . 72.12 110.341 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . 0.474 ' HG3' ' CD1' ' A' ' 176' ' ' LEU . 0.8 OUTLIER -111.06 -12.0 14.23 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.431 1.082 . . . . 74.3 110.29 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . 0.457 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 1.4 pt-20 -95.22 13.24 26.14 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.482 1.114 . . . . 64.31 110.318 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 1.7 t -118.18 164.96 14.39 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.541 1.151 . . . . 73.25 110.005 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -78.59 -26.5 45.49 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.51 1.131 . . . . 74.12 110.298 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -87.08 13.08 60.42 Favored Glycine 0 CA--C 1.53 1.009 0 O-C-N 124.45 1.094 . . . . 74.31 111.026 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 202' ' ' PHE . . . . . 0.592 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 0.0 OUTLIER -52.61 -45.74 96.04 Favored Pre-proline 0 C--N 1.325 -0.458 0 O-C-N 124.423 0.72 . . . . 75.24 110.986 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 203' ' ' PRO . . . . . 0.592 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.2 Cg_endo -74.97 -34.8 3.58 Favored 'Trans proline' 0 C--N 1.359 1.116 0 O-C-N 124.562 1.822 . . . . 62.33 111.014 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -57.45 -56.0 27.47 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.448 1.092 . . . . 64.43 110.358 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -63.61 -36.65 84.51 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.467 1.104 . . . . 74.51 110.33 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 206' ' ' VAL . . . . . 0.568 HG11 ' CE2' ' A' ' 104' ' ' PHE . 37.7 t -63.86 -37.09 78.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 O-C-N 124.491 1.119 . . . . 74.4 109.329 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 207' ' ' GLU . . . . . 0.435 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 4.3 mt-10 -69.68 -49.49 53.01 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.545 1.153 . . . . 72.33 110.305 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 80.0 mtt-85 -67.21 -66.25 0.58 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.476 1.11 . . . . 70.24 110.271 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 209' ' ' ILE . . . . . 0.58 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 45.4 mt -43.46 -57.78 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.53 1.144 . . . . 71.15 109.309 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 210' ' ' PHE . . . . . 0.58 ' CE1' ' CG2' ' A' ' 209' ' ' ILE . 3.2 m-85 -102.53 69.45 1.1 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.54 1.15 . . . . 72.03 110.967 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 211' ' ' GLN . . . . . 0.435 ' CB ' ' O ' ' A' ' 207' ' ' GLU . 0.0 OUTLIER -110.83 143.26 41.69 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.457 1.098 . . . . 71.23 110.3 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . 0.454 ' O ' ' N ' ' A' ' 215' ' ' TYR . 29.2 tt0 -50.09 -53.74 25.21 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.541 1.15 . . . . 71.22 110.246 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -48.56 -23.53 1.02 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.482 1.114 . . . . 74.22 109.983 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 20.4 t -95.14 -29.56 4.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 O-C-N 124.499 1.124 . . . . 72.14 109.26 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 215' ' ' TYR . . . . . 0.461 ' OH ' ' CD2' ' A' ' 78' ' ' PHE . 9.4 t80 -61.92 -19.01 62.25 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.476 1.11 . . . . 74.41 111.039 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 16.5 mmmt -76.13 -44.52 38.06 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.539 1.149 . . . . 75.12 109.245 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 74.7 m -59.63 -66.43 0.51 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.5 1.125 . . . . 44.01 110.445 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 218' ' ' GLN . . . . . 0.425 ' NE2' ' N ' ' A' ' 218' ' ' GLN . 0.0 OUTLIER -51.34 -28.31 12.01 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.486 1.117 . . . . 73.2 110.32 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 33.3 tp60 -67.96 -55.57 12.25 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.54 1.15 . . . . 74.5 110.263 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.6 m -62.31 -36.4 82.05 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.534 1.146 . . . . 63.31 110.392 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 221' ' ' ILE . . . . . 0.414 HG22 ' N ' ' A' ' 167' ' ' TYR . 20.3 mt -66.87 -18.91 24.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.519 1.137 . . . . 74.23 109.302 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 222' ' ' TRP . . . . . 0.502 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 11.8 t90 -69.89 -64.68 0.84 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.517 1.135 . . . . 71.22 107.958 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . 0.451 ' NZ ' ' CB ' ' A' ' 223' ' ' LYS . 0.0 OUTLIER -54.14 -31.21 51.81 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.509 1.13 . . . . 73.21 109.247 -179.942 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.325 -0.473 0 O-C-N 124.498 1.124 . . . . 75.41 110.301 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.444 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 2.4 p . . . . . 0 N--CA 1.453 -0.289 0 N-CA-C 109.295 -0.631 . . . . 73.44 109.295 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.552 ' CE2' ' HD3' ' A' ' 108' ' ' PRO . 48.2 p90 -96.22 40.33 1.13 Allowed 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.556 1.16 . . . . 74.01 111.003 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 78' ' ' PHE . 3.0 tp -39.97 133.82 1.59 Allowed 'General case' 0 C--N 1.323 -0.553 0 O-C-N 124.52 1.138 . . . . 65.33 109.258 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.495 ' NZ ' ' CG2' ' A' ' 106' ' ' ILE . 9.2 mmmm -57.04 -66.35 0.47 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.483 1.114 . . . . 75.35 109.317 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.422 ' CE2' HG13 ' A' ' 83' ' ' ILE . 2.2 p90 -166.32 179.81 5.43 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.585 1.178 . . . . 72.13 111.001 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.474 ' CG2' ' HE1' ' A' ' 115' ' ' MET . 0.8 OUTLIER -111.73 149.91 14.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.433 1.083 . . . . 73.14 109.318 179.999 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.447 HG13 ' CG1' ' A' ' 136' ' ' ILE . 4.9 mp -121.2 89.51 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.533 1.145 . . . . 72.42 109.252 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.572 HD22 ' CD1' ' A' ' 112' ' ' PHE . 6.2 mt -70.24 121.79 18.27 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.568 1.168 . . . . 75.22 109.35 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.576 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -144.14 174.64 10.7 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.541 1.151 . . . . 75.21 109.552 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -111.99 164.35 13.23 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.474 1.109 . . . . 70.15 109.279 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -63.04 -12.27 25.19 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.502 1.126 . . . . 73.52 110.244 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -82.33 -46.12 14.02 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.481 1.113 . . . . 64.44 109.273 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -120.71 44.33 2.52 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.452 1.095 . . . . 71.43 109.293 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.576 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -76.85 -25.66 53.41 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.457 1.098 . . . . 74.51 110.347 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -85.79 -21.75 28.01 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.453 1.096 . . . . 72.35 109.314 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -73.18 -45.67 55.11 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.56 1.163 . . . . 75.51 110.338 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.471 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -70.14 -31.43 68.93 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.464 1.103 . . . . 74.21 109.352 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.485 ' CD2' ' C ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -73.1 -52.82 12.84 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.51 1.131 . . . . 74.52 109.311 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.23 -37.25 2.07 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.46 1.1 . . . . 73.21 110.328 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.454 ' C ' ' N ' ' A' ' 98' ' ' ASN . 2.3 t -73.42 -64.76 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.512 1.133 . . . . 72.24 109.315 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.435 ' N ' HG11 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -40.6 -26.86 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.53 1.144 . . . . 64.43 110.319 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.454 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.0 OUTLIER -73.21 -60.18 2.36 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.521 1.138 . . . . 71.23 109.287 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.519 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -62.61 -22.11 66.16 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.504 1.127 . . . . 74.02 109.282 179.995 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.459 ' CD2' HG13 ' A' ' 206' ' ' VAL . 28.5 mt -67.75 -43.23 80.35 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.415 1.072 . . . . 72.51 109.272 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -86.41 46.73 1.38 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.567 1.167 . . . . 64.41 110.272 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -166.68 -63.74 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.574 1.171 . . . . 72.0 109.247 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.551 ' OD1' ' CE2' ' A' ' 104' ' ' PHE . 22.4 t70 -46.55 -46.46 19.38 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.55 1.156 . . . . 74.3 109.297 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.576 ' CZ ' HG11 ' A' ' 206' ' ' VAL . 0.4 OUTLIER -116.26 -31.87 5.5 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.514 1.134 . . . . 75.44 110.96 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.444 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 100.73 44.63 2.07 Favored Glycine 0 CA--C 1.531 1.049 0 O-C-N 124.519 1.137 . . . . 74.13 110.986 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.495 ' CG2' ' NZ ' ' A' ' 80' ' ' LYS . 6.1 mm -84.95 70.11 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.556 0.798 . . . . 74.22 109.308 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.508 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -120.92 155.48 57.52 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.468 1.105 . . . . 74.43 109.272 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.552 ' HD3' ' CE2' ' A' ' 78' ' ' PHE . 18.1 Cg_endo -74.97 160.76 96.07 Favored 'Cis proline' 0 C--N 1.36 1.176 0 C-N-CA 120.927 -2.53 . . . . 74.14 111.022 -0.052 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -136.56 137.11 8.81 Favored Glycine 0 CA--C 1.53 0.985 0 O-C-N 124.498 1.124 . . . . 65.41 111.028 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 2.5 tt -148.2 152.09 12.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.529 0.782 . . . . 73.55 109.263 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 40.9 pt -101.22 167.33 2.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.426 1.079 . . . . 72.33 109.31 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.572 ' CD1' HD22 ' A' ' 84' ' ' LEU . 2.7 t80 -66.88 -19.24 65.7 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.481 1.113 . . . . 63.24 111.0 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -90.69 -6.64 54.23 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.552 1.157 . . . . 73.11 109.324 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -110.64 -5.91 14.95 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.495 1.122 . . . . 72.3 110.3 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.474 ' HE1' ' CG2' ' A' ' 82' ' ' VAL . 10.8 ttm -61.4 110.94 3.54 Favored Pre-proline 0 C--N 1.325 -0.457 0 O-C-N 124.456 1.097 . . . . 74.43 110.958 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 C--N 1.359 1.128 0 O-C-N 124.497 1.788 . . . . 52.24 111.0 179.958 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.453 ' CD1' HD23 ' A' ' 157' ' ' LEU . 4.2 pp . . . . . 0 N--CA 1.453 -0.313 0 N-CA-C 109.303 -0.628 . . . . 74.42 109.303 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.44 ' O ' ' N ' ' A' ' 129' ' ' VAL . 11.9 p-10 -63.85 -42.34 97.61 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.494 1.121 . . . . 70.03 109.313 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -48.98 -32.92 9.98 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.509 1.131 . . . . 74.04 109.307 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.459 ' CB ' HG11 ' A' ' 82' ' ' VAL . . . -68.44 -36.2 78.7 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.522 1.138 . . . . 72.32 109.311 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.494 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 53.9 t -89.12 14.2 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.478 1.111 . . . . 75.04 109.29 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -129.27 120.84 26.39 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.544 1.153 . . . . 71.15 109.265 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 88.2 -20.12 31.41 Favored Glycine 0 CA--C 1.53 0.973 0 O-C-N 124.506 1.129 . . . . 74.25 110.994 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 39.2 m -87.95 151.67 22.63 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.522 0.777 . . . . 62.43 110.027 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . 0.536 ' O ' ' CG ' ' A' ' 134' ' ' TRP . . . -94.44 -9.69 34.76 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.454 1.096 . . . . 73.21 109.308 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.578 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 9.7 m-90 -161.91 173.7 14.14 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.524 1.14 . . . . 74.24 107.981 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 82' ' ' VAL . 11.8 p -153.29 131.26 11.76 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 124.528 1.143 . . . . 75.55 110.436 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.447 ' CG1' HG13 ' A' ' 83' ' ' ILE . 21.5 mm -93.21 134.62 30.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 124.552 1.158 . . . . 64.01 109.292 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 5.2 mt -113.64 85.49 2.21 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.499 1.124 . . . . 72.04 109.263 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.593 ' O ' ' CD1' ' A' ' 143' ' ' PHE . 1.8 tp -62.65 90.14 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.575 1.172 . . . . 74.32 109.33 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.409 HD11 ' CD1' ' A' ' 189' ' ' LEU . 0.7 OUTLIER -70.44 116.69 11.06 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.541 1.15 . . . . 55.24 109.272 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' THR . . . . . 0.456 ' HB ' ' CB ' ' A' ' 143' ' ' PHE . 6.8 m -139.22 157.87 45.17 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.43 1.082 . . . . 75.44 110.352 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -50.24 -40.96 49.23 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.477 1.111 . . . . 71.3 110.271 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -89.27 -52.18 5.19 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.509 1.13 . . . . 73.15 109.337 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.608 ' CE1' ' CG2' ' A' ' 147' ' ' THR . 29.0 t80 -52.18 -20.16 2.42 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.483 1.114 . . . . 75.31 111.018 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.467 ' C ' ' CD1' ' A' ' 144' ' ' LEU . 1.9 tm? -72.14 -67.54 0.53 Allowed 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.518 1.136 . . . . 75.24 109.282 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.445 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 25.4 mmm180 -52.75 -23.1 6.11 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.59 1.181 . . . . 74.42 110.302 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -75.69 -73.11 0.28 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.521 1.138 . . . . 65.53 109.265 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.608 ' CG2' ' CE1' ' A' ' 143' ' ' PHE . 47.2 p -57.42 -56.18 25.24 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.428 1.08 . . . . 64.14 110.403 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.493 ' CH2' ' HB3' ' A' ' 186' ' ' PRO . 4.6 t-105 -43.9 -42.2 5.67 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.558 1.161 . . . . 73.41 108.01 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' CYS . . . . . 0.445 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 12.6 t -67.88 -45.4 74.58 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.486 1.116 . . . . 51.4 108.279 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' ASN . . . . . 0.454 ' N ' ' O ' ' A' ' 147' ' ' THR . 34.2 m-20 -52.23 -61.96 1.94 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.5 1.125 . . . . 75.3 109.309 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.686 ' CE1' ' CD1' ' A' ' 157' ' ' LEU . 9.8 m-30 -38.46 -45.88 1.09 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.437 1.086 . . . . 74.13 110.971 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.27 -48.84 45.66 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.544 1.153 . . . . 65.42 110.31 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -88.06 -11.72 46.34 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.538 1.148 . . . . 73.53 111.041 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.4 ' N ' ' O ' ' A' ' 150' ' ' ASN . 3.2 m-30 -116.67 77.36 1.1 Allowed 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.437 1.086 . . . . 74.44 110.995 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' THR . . . . . 0.444 ' O ' ' ND2' ' A' ' 159' ' ' ASN . 1.1 t -61.82 -13.41 23.71 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.538 1.149 . . . . 73.32 110.448 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 13.1 m -71.53 -32.26 67.96 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.461 1.1 . . . . 74.34 110.017 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.686 ' CD1' ' CE1' ' A' ' 151' ' ' PHE . 0.4 OUTLIER -74.1 -47.21 37.86 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.566 1.166 . . . . 75.4 109.322 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' MET . . . . . 0.426 ' CE ' HG23 ' A' ' 161' ' ' VAL . 1.9 tpt -48.76 -23.01 0.91 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.485 1.115 . . . . 74.42 111.083 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' ASN . . . . . 0.513 ' N ' HD21 ' A' ' 159' ' ' ASN . 1.5 m-80 -77.84 -42.79 32.41 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.528 1.143 . . . . 71.25 109.271 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.16 -22.79 67.1 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.484 1.115 . . . . 74.03 110.011 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . 0.426 HG23 ' CE ' ' A' ' 158' ' ' MET . 41.9 t -57.41 -17.87 7.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.489 1.118 . . . . 74.23 109.315 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -90.96 21.5 4.16 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.621 1.201 . . . . 74.42 109.288 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.483 ' CD ' ' O ' ' A' ' 170' ' ' VAL . 0.0 OUTLIER 46.6 37.12 4.16 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.5 1.125 . . . . 75.03 110.327 -179.94 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' A' ' 163' ' ' ARG . 5.0 mt-30 -38.3 131.31 1.19 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.483 1.114 . . . . 73.23 110.295 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 12.6 m170 -90.1 57.4 3.76 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.518 1.136 . . . . 75.51 109.587 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . 0.603 ' O ' ' CD1' ' A' ' 167' ' ' TYR . 0.0 OUTLIER -118.25 89.7 3.18 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.534 1.146 . . . . 73.31 109.24 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 167' ' ' TYR . . . . . 0.603 ' CD1' ' O ' ' A' ' 166' ' ' LYS . 12.7 p90 36.61 32.98 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.571 1.17 . . . . 75.2 111.047 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . 0.439 ' ND2' ' O ' ' A' ' 129' ' ' VAL . 27.0 p30 178.48 156.97 0.45 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.548 1.155 . . . . 75.02 109.277 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 169' ' ' SER . . . . . 0.402 ' O ' ' OG1' ' A' ' 135' ' ' THR . 0.4 OUTLIER -140.05 176.99 8.29 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.494 1.121 . . . . 71.14 109.969 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.483 ' O ' ' CD ' ' A' ' 163' ' ' ARG . 65.3 t -131.34 120.57 46.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.563 1.164 . . . . 72.55 109.272 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.3 mp -136.37 105.42 9.31 Favored Pre-proline 0 C--N 1.325 -0.468 0 O-C-N 124.497 1.123 . . . . 70.42 109.359 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . 0.509 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.5 Cg_endo -74.95 112.96 3.68 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.507 1.793 . . . . 72.33 111.041 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 5.7 ttt -89.16 160.67 16.87 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.576 1.173 . . . . 74.4 110.96 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.48 119.05 27.35 Favored Pre-proline 0 C--N 1.325 -0.48 0 O-C-N 124.531 1.144 . . . . 74.33 110.296 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.05 155.05 42.68 Favored 'Trans proline' 0 C--N 1.36 1.142 0 O-C-N 124.5 1.79 . . . . 71.11 110.983 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . 0.508 ' CD2' ' CG ' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -98.18 -36.87 9.91 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.584 1.177 . . . . 75.12 109.319 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . 0.533 HD21 ' N ' ' A' ' 177' ' ' ASN . 1.1 m-80 -72.68 -23.02 60.83 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.504 1.127 . . . . 53.2 109.278 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -110.35 113.09 56.61 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.409 1.068 . . . . 71.1 109.292 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.05 115.02 4.16 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.536 1.808 . . . . 63.14 110.958 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . 0.461 HD23 ' CB ' ' A' ' 184' ' ' ARG . 0.8 OUTLIER -132.86 96.62 17.88 Favored Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.537 1.148 . . . . 71.22 109.342 179.939 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.98 164.21 33.83 Favored 'Trans proline' 0 C--N 1.361 1.203 0 O-C-N 124.455 1.766 . . . . 52.22 111.025 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . 0.425 ' HG3' ' N ' ' A' ' 183' ' ' GLU . 0.7 OUTLIER -51.88 -35.16 44.16 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.446 1.091 . . . . 74.42 110.329 -179.985 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . 0.425 ' N ' ' HG3' ' A' ' 182' ' ' ARG . 4.7 pt-20 -56.8 -32.01 65.25 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.54 1.15 . . . . 55.14 110.324 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 184' ' ' ARG . . . . . 0.461 ' CB ' HD23 ' A' ' 180' ' ' LEU . 5.7 mmp_? -87.96 -28.6 21.37 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.476 1.11 . . . . 75.54 110.236 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 185' ' ' THR . . . . . 0.412 ' HA ' ' HD3' ' A' ' 186' ' ' PRO . 21.2 m -77.27 144.03 70.3 Favored Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.477 1.111 . . . . 75.23 110.454 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 186' ' ' PRO . . . . . 0.493 ' HB3' ' CH2' ' A' ' 148' ' ' TRP . 18.3 Cg_endo -74.93 152.33 41.0 Favored 'Trans proline' 0 C--N 1.36 1.167 0 O-C-N 124.508 1.793 . . . . 64.2 111.02 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 187' ' ' PHE . . . . . 0.483 ' O ' ' CG2' ' A' ' 191' ' ' THR . 13.2 p90 -68.22 -6.79 25.48 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.517 1.135 . . . . 72.41 111.0 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.75 -53.84 3.86 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.528 1.143 . . . . 72.04 109.267 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.477 ' CD2' ' HG3' ' A' ' 172' ' ' PRO . 49.3 mt -68.5 -42.21 78.91 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.455 1.097 . . . . 74.01 109.306 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -63.31 -11.5 22.52 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.5 1.125 . . . . 74.24 110.293 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 191' ' ' THR . . . . . 0.483 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 32.5 p -112.67 2.4 16.1 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.49 1.118 . . . . 74.12 110.353 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.49 ' CG2' ' N ' ' A' ' 193' ' ' ASN . 30.9 mt -105.31 163.36 4.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.461 1.101 . . . . 74.32 109.36 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 193' ' ' ASN . . . . . 0.49 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 22.7 p30 -66.8 74.78 0.11 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.507 1.129 . . . . 74.01 109.301 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . 0.509 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -70.04 156.36 39.27 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.557 1.16 . . . . 74.04 109.342 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 195' ' ' LEU . . . . . 0.463 HD23 ' CD1' ' A' ' 209' ' ' ILE . 0.3 OUTLIER -95.83 127.58 41.98 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.474 1.109 . . . . 75.51 109.256 -179.967 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . 0.402 ' HB3' ' CB ' ' A' ' 199' ' ' SER . 45.3 mt-10 -108.42 130.42 55.24 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.543 1.152 . . . . 73.41 110.292 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . 0.508 ' CG ' ' CD2' ' A' ' 176' ' ' LEU . 25.2 tp10 -100.53 -23.14 14.77 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.509 1.131 . . . . 72.52 110.305 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . 0.424 ' N ' HD12 ' A' ' 176' ' ' LEU . 0.4 OUTLIER -104.95 15.33 27.91 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.527 1.142 . . . . 74.41 110.292 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 199' ' ' SER . . . . . 0.402 ' CB ' ' HB3' ' A' ' 196' ' ' GLU . 40.2 t -104.54 139.78 38.94 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.437 1.086 . . . . 73.22 110.023 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 21.5 ttp180 -59.47 -15.34 16.86 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.538 1.149 . . . . 75.32 110.315 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -102.89 17.61 52.15 Favored Glycine 0 CA--C 1.531 1.047 0 O-C-N 124.543 1.152 . . . . 72.2 110.928 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 202' ' ' PHE . . . . . 0.601 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 0.1 OUTLIER -54.16 -44.49 98.58 Favored Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.535 0.785 . . . . 65.21 111.019 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 203' ' ' PRO . . . . . 0.601 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.2 Cg_endo -74.99 -34.98 3.42 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.542 1.811 . . . . 75.21 110.994 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.98 -51.03 70.86 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.538 1.149 . . . . 61.35 110.411 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 205' ' ' GLN . . . . . 0.401 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 6.2 mt-30 -69.53 -33.04 72.23 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.495 1.122 . . . . 71.51 110.3 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 206' ' ' VAL . . . . . 0.576 HG11 ' CZ ' ' A' ' 104' ' ' PHE . 50.5 t -70.28 -29.68 40.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.564 1.165 . . . . 61.12 109.287 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 207' ' ' GLU . . . . . 0.504 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 3.9 mt-10 -77.92 -36.67 49.16 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.544 1.152 . . . . 74.11 110.335 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -78.79 -62.93 1.54 Allowed 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.459 1.099 . . . . 72.24 110.279 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 209' ' ' ILE . . . . . 0.559 HG22 ' CD1' ' A' ' 210' ' ' PHE . 81.3 mt -47.83 -61.13 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.443 1.09 . . . . 73.44 109.325 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 210' ' ' PHE . . . . . 0.578 ' HA ' ' CH2' ' A' ' 134' ' ' TRP . 3.9 m-85 -97.42 67.36 2.09 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.519 1.137 . . . . 75.34 111.012 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 211' ' ' GLN . . . . . 0.504 ' CB ' ' O ' ' A' ' 207' ' ' GLU . 0.0 OUTLIER -110.98 141.09 44.92 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.502 1.126 . . . . 75.34 110.372 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . 0.454 ' O ' ' N ' ' A' ' 215' ' ' TYR . 25.6 tt0 -51.97 -51.52 56.63 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.528 1.142 . . . . 74.45 110.255 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.42 -23.16 0.85 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.443 1.09 . . . . 75.53 109.943 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.413 ' O ' ' NE2' ' A' ' 218' ' ' GLN . 17.4 t -95.47 -30.19 4.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 O-C-N 124.603 1.189 . . . . 73.03 109.301 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 215' ' ' TYR . . . . . 0.454 ' N ' ' O ' ' A' ' 212' ' ' GLU . 13.7 t80 -64.64 -20.37 66.25 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.586 1.178 . . . . 74.32 111.025 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 4.8 mmpt? -69.37 -54.88 12.27 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.468 1.105 . . . . 72.3 109.305 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 217' ' ' THR . . . . . 0.434 ' CG2' HD11 ' A' ' 221' ' ' ILE . 2.2 m -49.13 -67.52 0.26 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.506 1.129 . . . . 74.24 110.409 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 218' ' ' GLN . . . . . 0.488 ' HA ' ' CD1' ' A' ' 221' ' ' ILE . 0.0 OUTLIER -50.32 -43.64 53.86 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.493 1.12 . . . . 75.34 110.252 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 219' ' ' GLN . . . . . 0.402 ' CB ' ' O ' ' A' ' 215' ' ' TYR . 38.2 tp60 -52.3 -37.87 56.92 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.505 1.128 . . . . 73.41 110.284 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 22.7 m -79.6 -35.17 40.0 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.429 1.081 . . . . 73.04 110.381 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 221' ' ' ILE . . . . . 0.488 ' CD1' ' HA ' ' A' ' 218' ' ' GLN . 10.9 mt -66.03 -27.24 40.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 O-C-N 124.443 1.09 . . . . 74.12 109.32 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 222' ' ' TRP . . . . . 0.444 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 24.1 t90 -89.11 -49.18 6.9 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.498 1.124 . . . . 75.44 107.991 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . 0.462 ' C ' ' CD ' ' A' ' 223' ' ' LYS . 0.0 OUTLIER -60.47 -16.77 39.91 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.532 1.145 . . . . 74.51 109.283 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 . . . . . 0 C--N 1.324 -0.504 0 O-C-N 124.554 1.159 . . . . 61.13 110.309 -179.996 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.427 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 5.3 p . . . . . 0 N--CA 1.454 -0.249 0 N-CA-C 109.303 -0.628 . . . . 74.42 109.303 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.519 ' CE2' ' OH ' ' A' ' 215' ' ' TYR . 5.6 t80 -88.68 24.82 1.89 Allowed 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.481 1.113 . . . . 74.33 111.004 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.407 ' C ' ' O ' ' A' ' 78' ' ' PHE . 3.2 tp -39.5 143.14 0.23 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.486 1.116 . . . . 74.41 109.269 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.501 ' O ' ' CB ' ' A' ' 133' ' ' ALA . 8.2 ttmt -79.03 -62.3 1.74 Allowed 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.522 1.139 . . . . 62.43 109.249 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.607 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -165.47 140.09 4.87 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.563 1.164 . . . . 75.14 110.979 179.97 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.468 ' CG2' ' HE3' ' A' ' 115' ' ' MET . 7.5 p -90.69 167.49 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 O-C-N 124.428 1.08 . . . . 65.23 109.313 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.496 HD13 ' CZ ' ' A' ' 81' ' ' PHE . 3.8 mp -132.64 92.0 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.47 1.106 . . . . 72.03 109.33 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.465 ' CD1' ' HB3' ' A' ' 128' ' ' ALA . 5.9 mp -70.16 113.22 7.13 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.454 1.096 . . . . 73.32 109.304 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.568 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -128.44 174.39 9.39 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.465 1.103 . . . . 74.1 109.661 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -113.24 162.47 15.98 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.538 1.149 . . . . 72.53 109.309 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -64.31 -11.33 31.02 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.541 1.151 . . . . 61.01 110.374 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -81.68 -45.95 15.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.482 1.114 . . . . 74.44 109.284 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -124.58 44.21 2.82 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.441 1.088 . . . . 64.02 109.265 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.568 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -75.54 -33.89 60.71 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.456 1.098 . . . . 75.3 110.383 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -79.01 -17.21 55.75 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.537 1.148 . . . . 74.15 109.354 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -79.39 -54.04 6.32 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.548 1.155 . . . . 72.4 110.302 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.46 ' CB ' HD21 ' A' ' 138' ' ' LEU . . . -65.16 -19.75 66.12 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.473 1.108 . . . . 73.41 109.251 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.96 -51.89 5.57 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.573 1.17 . . . . 71.04 109.264 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -45.27 -33.32 2.33 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.514 1.133 . . . . 72.52 110.334 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.466 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 10.7 p -82.77 -55.89 6.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.516 1.135 . . . . 74.43 109.295 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.466 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -48.24 -22.12 0.61 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.466 1.104 . . . . 73.23 110.339 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -77.21 -38.61 51.03 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.466 1.104 . . . . 74.24 109.334 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.488 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -83.08 -21.99 33.57 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.473 1.108 . . . . 72.52 109.263 -179.98 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.442 ' N ' HD22 ' A' ' 99' ' ' LEU . 71.9 mt -63.44 -51.51 65.37 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.529 1.143 . . . . 64.02 109.276 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -77.5 54.79 1.21 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.487 1.117 . . . . 74.44 110.306 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -176.3 -67.05 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.482 1.114 . . . . 70.04 109.321 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -43.57 -54.09 5.17 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.462 1.101 . . . . 53.0 109.276 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.417 ' CZ ' ' HB3' ' A' ' 203' ' ' PRO . 6.4 m-85 -107.96 -31.2 8.08 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.507 1.13 . . . . 72.41 110.992 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 104.78 41.98 1.9 Allowed Glycine 0 CA--C 1.531 1.048 0 O-C-N 124.482 1.114 . . . . 71.34 110.996 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.556 HG23 ' CE1' ' A' ' 81' ' ' PHE . 11.1 mm -82.97 79.69 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.555 0.797 . . . . 75.04 109.295 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.505 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -131.76 156.39 80.18 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.522 1.139 . . . . 74.24 109.321 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.505 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.0 160.1 97.05 Favored 'Cis proline' 0 C--N 1.36 1.168 0 C-N-CA 120.981 -2.508 . . . . 74.34 110.994 -0.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -122.7 141.48 14.03 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.466 1.104 . . . . 71.52 111.046 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -158.72 130.16 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.5 0.765 . . . . 75.15 109.275 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . 0.422 HD11 ' NE2' ' A' ' 85' ' ' HIS . 1.9 pt -96.67 156.88 3.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.571 1.169 . . . . 73.45 109.291 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -54.65 -19.17 5.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.491 1.12 . . . . 65.35 110.998 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.525 ' HB1' ' CE1' ' A' ' 85' ' ' HIS . . . -76.26 -51.58 11.74 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.541 1.15 . . . . 53.35 109.356 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -71.02 -25.93 62.89 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.425 1.078 . . . . 73.14 110.319 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.468 ' HE3' ' CG2' ' A' ' 82' ' ' VAL . 34.8 tpp -38.12 111.03 0.57 Allowed Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.508 1.13 . . . . 73.14 110.974 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 C--N 1.36 1.157 0 O-C-N 124.483 1.781 . . . . 64.52 111.048 179.933 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.1 pt? . . . . . 0 N--CA 1.453 -0.276 0 N-CA-C 109.242 -0.651 . . . . 63.24 109.242 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.9 -40.06 72.49 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.55 1.157 . . . . 75.33 109.265 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -43.9 -54.53 5.24 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.548 1.155 . . . . 75.53 109.302 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.465 ' HB3' ' CD1' ' A' ' 84' ' ' LEU . . . -60.5 -36.03 77.37 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.53 1.144 . . . . 70.23 109.293 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.456 HG22 ' CD2' ' A' ' 157' ' ' LEU . 3.4 t -73.31 -5.5 6.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.526 1.141 . . . . 73.31 109.276 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -109.59 119.81 40.55 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.473 1.108 . . . . 72.42 109.268 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 78.77 63.49 2.09 Favored Glycine 0 CA--C 1.529 0.951 0 O-C-N 124.436 1.085 . . . . 63.25 111.033 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 50.9 p -163.52 155.94 17.94 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.45 0.735 . . . . 42.23 110.073 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . 0.553 ' O ' ' CG ' ' A' ' 134' ' ' TRP . . . -94.92 -22.31 18.07 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.497 1.123 . . . . 73.34 109.336 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.584 ' CZ2' ' HA ' ' A' ' 210' ' ' PHE . 16.1 m-90 -161.07 154.87 22.27 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.492 1.12 . . . . 71.53 108.041 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' THR . . . . . 0.438 ' CG2' ' CG1' ' A' ' 82' ' ' VAL . 1.8 p -140.55 122.3 15.36 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.551 1.157 . . . . 75.35 110.391 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.458 ' CG2' HG21 ' A' ' 83' ' ' ILE . 0.9 OUTLIER -84.08 142.09 13.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.542 1.151 . . . . 74.24 109.23 -179.936 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 47.7 mt -130.06 98.88 4.88 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.535 1.147 . . . . 72.13 109.378 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.473 HD21 ' CB ' ' A' ' 85' ' ' HIS . 0.1 OUTLIER -62.46 102.23 0.3 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.571 1.169 . . . . 73.51 109.307 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.466 ' CD2' HG22 ' A' ' 185' ' ' THR . 0.2 OUTLIER -68.56 99.13 0.94 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.474 1.109 . . . . 75.51 109.269 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' THR . . . . . 0.447 ' O ' ' N ' ' A' ' 144' ' ' LEU . 2.4 m -125.34 141.55 52.01 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.582 1.176 . . . . 74.14 110.394 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . 0.44 ' HB3' ' CD2' ' A' ' 180' ' ' LEU . 0.1 OUTLIER -47.41 -46.18 26.11 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.512 1.132 . . . . 73.33 110.307 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . 0.453 ' OD1' ' N ' ' A' ' 143' ' ' PHE . 11.2 p30 -73.04 -47.57 43.6 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.562 1.164 . . . . 71.43 109.331 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.612 ' CZ ' ' CG2' ' A' ' 147' ' ' THR . 76.9 t80 -60.24 -19.37 54.26 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.44 1.087 . . . . 72.54 110.997 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.468 ' C ' ' CD1' ' A' ' 144' ' ' LEU . 2.0 tm? -66.83 -67.54 0.44 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.515 1.134 . . . . 73.35 109.319 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.447 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 30.3 mmt180 -50.95 -21.51 1.78 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.534 1.146 . . . . 75.42 110.276 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 92.7 m-20 -78.36 -72.33 0.38 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.442 1.089 . . . . 74.15 109.283 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.612 ' CG2' ' CZ ' ' A' ' 143' ' ' PHE . 20.6 p -58.64 -56.0 27.76 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.489 1.118 . . . . 73.44 110.394 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -43.48 -56.65 3.51 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.98 -1.119 . . . . 75.01 107.98 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' CYS . . . . . 0.447 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 42.6 t -58.86 -37.88 77.51 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.446 1.091 . . . . 74.13 108.261 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' ASN . . . . . 0.453 ' N ' ' O ' ' A' ' 147' ' ' THR . 14.5 t-20 -63.5 -27.6 69.38 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.47 1.106 . . . . 72.45 109.3 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.657 ' CZ ' ' CD1' ' A' ' 157' ' ' LEU . 10.1 m-30 -87.15 -13.3 44.46 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.452 1.095 . . . . 72.41 110.978 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -75.46 -35.76 60.83 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.541 1.151 . . . . 71.1 110.293 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.594 ' CD1' ' C ' ' A' ' 153' ' ' PHE . 0.8 OUTLIER -94.08 -21.4 19.15 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.489 1.118 . . . . 74.1 111.017 -179.989 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -115.24 109.74 18.41 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.519 1.137 . . . . 73.33 111.043 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' THR . . . . . 0.44 ' O ' ' ND2' ' A' ' 159' ' ' ASN . 1.2 t -85.81 -5.98 59.17 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.573 1.17 . . . . 72.45 110.369 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 1.6 t -72.52 -31.89 65.69 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.543 1.152 . . . . 73.15 110.051 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.657 ' CD1' ' CZ ' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -85.46 -25.87 26.65 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.471 1.107 . . . . 73.03 109.291 179.984 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' MET . . . . . 0.467 ' HE2' ' CG2' ' A' ' 161' ' ' VAL . 7.0 mmt -67.64 -25.61 65.82 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.445 1.091 . . . . 74.45 110.978 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' ASN . . . . . 0.633 ' N ' HD21 ' A' ' 159' ' ' ASN . 0.9 OUTLIER -78.08 -15.81 58.57 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.475 1.11 . . . . 73.43 109.354 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' SER . . . . . 0.451 ' O ' ' NH1' ' A' ' 163' ' ' ARG . 0.5 OUTLIER -80.0 -43.08 22.61 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.521 1.138 . . . . 65.32 109.976 179.978 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . 0.467 ' CG2' ' HE2' ' A' ' 158' ' ' MET . 35.5 m -61.02 -17.02 15.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 O-C-N 124.447 1.092 . . . . 75.55 109.258 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -76.04 -0.8 23.04 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.509 1.13 . . . . 73.5 109.323 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.499 ' HA ' ' CZ ' ' A' ' 163' ' ' ARG . 2.6 mmp_? 51.35 58.64 5.3 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.472 1.108 . . . . 74.52 110.32 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -78.62 -163.54 0.47 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.51 1.131 . . . . 73.3 110.353 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -112.17 54.48 0.7 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.476 1.11 . . . . 73.43 109.552 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . 0.571 ' HG3' ' CD2' ' A' ' 167' ' ' TYR . 3.5 tptt -97.72 164.46 12.39 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.476 1.11 . . . . 63.54 109.309 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 167' ' ' TYR . . . . . 0.581 ' CD1' ' N ' ' A' ' 168' ' ' ASN . 40.0 p90 -58.09 -48.22 80.83 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.46 1.1 . . . . 74.2 110.983 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . 0.581 ' N ' ' CD1' ' A' ' 167' ' ' TYR . 7.8 p30 -79.86 134.88 36.34 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.519 1.137 . . . . 64.12 109.264 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 169' ' ' SER . . . . . 0.574 ' HB3' ' CD1' ' A' ' 134' ' ' TRP . 47.0 t -113.06 132.3 55.47 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.463 1.102 . . . . 73.53 109.992 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.467 ' H ' ' NH2' ' A' ' 163' ' ' ARG . 9.6 t -99.48 133.98 40.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.494 1.121 . . . . 64.23 109.272 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . 0.457 ' CD1' ' O ' ' A' ' 170' ' ' VAL . 1.2 mp -140.52 108.05 6.61 Favored Pre-proline 0 C--N 1.326 -0.44 0 O-C-N 124.389 1.056 . . . . 72.54 109.361 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . 0.509 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -74.99 106.57 2.3 Favored 'Trans proline' 0 C--N 1.359 1.097 0 O-C-N 124.537 1.809 . . . . 74.21 111.012 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 6.7 ttt -89.21 156.41 18.79 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.579 1.175 . . . . 74.34 110.983 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 8.7 mmm-85 -114.94 121.62 35.02 Favored Pre-proline 0 C--N 1.324 -0.506 0 O-C-N 124.47 1.106 . . . . 74.13 110.284 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.01 159.94 40.71 Favored 'Trans proline' 0 C--N 1.359 1.114 0 O-C-N 124.516 1.798 . . . . 73.22 110.975 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . 0.496 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -104.21 -40.17 6.24 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.523 1.139 . . . . 73.12 109.278 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . 0.402 HD21 ' N ' ' A' ' 177' ' ' ASN . 1.3 m-80 -72.89 -23.76 60.76 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.543 1.152 . . . . 75.1 109.311 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -110.19 105.91 57.59 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.503 1.127 . . . . 75.11 109.34 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.92 115.67 4.36 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.466 1.772 . . . . 74.02 111.049 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . 0.469 HD22 ' CB ' ' A' ' 184' ' ' ARG . 2.1 tm? -139.12 101.67 7.61 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.432 1.083 . . . . 72.21 109.342 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.99 171.79 17.64 Favored 'Trans proline' 0 C--N 1.362 1.245 0 O-C-N 124.441 1.759 . . . . 74.22 110.993 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 3.5 ptp85 -59.53 -32.17 70.08 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.505 1.128 . . . . 64.22 110.299 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -48.47 -31.82 6.92 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.523 1.14 . . . . 62.4 110.279 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 184' ' ' ARG . . . . . 0.469 ' CB ' HD22 ' A' ' 180' ' ' LEU . 39.6 mmt180 -96.11 -22.38 17.36 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.507 1.129 . . . . 63.5 110.292 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 185' ' ' THR . . . . . 0.466 HG22 ' CD2' ' A' ' 139' ' ' LEU . 12.1 m -77.44 144.35 70.09 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.492 1.12 . . . . 75.24 110.424 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 186' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 185' ' ' THR . 18.2 Cg_endo -74.97 164.6 33.07 Favored 'Trans proline' 0 C--N 1.36 1.155 0 O-C-N 124.404 1.739 . . . . 60.24 110.989 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 187' ' ' PHE . . . . . 0.466 ' O ' ' CG2' ' A' ' 191' ' ' THR . 32.2 p90 -77.35 -6.92 55.07 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.596 1.185 . . . . 75.33 111.028 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -95.33 -51.29 4.65 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.434 1.084 . . . . 71.4 109.279 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 49.4 mt -68.39 -42.66 78.77 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.502 1.126 . . . . 74.24 109.257 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 190' ' ' GLN . . . . . 0.428 ' CG ' HG22 ' A' ' 191' ' ' THR . 2.0 pt20 -65.2 -9.68 25.4 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.505 1.128 . . . . 75.31 110.262 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 191' ' ' THR . . . . . 0.466 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 80.8 p -120.84 24.55 10.17 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.491 1.119 . . . . 73.32 110.403 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.496 ' CG2' ' N ' ' A' ' 193' ' ' ASN . 7.8 mt -123.41 163.32 22.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.499 1.125 . . . . 75.43 109.315 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 193' ' ' ASN . . . . . 0.496 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 2.4 m-20 -66.71 74.22 0.1 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.558 1.161 . . . . 70.44 109.284 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . 0.509 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -71.04 162.3 29.66 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.452 1.095 . . . . 73.55 109.3 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 195' ' ' LEU . . . . . 0.461 ' CD2' HD12 ' A' ' 209' ' ' ILE . 0.3 OUTLIER -106.72 149.32 27.41 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.478 1.111 . . . . 75.31 109.288 -179.967 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -142.94 142.07 31.59 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.477 1.111 . . . . 71.34 110.335 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . 0.471 ' HG3' ' CD2' ' A' ' 176' ' ' LEU . 3.4 pm0 -113.62 -28.67 7.4 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.464 1.103 . . . . 72.23 110.233 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? -77.39 0.7 21.47 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.488 1.118 . . . . 75.04 110.334 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 6.9 t -104.28 161.33 14.14 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.49 1.119 . . . . 71.22 110.042 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 22.0 ttt-85 -77.55 -26.14 50.7 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.458 1.099 . . . . 72.0 110.274 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -88.73 21.99 23.67 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.554 1.159 . . . . 42.03 110.98 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 202' ' ' PHE . . . . . 0.646 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 0.3 OUTLIER -61.18 -41.96 83.35 Favored Pre-proline 0 C--N 1.326 -0.438 0 O-C-N 124.458 0.74 . . . . 73.34 110.981 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 203' ' ' PRO . . . . . 0.646 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.6 Cg_endo -74.94 -37.43 2.08 Favored 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.494 1.786 . . . . 73.01 111.049 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.36 -50.98 61.3 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.558 1.161 . . . . 75.4 110.406 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 205' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 3.0 mt-30 -71.05 -40.15 71.83 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.559 1.162 . . . . 74.55 110.326 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 206' ' ' VAL . . . . . 0.523 ' CG2' ' O ' ' A' ' 202' ' ' PHE . 57.1 t -62.82 -26.64 41.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 O-C-N 124.586 1.179 . . . . 75.15 109.261 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -81.01 -49.93 10.32 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.482 1.114 . . . . 75.15 110.345 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 83.7 mtt-85 -67.46 -62.75 1.27 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.57 1.169 . . . . 75.51 110.293 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 209' ' ' ILE . . . . . 0.578 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 96.5 mt -45.61 -50.0 3.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.554 1.159 . . . . 71.14 109.325 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 210' ' ' PHE . . . . . 0.584 ' HA ' ' CZ2' ' A' ' 134' ' ' TRP . 1.5 m-85 -105.83 67.39 0.75 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.524 1.14 . . . . 71.11 111.01 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -111.04 142.95 42.51 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.485 1.116 . . . . 72.23 110.324 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . 0.448 ' CG ' ' HE3' ' A' ' 216' ' ' LYS . 7.1 tt0 -49.06 -54.42 16.01 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.498 1.124 . . . . 65.12 110.324 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.01 -25.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.499 1.125 . . . . 51.3 109.993 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 42.5 t -96.1 -28.45 3.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.487 1.117 . . . . 72.3 109.279 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 215' ' ' TYR . . . . . 0.519 ' OH ' ' CE2' ' A' ' 78' ' ' PHE . 32.0 t80 -64.69 -30.77 71.79 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.522 1.139 . . . . 74.12 111.051 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . 0.448 ' HE3' ' CG ' ' A' ' 212' ' ' GLU . 12.7 mttp -63.11 -66.32 0.56 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.565 1.166 . . . . 73.42 109.323 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 86.9 m -41.01 -55.26 2.59 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.502 1.126 . . . . 74.45 110.362 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 218' ' ' GLN . . . . . 0.453 ' O ' ' N ' ' A' ' 221' ' ' ILE . 18.6 mm-40 -57.15 -67.2 0.34 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.496 1.122 . . . . 75.32 110.321 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 37.8 tp60 -44.05 -27.36 0.37 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.539 1.15 . . . . 74.23 110.385 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 4.4 m -81.2 -41.01 22.96 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.503 1.127 . . . . 74.12 110.392 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 221' ' ' ILE . . . . . 0.453 ' N ' ' O ' ' A' ' 218' ' ' GLN . 14.5 mt -66.56 -31.26 52.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.439 1.087 . . . . 75.42 109.215 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 222' ' ' TRP . . . . . 0.427 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 28.9 t90 -69.57 -61.46 1.78 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.549 1.156 . . . . 74.5 107.968 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.05 -20.48 6.51 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.564 1.165 . . . . 74.4 109.275 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 . . . . . 0 C--N 1.325 -0.499 0 O-C-N 124.518 1.136 . . . . 73.51 110.344 179.94 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.54 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.7 p . . . . . 0 N--CA 1.453 -0.281 0 N-CA-C 109.288 -0.634 . . . . 73.51 109.288 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.402 ' O ' ' C ' ' A' ' 79' ' ' LEU . 8.3 m-85 -88.84 25.21 1.83 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.494 1.121 . . . . 74.43 111.007 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.402 ' C ' ' O ' ' A' ' 78' ' ' PHE . 6.1 tp -40.07 158.51 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.553 1.158 . . . . 73.34 109.317 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.409 ' NZ ' ' HA ' ' A' ' 106' ' ' ILE . 11.4 ptmt -111.76 -47.68 3.13 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.458 1.099 . . . . 71.21 109.338 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.614 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.1 OUTLIER -166.48 151.3 7.84 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.567 1.167 . . . . 75.43 110.936 -179.972 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.456 HG21 ' CE ' ' A' ' 115' ' ' MET . 3.9 p -104.86 167.78 2.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.451 1.095 . . . . 75.44 109.347 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.61 ' CD1' ' CZ ' ' A' ' 81' ' ' PHE . 2.3 mp -126.49 105.03 13.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 O-C-N 124.525 1.14 . . . . 63.31 109.412 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.458 HD23 ' CD1' ' A' ' 112' ' ' PHE . 5.3 mt -70.22 133.27 46.88 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.464 1.102 . . . . 53.31 109.259 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.57 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -156.61 174.45 15.43 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.519 1.137 . . . . 72.45 109.568 179.972 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.432 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -119.2 164.92 14.88 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.514 1.133 . . . . 73.22 109.307 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -54.46 -35.12 62.69 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 124.478 1.111 . . . . 73.31 110.267 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -69.28 -46.33 67.46 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.554 1.159 . . . . 65.41 109.281 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.455 ' O ' ' CD2' ' A' ' 138' ' ' LEU . 2.1 m-20 -108.02 44.43 1.1 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.464 1.103 . . . . 74.04 109.33 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.57 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -80.42 -51.59 8.65 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.47 1.106 . . . . 74.14 110.39 -179.962 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.04 -32.88 74.59 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.479 1.112 . . . . 73.22 109.289 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.404 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 4.5 tp10 -58.61 -67.8 0.32 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.498 1.124 . . . . 71.41 110.288 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.482 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -47.71 -29.66 3.23 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.495 1.122 . . . . 72.31 109.302 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 tt -69.9 -49.62 50.4 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.506 1.128 . . . . 75.41 109.332 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -47.19 -33.15 5.03 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.474 1.109 . . . . 73.34 110.326 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.444 ' CG2' ' OE1' ' A' ' 197' ' ' GLU . 1.8 t -79.31 -64.69 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.531 1.145 . . . . 73.55 109.224 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.437 ' N ' HG11 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -45.08 -22.48 0.1 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.489 1.118 . . . . 74.12 110.353 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.435 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.0 OUTLIER -78.02 -59.91 2.59 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.541 1.151 . . . . 75.21 109.291 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.504 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -61.73 -21.55 64.61 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.509 1.131 . . . . 72.55 109.375 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.426 ' N ' HD21 ' A' ' 99' ' ' LEU . 22.6 mt -66.42 -52.61 44.73 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.521 1.138 . . . . 73.4 109.292 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . 0.409 ' O ' ' HG3' ' A' ' 101' ' ' GLN . 10.4 pt20 -81.0 49.86 1.3 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.485 1.116 . . . . 72.42 110.276 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -169.63 -65.79 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.498 1.124 . . . . 64.23 109.337 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -48.42 -48.13 37.38 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.455 1.097 . . . . 75.04 109.29 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.565 ' CE2' HG12 ' A' ' 206' ' ' VAL . 5.5 m-85 -115.94 -29.8 6.24 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.596 1.185 . . . . 74.45 111.018 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.43 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 95.21 45.83 2.95 Favored Glycine 0 CA--C 1.53 1.012 0 O-C-N 124.517 1.136 . . . . 73.32 110.95 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.409 ' HA ' ' NZ ' ' A' ' 80' ' ' LYS . 10.0 mm -81.29 68.12 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.452 0.736 . . . . 75.34 109.326 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.503 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -118.42 155.46 51.96 Favored Pre-proline 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 72.33 109.327 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.503 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.96 154.43 99.69 Favored 'Cis proline' 0 C--N 1.359 1.117 0 C-N-CA 120.925 -2.531 . . . . 72.31 111.049 -0.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -135.2 142.99 14.49 Favored Glycine 0 CA--C 1.531 1.038 0 O-C-N 124.468 1.105 . . . . 72.54 110.957 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 3.3 tt -153.2 151.92 10.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.506 0.768 . . . . 75.41 109.269 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 21.3 pt -95.73 -178.14 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.445 1.091 . . . . 74.41 109.293 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.458 ' CD1' HD23 ' A' ' 84' ' ' LEU . 8.0 t80 -82.07 -19.21 40.7 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.488 1.118 . . . . 64.14 111.059 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.45 -4.37 51.41 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.425 1.078 . . . . 63.04 109.251 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -109.09 -12.22 14.85 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.502 1.126 . . . . 71.05 110.292 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.456 ' CE ' HG21 ' A' ' 82' ' ' VAL . 6.2 ttm -55.74 143.89 58.08 Favored Pre-proline 0 C--N 1.326 -0.439 0 O-C-N 124.465 1.103 . . . . 73.44 111.06 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 C--N 1.36 1.159 0 O-C-N 124.498 1.788 . . . . 72.03 110.964 -179.971 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 2.4 pp . . . . . 0 N--CA 1.452 -0.335 0 N-CA-C 109.249 -0.648 . . . . 72.11 109.249 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -62.81 -14.12 41.72 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 124.568 1.168 . . . . 74.1 109.295 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -55.54 -26.29 42.42 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.518 1.136 . . . . 73.21 109.366 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -93.91 -22.5 18.57 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.459 1.099 . . . . 72.23 109.324 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.493 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 25.4 t -82.8 5.17 2.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.5 1.125 . . . . 64.52 109.259 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 -143.55 118.54 10.02 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.579 1.175 . . . . 74.22 109.293 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 102.1 42.19 2.29 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.478 1.111 . . . . 30.35 111.032 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' SER . . . . . 0.451 ' CB ' ' HA ' ' A' ' 81' ' ' PHE . 0.2 OUTLIER -163.26 -177.03 5.11 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.513 0.772 . . . . 54.44 110.014 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . 0.647 ' CB ' ' CZ3' ' A' ' 134' ' ' TRP . . . -107.24 -25.86 11.31 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.536 1.148 . . . . 73.12 109.343 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.647 ' CZ3' ' CB ' ' A' ' 133' ' ' ALA . 4.2 m-90 -159.66 172.9 16.91 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.487 1.117 . . . . 74.54 108.035 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' THR . . . . . 0.491 ' O ' ' CD1' ' A' ' 137' ' ' LEU . 38.9 p -147.25 124.62 11.6 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.518 1.136 . . . . 75.32 110.421 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.405 ' O ' ' O ' ' A' ' 84' ' ' LEU . 1.1 mp -84.32 128.65 38.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.528 1.143 . . . . 72.54 109.353 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.532 ' CD1' ' N ' ' A' ' 137' ' ' LEU . 2.0 mp -110.96 101.69 10.23 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.508 1.13 . . . . 74.33 109.252 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.592 ' O ' ' CD1' ' A' ' 143' ' ' PHE . 0.1 OUTLIER -62.02 89.87 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.43 1.081 . . . . 73.52 109.306 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.422 ' CD2' HG21 ' A' ' 185' ' ' THR . 5.2 tp -63.04 99.99 0.19 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.472 1.107 . . . . 73.21 109.27 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 18.9 m -131.11 154.11 48.65 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.542 1.151 . . . . 74.22 110.397 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -52.71 -34.32 51.81 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.54 1.15 . . . . 72.12 110.304 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -89.39 -53.06 4.72 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.541 1.151 . . . . 73.45 109.324 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.592 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 58.7 t80 -55.16 -19.8 8.69 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.442 1.089 . . . . 71.11 110.982 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.502 ' O ' ' CB ' ' A' ' 148' ' ' TRP . 3.0 tm? -63.08 -67.83 0.39 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.52 1.138 . . . . 75.04 109.3 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.454 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 0.2 OUTLIER -62.7 -15.03 50.87 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.521 1.138 . . . . 72.04 110.255 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -64.21 -60.65 2.95 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.551 1.157 . . . . 65.41 109.246 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.552 ' OG1' ' CE1' ' A' ' 151' ' ' PHE . 1.0 OUTLIER -92.06 -47.03 7.48 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.523 1.139 . . . . 74.44 110.392 -179.946 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.504 ' CZ3' ' HE1' ' A' ' 158' ' ' MET . 30.2 t-105 -43.37 -35.72 1.65 Allowed 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.503 1.127 . . . . 75.34 108.017 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' CYS . . . . . 0.454 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 17.9 t -80.37 -45.01 18.45 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.479 1.112 . . . . 73.42 108.282 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' ASN . . . . . 0.427 ' N ' ' O ' ' A' ' 147' ' ' THR . 24.3 t-20 -60.7 -15.65 31.26 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.461 1.1 . . . . 74.23 109.317 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.56 ' CZ ' HD12 ' A' ' 157' ' ' LEU . 10.7 m-30 -82.41 -50.91 8.36 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.54 1.15 . . . . 75.21 110.951 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -46.26 -38.11 8.11 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.507 1.13 . . . . 73.42 110.385 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -77.66 -33.76 53.32 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.483 1.114 . . . . 72.4 110.957 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -116.41 91.32 3.55 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.468 1.105 . . . . 73.22 110.966 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.2 t -62.56 -13.03 26.52 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.5 1.125 . . . . 72.41 110.334 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 12.1 t -70.19 -18.64 63.19 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.461 1.1 . . . . 63.24 109.956 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.56 HD12 ' CZ ' ' A' ' 151' ' ' PHE . 0.2 OUTLIER -88.58 -36.02 16.57 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.523 1.139 . . . . 75.42 109.315 179.98 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' MET . . . . . 0.504 ' HE1' ' CZ3' ' A' ' 148' ' ' TRP . 2.2 mmt -68.67 -11.55 60.3 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.53 1.144 . . . . 65.05 110.989 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -77.58 -48.52 16.73 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.465 1.103 . . . . 75.33 109.317 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' SER . . . . . 0.471 ' HB3' ' CG2' ' A' ' 170' ' ' VAL . 0.4 OUTLIER -59.86 -24.88 64.59 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.495 1.122 . . . . 70.43 110.019 179.958 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . 0.487 ' O ' ' CD1' ' A' ' 192' ' ' ILE . 44.2 t -62.01 -18.03 18.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.513 1.133 . . . . 74.14 109.337 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' ASN . . . . . 0.421 ' HB3' ' NE2' ' A' ' 164' ' ' GLN . 4.0 t-20 -79.45 1.36 25.82 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.427 1.079 . . . . 71.32 109.271 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.487 ' NH1' ' ND2' ' A' ' 193' ' ' ASN . 17.6 mmm-85 63.33 62.97 0.93 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.449 1.093 . . . . 73.51 110.323 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . 0.54 HE21 ' N ' ' A' ' 164' ' ' GLN . 0.0 OUTLIER -60.1 -173.66 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 75.21 110.244 -179.973 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -124.54 24.72 7.8 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.572 1.17 . . . . 73.13 109.62 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -82.95 174.89 10.49 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.566 1.166 . . . . 74.22 109.284 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 167' ' ' TYR . . . . . 0.464 ' CA ' HG23 ' A' ' 221' ' ' ILE . 9.9 t80 -45.27 -65.47 0.53 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.53 1.144 . . . . 74.4 111.04 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . 0.402 ' CG ' ' O ' ' A' ' 129' ' ' VAL . 2.6 p30 -76.84 154.67 33.64 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.487 1.117 . . . . 63.32 109.316 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 43.2 m -140.23 168.09 20.63 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.479 1.112 . . . . 74.43 110.065 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.471 ' CG2' ' HB3' ' A' ' 160' ' ' SER . 73.0 t -122.72 130.96 74.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.546 1.154 . . . . 62.11 109.253 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . 0.464 ' CD1' ' O ' ' A' ' 170' ' ' VAL . 1.1 mp -142.34 110.74 5.9 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.52 1.138 . . . . 73.1 109.313 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . 0.508 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.0 Cg_endo -75.06 106.77 2.34 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.533 1.807 . . . . 75.43 110.939 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 173' ' ' MET . . . . . 0.407 ' HE2' ' CD1' ' A' ' 195' ' ' LEU . 5.1 ttt -87.37 155.69 19.92 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.515 1.135 . . . . 71.12 110.968 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . 0.423 ' NE ' ' HA ' ' A' ' 174' ' ' ARG . 0.0 OUTLIER -115.89 116.53 40.44 Favored Pre-proline 0 C--N 1.325 -0.46 0 O-C-N 124.49 1.119 . . . . 73.21 110.321 -179.966 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.04 160.12 40.41 Favored 'Trans proline' 0 C--N 1.359 1.109 0 O-C-N 124.492 1.786 . . . . 72.2 110.943 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . 0.554 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -95.25 -43.8 7.9 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.526 1.141 . . . . 73.42 109.257 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . 0.448 ' H ' ' ND2' ' A' ' 177' ' ' ASN . 1.9 p30 -72.77 -25.71 61.28 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.509 1.13 . . . . 60.33 109.25 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -110.26 102.38 51.05 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.52 1.138 . . . . 73.35 109.326 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.04 134.32 17.61 Favored 'Trans proline' 0 C--N 1.359 1.118 0 O-C-N 124.48 1.779 . . . . 75.23 110.969 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -141.18 97.18 6.98 Favored Pre-proline 0 C--N 1.326 -0.42 0 O-C-N 124.493 1.121 . . . . 61.52 109.3 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.02 165.8 30.52 Favored 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.495 1.787 . . . . 61.35 110.973 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . 0.416 ' HG3' ' N ' ' A' ' 183' ' ' GLU . 5.4 ptm180 -68.11 -22.33 64.9 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.54 1.15 . . . . 73.21 110.283 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' A' ' 182' ' ' ARG . 11.6 pt-20 -61.96 -14.5 35.45 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.53 1.144 . . . . 72.31 110.262 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -121.4 3.43 10.26 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.594 1.184 . . . . 74.44 110.313 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 185' ' ' THR . . . . . 0.422 HG21 ' CD2' ' A' ' 139' ' ' LEU . 10.5 m -100.42 144.13 27.87 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.476 1.11 . . . . 73.13 110.425 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 186' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 185' ' ' THR . 18.4 Cg_endo -74.95 164.38 33.52 Favored 'Trans proline' 0 C--N 1.36 1.179 0 O-C-N 124.522 1.801 . . . . 72.31 110.97 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 187' ' ' PHE . . . . . 0.495 ' O ' ' CG2' ' A' ' 191' ' ' THR . 5.7 p90 -77.01 -7.0 54.87 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.515 1.134 . . . . 74.44 110.996 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -95.03 -51.36 4.69 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.557 1.161 . . . . 74.53 109.252 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 51.9 mt -68.41 -42.55 78.82 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.555 1.159 . . . . 74.55 109.37 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 190' ' ' GLN . . . . . 0.4 ' CG ' HG21 ' A' ' 191' ' ' THR . 1.9 pt20 -65.3 -9.41 24.07 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.494 1.121 . . . . 74.23 110.241 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 191' ' ' THR . . . . . 0.495 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 67.7 p -119.32 17.95 13.0 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.472 1.107 . . . . 63.04 110.439 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.487 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 7.4 mt -112.97 157.36 13.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.552 1.157 . . . . 73.44 109.277 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 193' ' ' ASN . . . . . 0.487 ' ND2' ' NH1' ' A' ' 163' ' ' ARG . 46.2 p-10 -65.53 75.38 0.06 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.477 1.111 . . . . 72.54 109.324 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . 0.508 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -71.9 149.58 45.0 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.424 1.078 . . . . 74.31 109.292 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 195' ' ' LEU . . . . . 0.407 ' CD1' ' HE2' ' A' ' 173' ' ' MET . 0.5 OUTLIER -93.15 124.53 37.19 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.533 1.146 . . . . 75.43 109.291 -179.951 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -118.6 109.17 15.83 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.529 1.143 . . . . 72.21 110.287 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . 0.556 ' HA ' ' CD1' ' A' ' 202' ' ' PHE . 14.0 pt-20 -79.63 -34.03 40.93 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.453 1.095 . . . . 73.51 110.314 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . 0.466 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 11.7 pt-20 -79.62 2.43 22.51 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.49 1.119 . . . . 73.45 110.303 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 29.4 t -96.52 145.35 25.78 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.445 1.09 . . . . 62.44 110.063 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -57.55 -28.69 63.76 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.535 1.147 . . . . 72.44 110.371 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -93.59 23.44 30.41 Favored Glycine 0 CA--C 1.53 1.027 0 O-C-N 124.552 1.158 . . . . 75.33 111.03 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 202' ' ' PHE . . . . . 0.619 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 0.2 OUTLIER -59.04 -43.14 97.04 Favored Pre-proline 0 C--N 1.324 -0.534 0 O-C-N 124.567 0.804 . . . . 75.3 111.027 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 203' ' ' PRO . . . . . 0.619 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -75.03 -36.05 2.76 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.487 1.783 . . . . 71.03 110.971 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -57.87 -47.2 83.42 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.483 1.114 . . . . 70.14 110.36 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 205' ' ' GLN . . . . . 0.401 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 1.8 mt-30 -70.67 -40.04 73.19 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.495 1.122 . . . . 64.44 110.293 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 206' ' ' VAL . . . . . 0.565 HG12 ' CE2' ' A' ' 104' ' ' PHE . 89.7 t -66.85 -27.83 41.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.453 1.095 . . . . 74.45 109.273 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 207' ' ' GLU . . . . . 0.477 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 2.3 mt-10 -80.31 -51.72 8.56 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.494 1.121 . . . . 72.24 110.253 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 77.4 mtt180 -62.75 -57.92 9.26 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.518 1.136 . . . . 72.44 110.34 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 209' ' ' ILE . . . . . 0.628 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 65.5 mt -52.49 -53.82 18.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.485 1.116 . . . . 73.02 109.29 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 210' ' ' PHE . . . . . 0.628 ' CE1' ' CG2' ' A' ' 209' ' ' ILE . 1.1 m-85 -104.97 57.51 0.69 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.488 1.118 . . . . 74.44 110.959 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 211' ' ' GLN . . . . . 0.477 ' CB ' ' O ' ' A' ' 207' ' ' GLU . 0.0 OUTLIER -96.23 139.51 32.28 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.414 1.071 . . . . 53.43 110.291 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 215' ' ' TYR . 56.9 tt0 -49.98 -53.35 27.03 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.516 1.135 . . . . 74.01 110.309 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -47.1 -24.25 0.63 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.478 1.111 . . . . 74.2 110.013 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 34.6 t -95.9 -32.02 4.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.513 1.133 . . . . 73.21 109.261 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 215' ' ' TYR . . . . . 0.45 ' N ' ' O ' ' A' ' 212' ' ' GLU . 4.5 t80 -63.3 -36.41 83.6 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.512 1.133 . . . . 75.43 111.027 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt -50.4 -60.86 2.57 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.547 1.154 . . . . 72.23 109.289 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 1.3 m -51.98 -46.89 65.03 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.446 1.091 . . . . 73.21 110.443 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 11.0 mm-40 -49.11 -54.67 15.11 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.476 1.11 . . . . 71.01 110.265 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 21.8 tp60 -45.42 -52.81 9.59 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.514 1.134 . . . . 75.13 110.295 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -59.09 -44.87 91.96 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.483 1.115 . . . . 74.02 110.399 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 221' ' ' ILE . . . . . 0.468 ' HA ' ' CG ' ' A' ' 224' ' ' GLU . 17.4 mt -59.18 -27.31 36.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.536 1.148 . . . . 72.41 109.311 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 222' ' ' TRP . . . . . 0.54 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 21.2 t90 -89.41 -17.42 28.8 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.98 -1.119 . . . . 75.33 107.98 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 1.6 tmmm? -85.91 -29.73 23.41 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.457 1.098 . . . . 71.43 109.351 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . 0.468 ' CG ' ' HA ' ' A' ' 221' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.444 0 O-C-N 124.458 1.099 . . . . 72.41 110.262 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.505 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 2.9 p . . . . . 0 N--CA 1.454 -0.245 0 N-CA-C 109.307 -0.627 . . . . 72.34 109.307 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.498 ' CE2' ' HG3' ' A' ' 108' ' ' PRO . 51.4 p90 -89.72 30.95 0.98 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.448 1.092 . . . . 74.22 110.984 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.461 HD13 ' CG2' ' A' ' 110' ' ' ILE . 6.1 tp -39.91 134.81 1.39 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.553 1.158 . . . . 72.13 109.359 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.475 ' O ' ' CB ' ' A' ' 133' ' ' ALA . 9.1 ttmt -74.84 -67.07 0.67 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.589 1.181 . . . . 72.33 109.365 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.628 ' CZ ' ' CD1' ' A' ' 83' ' ' ILE . 1.5 p90 -152.16 140.68 20.69 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.384 1.052 . . . . 74.31 111.018 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.484 ' CG1' ' HB ' ' A' ' 135' ' ' THR . 8.6 p -84.07 171.59 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 O-C-N 124.48 1.112 . . . . 64.34 109.306 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.628 ' CD1' ' CZ ' ' A' ' 81' ' ' PHE . 2.8 mp -137.4 86.04 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.574 1.172 . . . . 73.54 109.224 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.57 HD23 ' CE1' ' A' ' 112' ' ' PHE . 12.8 mt -70.41 101.38 1.94 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.501 1.125 . . . . 74.41 109.275 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.585 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -121.32 174.62 6.61 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 124.552 1.157 . . . . 65.15 109.6 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.403 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -117.37 164.49 14.78 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.444 1.09 . . . . 74.4 109.252 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.4 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 21.0 tt0 -63.54 -11.4 24.04 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.512 1.132 . . . . 71.54 110.316 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -83.66 -45.93 12.89 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.488 1.118 . . . . 55.11 109.278 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -123.05 44.44 2.66 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.475 1.11 . . . . 74.52 109.324 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.585 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -76.03 -28.94 57.89 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.49 1.119 . . . . 71.54 110.42 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -84.72 -24.2 29.0 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.472 1.108 . . . . 73.23 109.408 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.423 ' HG3' ' ND2' ' A' ' 177' ' ' ASN . 0.0 OUTLIER -71.68 -54.73 9.38 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.495 1.122 . . . . 74.53 110.325 179.972 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.481 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -59.63 -35.63 74.75 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.471 1.107 . . . . 52.42 109.296 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.422 ' CD2' ' C ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -69.95 -49.6 50.17 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.537 1.148 . . . . 72.32 109.249 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.97 -37.83 4.29 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.515 1.134 . . . . 73.43 110.232 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.467 ' O ' ' N ' ' A' ' 99' ' ' LEU . 2.1 t -73.63 -64.51 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.489 1.118 . . . . 74.13 109.268 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.428 ' N ' HG11 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -41.67 -26.53 0.08 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.463 1.102 . . . . 74.2 110.302 -179.95 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.449 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.4 t-20 -71.34 -49.68 39.96 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.516 1.135 . . . . 73.3 109.286 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.506 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -74.95 -22.19 58.72 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.555 1.159 . . . . 74.12 109.333 -179.995 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.477 HD22 ' CD2' ' A' ' 99' ' ' LEU . 30.8 mt -62.83 -51.73 65.89 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.529 1.143 . . . . 71.25 109.281 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 101' ' ' GLN . 10.0 pt20 -79.81 51.48 1.32 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.538 1.149 . . . . 74.21 110.297 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -170.13 -66.55 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.566 1.166 . . . . 61.14 109.27 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -50.28 -44.67 53.95 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.466 1.104 . . . . 75.15 109.36 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.563 ' CE2' HG11 ' A' ' 206' ' ' VAL . 1.6 m-85 -116.5 -32.27 5.28 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.514 1.134 . . . . 74.53 111.011 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.429 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 98.47 44.7 2.47 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 124.474 1.109 . . . . 72.13 110.978 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.421 HG22 ' CD ' ' A' ' 80' ' ' LYS . 8.9 mm -84.1 72.64 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.519 0.776 . . . . 72.04 109.31 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.489 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -119.9 156.69 54.01 Favored Pre-proline 0 C--N 1.324 -0.51 0 O-C-N 124.515 1.135 . . . . 74.44 109.322 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.498 ' HG3' ' CE2' ' A' ' 78' ' ' PHE . 18.1 Cg_endo -75.06 164.39 88.49 Favored 'Cis proline' 0 C--N 1.359 1.121 0 C-N-CA 120.994 -2.502 . . . . 65.21 110.953 0.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.44 125.4 5.02 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.405 1.066 . . . . 74.22 111.008 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.461 ' CG2' HD13 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -141.17 130.27 24.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.439 0.729 . . . . 75.54 109.271 179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . 0.454 ' CD1' ' HB2' ' A' ' 113' ' ' ALA . 1.8 pt -94.19 148.49 4.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 124.447 1.092 . . . . 74.21 109.326 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.57 ' CE1' HD23 ' A' ' 84' ' ' LEU . 2.6 t80 -51.59 -20.25 1.88 Allowed 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.49 1.119 . . . . 70.42 110.965 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.454 ' HB2' ' CD1' ' A' ' 111' ' ' ILE . . . -78.89 -35.98 42.78 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.512 1.132 . . . . 64.44 109.288 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -83.37 -24.87 31.83 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.474 1.109 . . . . 71.4 110.327 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 42.1 tpp -37.37 110.81 0.51 Allowed Pre-proline 0 C--N 1.326 -0.45 0 O-C-N 124.536 1.147 . . . . 75.24 110.997 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo . . . . . 0 C--N 1.36 1.158 0 O-C-N 124.525 1.803 . . . . 75.33 110.994 179.993 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.302 0 N-CA-C 109.31 -0.626 . . . . 71.43 109.31 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -59.8 -20.23 55.52 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.504 1.127 . . . . 71.41 109.328 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -55.3 -21.87 16.49 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.434 1.084 . . . . 74.24 109.281 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.454 ' CB ' ' CD1' ' A' ' 84' ' ' LEU . . . -77.42 -40.87 41.99 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.488 1.118 . . . . 65.21 109.326 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 3.6 m -92.27 29.3 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 O-C-N 124.576 1.173 . . . . 73.53 109.26 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 24.4 m-20 -109.97 124.22 51.03 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.493 1.121 . . . . 73.32 109.283 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . 0.555 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 44.21 73.05 0.28 Allowed Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.532 1.145 . . . . 41.2 111.028 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' SER . . . . . 0.402 ' O ' ' O ' ' A' ' 167' ' ' TYR . 2.5 m -162.96 -175.79 4.56 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.491 0.76 . . . . 73.24 109.955 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . 0.581 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -99.83 -77.11 0.53 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.497 1.123 . . . . 74.43 109.296 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.581 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 0.8 OUTLIER -125.18 176.16 6.91 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.544 1.153 . . . . 74.4 108.001 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' THR . . . . . 0.484 ' HB ' ' CG1' ' A' ' 82' ' ' VAL . 3.4 t -153.98 130.86 10.89 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.462 1.101 . . . . 73.33 110.423 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 1.4 mp -84.33 133.53 29.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.514 1.134 . . . . 64.04 109.303 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.597 ' CD1' ' CG1' ' A' ' 170' ' ' VAL . 10.2 mt -116.13 96.75 5.71 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.51 1.131 . . . . 75.11 109.311 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.505 ' O ' ' CD2' ' A' ' 143' ' ' PHE . 0.1 OUTLIER -62.34 92.08 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.522 1.139 . . . . 75.03 109.311 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 97.4 mt -68.43 111.04 4.42 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.513 1.133 . . . . 74.05 109.3 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' THR . . . . . 0.479 ' O ' ' CB ' ' A' ' 144' ' ' LEU . 4.5 m -124.61 160.97 27.26 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 124.482 1.114 . . . . 72.14 110.47 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -56.04 -39.12 71.51 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.523 1.14 . . . . 73.43 110.352 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -89.6 -52.62 4.92 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.452 1.095 . . . . 71.31 109.318 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.505 ' CD2' ' O ' ' A' ' 138' ' ' LEU . 55.3 t80 -53.23 -24.92 12.34 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.536 1.148 . . . . 74.22 110.968 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.479 ' CB ' ' O ' ' A' ' 140' ' ' THR . 2.0 tm? -70.95 -67.19 0.52 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.545 1.153 . . . . 75.34 109.304 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -46.23 -25.03 0.54 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.526 1.141 . . . . 70.32 110.296 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -81.03 -54.54 5.46 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.545 1.153 . . . . 74.02 109.263 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.545 ' O ' ' CG ' ' A' ' 151' ' ' PHE . 27.2 p -70.48 -7.54 44.23 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.497 1.123 . . . . 74.32 110.414 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.564 ' CZ2' ' HB3' ' A' ' 186' ' ' PRO . 0.8 OUTLIER -96.77 -25.75 15.39 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.447 1.092 . . . . 75.23 108.059 179.916 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 14.5 t -82.77 -39.48 21.77 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.448 1.093 . . . . 74.42 108.269 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' ASN . . . . . 0.405 ' O ' ' N ' ' A' ' 154' ' ' TYR . 4.0 m120 -68.12 -53.13 27.6 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.442 1.089 . . . . 75.15 109.269 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.645 ' CE1' ' CD1' ' A' ' 157' ' ' LEU . 6.9 m-30 -46.43 -53.2 11.55 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.512 1.132 . . . . 75.52 111.01 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -46.83 -47.53 21.12 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.534 1.146 . . . . 74.43 110.301 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -79.54 -19.43 49.57 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.581 1.176 . . . . 74.41 110.965 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.405 ' N ' ' O ' ' A' ' 150' ' ' ASN . 3.1 m-30 -113.31 97.82 6.72 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.551 1.157 . . . . 73.54 110.998 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' THR . . . . . 0.416 ' O ' ' ND2' ' A' ' 159' ' ' ASN . 1.2 t -74.93 -3.01 29.63 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.509 1.131 . . . . 74.34 110.389 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 8.8 t -78.51 -67.82 0.7 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.578 1.174 . . . . 74.14 109.939 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.645 ' CD1' ' CE1' ' A' ' 151' ' ' PHE . 0.4 OUTLIER -44.04 -51.69 7.65 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.491 1.12 . . . . 71.34 109.263 -179.933 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' MET . . . . . 0.561 ' HE1' ' CD2' ' A' ' 151' ' ' PHE . 6.6 mmt -44.15 -43.24 6.91 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.558 1.161 . . . . 75.12 110.937 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' ASN . . . . . 0.416 ' ND2' ' O ' ' A' ' 155' ' ' THR . 17.6 m-20 -64.24 -42.29 96.6 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 75.42 109.241 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' SER . . . . . 0.403 ' CB ' HG23 ' A' ' 170' ' ' VAL . 1.3 m -59.37 -35.2 73.46 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.592 1.183 . . . . 72.14 110.001 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . 0.473 ' O ' ' CD1' ' A' ' 192' ' ' ILE . 36.1 t -62.08 -18.36 19.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 O-C-N 124.577 1.173 . . . . 73.13 109.348 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -87.48 11.42 14.79 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.579 1.174 . . . . 72.54 109.282 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.465 ' CZ ' HG23 ' A' ' 192' ' ' ILE . 0.6 OUTLIER 38.75 59.08 1.63 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.55 1.156 . . . . 74.5 110.271 -179.956 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -73.17 -173.11 1.23 Allowed 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.557 1.161 . . . . 74.11 110.284 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 27.6 p80 -85.59 51.04 2.08 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.528 1.143 . . . . 73.21 109.595 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.9 173.33 6.38 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.518 1.136 . . . . 75.45 109.23 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 167' ' ' TYR . . . . . 0.402 ' O ' ' O ' ' A' ' 132' ' ' SER . 28.2 p90 -87.46 40.33 0.92 Allowed 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.465 1.103 . . . . 75.1 110.964 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -164.16 124.13 2.06 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.519 1.137 . . . . 71.32 109.296 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 169' ' ' SER . . . . . 0.505 ' HB3' ' CD1' ' A' ' 134' ' ' TRP . 27.6 t -118.28 105.79 12.12 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.441 1.088 . . . . 74.23 110.052 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.597 ' CG1' ' CD1' ' A' ' 137' ' ' LEU . 5.0 t -79.53 122.08 34.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.495 1.122 . . . . 74.15 109.319 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.3 mp -128.67 113.74 19.24 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.464 1.103 . . . . 63.42 109.251 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . 0.483 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.1 Cg_endo -75.04 107.43 2.48 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.502 1.791 . . . . 74.21 110.992 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 3.2 ttt -87.75 152.25 22.27 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.501 1.126 . . . . 65.34 110.976 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . 0.403 ' NE ' ' O ' ' A' ' 180' ' ' LEU . 0.0 OUTLIER -100.76 112.41 64.64 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.509 1.131 . . . . 72.32 110.305 179.975 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.97 151.57 39.86 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.58 1.831 . . . . 74.02 111.026 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . 0.61 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -86.56 -42.68 13.31 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.581 1.175 . . . . 70.15 109.33 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . 0.423 ' ND2' ' HG3' ' A' ' 92' ' ' GLU . 7.2 p30 -72.17 -28.0 62.94 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.528 1.142 . . . . 71.21 109.269 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -110.7 98.19 36.41 Favored Pre-proline 0 C--N 1.324 -0.507 0 O-C-N 124.533 1.146 . . . . 73.4 109.325 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.98 114.98 4.15 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.565 1.824 . . . . 72.41 110.992 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . 0.483 ' CD1' ' OG1' ' A' ' 185' ' ' THR . 0.4 OUTLIER -121.88 96.65 46.8 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.509 1.131 . . . . 74.32 109.313 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.05 167.49 26.89 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.44 1.758 . . . . 63.41 110.989 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 14.4 ptt180 -61.55 -25.58 67.39 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.563 1.164 . . . . 71.22 110.33 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -71.31 -9.99 59.03 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.433 1.083 . . . . 72.51 110.343 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -112.95 -28.87 7.56 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.482 1.114 . . . . 74.04 110.295 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 185' ' ' THR . . . . . 0.483 ' OG1' ' CD1' ' A' ' 180' ' ' LEU . 53.4 m -72.3 143.92 86.29 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.463 1.102 . . . . 70.51 110.352 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 186' ' ' PRO . . . . . 0.564 ' HB3' ' CZ2' ' A' ' 148' ' ' TRP . 18.7 Cg_endo -74.96 146.56 32.96 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.492 1.785 . . . . 74.32 111.067 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 187' ' ' PHE . . . . . 0.492 ' O ' ' CG2' ' A' ' 191' ' ' THR . 24.7 p90 -61.69 -12.49 16.71 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.56 1.162 . . . . 73.54 110.991 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -87.05 -53.62 4.77 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.53 1.144 . . . . 72.32 109.306 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 23.2 mt -74.53 -16.34 60.83 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.562 1.164 . . . . 73.53 109.311 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 190' ' ' GLN . . . . . 0.401 ' O ' ' CG ' ' A' ' 190' ' ' GLN . 6.2 tt0 -86.68 -8.25 57.59 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.567 1.167 . . . . 72.54 110.243 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 191' ' ' THR . . . . . 0.492 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 31.5 p -115.73 18.71 15.63 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.515 1.134 . . . . 75.14 110.322 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.473 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 8.8 mt -130.73 145.84 34.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.444 1.09 . . . . 72.12 109.248 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -52.77 118.53 3.73 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.504 1.127 . . . . 74.11 109.27 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . 0.483 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -110.95 177.6 4.61 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.5 1.125 . . . . 73.33 109.297 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 195' ' ' LEU . . . . . 0.439 HD22 ' CD1' ' A' ' 209' ' ' ILE . 0.2 OUTLIER -109.63 127.84 54.82 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.452 1.095 . . . . 74.1 109.238 -179.958 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -109.51 120.04 41.28 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.526 1.141 . . . . 75.35 110.258 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . 0.578 ' OE1' ' CE1' ' A' ' 202' ' ' PHE . 12.0 tp10 -101.84 -22.41 14.36 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.516 1.135 . . . . 65.32 110.236 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . 0.433 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 1.3 pt-20 -94.06 9.88 35.9 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.455 1.097 . . . . 75.5 110.298 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 2.3 t -112.31 151.22 29.96 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.504 1.127 . . . . 64.1 109.979 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 26.5 ttt85 -64.23 -26.46 68.51 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.52 1.138 . . . . 74.51 110.286 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -89.51 26.7 8.75 Favored Glycine 0 CA--C 1.53 0.989 0 O-C-N 124.465 1.103 . . . . 63.04 111.001 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 202' ' ' PHE . . . . . 0.687 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 3.3 t80 -68.34 -38.72 13.75 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 124.506 0.768 . . . . 73.51 110.972 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 203' ' ' PRO . . . . . 0.687 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.1 Cg_endo -74.95 -30.11 7.59 Favored 'Trans proline' 0 C--N 1.36 1.168 0 O-C-N 124.519 1.8 . . . . 62.44 111.021 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -64.14 -65.73 0.64 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.475 1.109 . . . . 74.34 110.4 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 205' ' ' GLN . . . . . 0.402 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 2.4 mt-30 -50.09 -41.82 48.92 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.49 1.118 . . . . 73.34 110.334 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 206' ' ' VAL . . . . . 0.563 HG11 ' CE2' ' A' ' 104' ' ' PHE . 53.7 t -59.84 -30.06 44.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.514 1.134 . . . . 62.33 109.288 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -79.81 -53.25 6.96 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.516 1.135 . . . . 74.32 110.297 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -55.91 -59.15 5.3 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.503 1.127 . . . . 73.32 110.305 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 209' ' ' ILE . . . . . 0.439 ' CD1' HD22 ' A' ' 195' ' ' LEU . 73.2 mt -54.29 -59.15 2.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.572 1.17 . . . . 73.51 109.29 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 210' ' ' PHE . . . . . 0.571 ' HA ' ' CZ2' ' A' ' 134' ' ' TRP . 1.0 OUTLIER -92.17 62.34 4.11 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.501 1.126 . . . . 73.34 111.05 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.87 145.46 38.23 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.52 1.137 . . . . 73.32 110.289 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 215' ' ' TYR . 27.8 tt0 -49.11 -55.14 13.19 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.487 1.117 . . . . 74.14 110.333 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.68 -24.23 1.3 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.517 1.136 . . . . 71.54 110.022 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 40.4 t -96.31 -27.46 3.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.539 1.149 . . . . 63.31 109.265 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 215' ' ' TYR . . . . . 0.447 ' N ' ' O ' ' A' ' 212' ' ' GLU . 12.0 t80 -66.08 -27.21 67.9 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.493 1.121 . . . . 74.14 110.973 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . 0.443 ' O ' ' N ' ' A' ' 220' ' ' THR . 12.8 mmtp -59.49 -58.27 9.35 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.382 1.051 . . . . 53.14 109.274 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 4.4 m -50.1 -62.94 1.28 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.503 1.127 . . . . 73.41 110.355 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -54.2 -27.1 32.1 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.533 1.146 . . . . 64.25 110.333 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 219' ' ' GLN . . . . . 0.444 ' O ' ' NE2' ' A' ' 219' ' ' GLN . 30.8 tp60 -82.29 -25.86 33.63 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.464 1.102 . . . . 71.21 110.269 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 220' ' ' THR . . . . . 0.444 ' O ' ' CG ' ' A' ' 224' ' ' GLU . 1.1 m -88.09 -20.32 25.86 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.53 1.144 . . . . 74.54 110.388 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 221' ' ' ILE . . . . . . . . . . . . . 19.8 mt -82.12 -41.76 18.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.424 1.078 . . . . 74.15 109.27 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 222' ' ' TRP . . . . . 0.555 ' CD1' ' HA2' ' A' ' 131' ' ' GLY . 13.9 t90 -64.51 -55.86 17.9 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.507 1.13 . . . . 73.33 107.999 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.02 -18.64 25.48 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.46 1.1 . . . . 73.34 109.318 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . 0.444 ' CG ' ' O ' ' A' ' 220' ' ' THR . 3.0 mm-40 . . . . . 0 C--N 1.325 -0.468 0 O-C-N 124.522 1.139 . . . . 72.35 110.304 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.426 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 6.5 p . . . . . 0 N--CA 1.452 -0.34 0 N-CA-C 109.274 -0.639 . . . . 74.31 109.274 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.415 ' O ' ' C ' ' A' ' 79' ' ' LEU . 34.1 t80 -80.38 12.76 2.77 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.463 1.102 . . . . 74.54 111.016 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.416 ' HG ' ' N ' ' A' ' 80' ' ' LYS . 15.5 tp -39.19 157.58 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.531 1.144 . . . . 75.43 109.299 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.546 ' NZ ' ' H ' ' A' ' 107' ' ' LYS . 5.0 ptpt -100.83 -45.81 5.33 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.515 1.134 . . . . 71.11 109.333 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.599 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.7 OUTLIER -167.78 129.1 1.46 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.46 1.1 . . . . 73.3 110.963 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.526 ' CG1' ' CG2' ' A' ' 135' ' ' THR . 9.3 p -84.51 174.33 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.506 1.129 . . . . 74.24 109.317 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.422 HD13 ' CZ ' ' A' ' 81' ' ' PHE . 2.1 mp -129.32 95.1 2.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.419 1.075 . . . . 73.54 109.344 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.465 ' HG ' ' CB ' ' A' ' 128' ' ' ALA . 1.0 OUTLIER -74.21 93.73 2.37 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.479 1.112 . . . . 74.41 109.232 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.609 ' CE1' ' OG1' ' A' ' 90' ' ' THR . 0.0 OUTLIER -112.85 174.49 5.87 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.49 1.119 . . . . 74.31 109.643 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.566 ' HB1' ' CD1' ' A' ' 143' ' ' PHE . . . -110.75 148.35 32.51 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.472 1.107 . . . . 71.52 109.276 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -50.3 -21.8 1.54 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.562 1.164 . . . . 74.52 110.411 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -77.37 -46.26 23.36 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.47 1.106 . . . . 75.21 109.299 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.42 ' CB ' HD13 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -117.05 44.46 2.07 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.581 1.176 . . . . 75.11 109.288 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.609 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -76.79 -44.1 34.12 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.478 1.112 . . . . 72.12 110.366 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -63.14 -37.67 88.13 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.487 1.117 . . . . 54.51 109.339 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.446 ' O ' ' N ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -55.63 -69.38 0.14 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.428 1.08 . . . . 73.24 110.339 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.483 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -47.73 -36.75 11.89 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.496 1.122 . . . . 74.45 109.268 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.486 ' O ' ' CD2' ' A' ' 94' ' ' LEU . 0.6 OUTLIER -67.7 -36.18 80.18 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.466 1.104 . . . . 75.42 109.364 179.936 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.446 ' N ' ' O ' ' A' ' 92' ' ' GLU . 17.5 tpp85 -61.0 -47.84 84.58 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.448 1.093 . . . . 73.54 110.32 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.549 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 0.3 OUTLIER -69.59 -52.83 28.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.595 1.185 . . . . 74.14 109.31 179.993 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.549 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -51.8 -17.77 1.05 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.612 1.195 . . . . 72.33 110.347 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.411 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -81.83 -52.41 7.14 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.484 1.115 . . . . 74.21 109.27 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.491 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -68.16 -22.46 64.85 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.475 1.109 . . . . 74.43 109.328 -179.937 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.427 ' N ' HD22 ' A' ' 99' ' ' LEU . 32.8 mt -66.81 -48.36 69.19 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.46 1.1 . . . . 73.04 109.298 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -79.52 52.84 1.45 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.501 1.126 . . . . 73.31 110.323 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -175.97 -64.17 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.529 1.143 . . . . 73.5 109.263 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -46.01 -45.95 16.19 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.473 1.108 . . . . 63.21 109.283 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -116.47 -32.02 5.38 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.444 1.09 . . . . 70.52 111.01 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.405 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 108.15 37.9 2.07 Favored Glycine 0 CA--C 1.53 1.02 0 O-C-N 124.538 1.148 . . . . 73.44 111.015 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.457 HG21 ' CE1' ' A' ' 81' ' ' PHE . 16.6 mm -78.56 74.87 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.516 0.774 . . . . 75.12 109.362 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.546 ' H ' ' NZ ' ' A' ' 80' ' ' LYS . 0.0 OUTLIER -126.92 155.99 74.76 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.516 1.135 . . . . 72.11 109.28 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.493 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.4 Cg_endo -74.94 161.22 95.27 Favored 'Cis proline' 0 C--N 1.36 1.152 0 C-N-CA 121.026 -2.489 . . . . 74.24 111.02 -0.031 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -117.6 119.3 4.38 Favored Glycine 0 CA--C 1.53 0.97 0 O-C-N 124.422 1.076 . . . . 73.13 111.036 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.95 128.59 31.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.469 0.746 . . . . 73.14 109.287 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . 0.409 HD13 ' NE2' ' A' ' 85' ' ' HIS . 39.3 pt -89.28 174.4 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.456 1.097 . . . . 73.23 109.323 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.503 ' CE1' ' CB ' ' A' ' 128' ' ' ALA . 2.4 t80 -75.2 -18.65 60.1 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.418 1.074 . . . . 71.41 110.967 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.5 -3.11 53.53 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.493 1.121 . . . . 71.32 109.256 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -107.65 -26.74 10.71 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.532 1.145 . . . . 71.13 110.281 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.465 ' CE ' HG23 ' A' ' 82' ' ' VAL . 35.6 tpp -41.72 110.77 0.81 Allowed Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.502 1.126 . . . . 74.25 111.011 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo . . . . . 0 C--N 1.36 1.148 0 O-C-N 124.479 1.779 . . . . 74.4 111.066 179.949 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.472 ' CD1' ' CD1' ' A' ' 157' ' ' LEU . 3.6 pp . . . . . 0 N--CA 1.454 -0.269 0 N-CA-C 109.304 -0.628 . . . . 65.13 109.304 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -63.09 -14.3 46.7 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.566 1.166 . . . . 74.55 109.332 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.48 -48.79 65.7 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.438 1.087 . . . . 74.12 109.292 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.503 ' CB ' ' CE1' ' A' ' 112' ' ' PHE . . . -65.64 -22.71 66.67 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.499 1.124 . . . . 74.33 109.357 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.456 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 70.9 t -86.6 10.04 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.517 1.136 . . . . 72.23 109.339 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -135.64 119.34 17.15 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 124.534 1.146 . . . . 75.22 109.302 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 91.76 47.98 3.29 Favored Glycine 0 CA--C 1.53 0.974 0 O-C-N 124.474 1.109 . . . . 71.13 111.033 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 3.2 m -163.35 171.14 16.5 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.496 0.762 . . . . 75.31 109.956 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . 0.579 ' HB2' ' CE3' ' A' ' 134' ' ' TRP . . . -104.85 -27.35 11.79 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.535 1.147 . . . . 74.34 109.251 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.579 ' CE3' ' HB2' ' A' ' 133' ' ' ALA . 6.6 m-90 -158.82 157.83 32.34 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.536 1.148 . . . . 74.23 108.0 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' THR . . . . . 0.526 ' CG2' ' CG1' ' A' ' 82' ' ' VAL . 6.3 p -140.56 128.77 22.31 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.5 1.125 . . . . 64.22 110.412 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.411 ' HA ' ' O ' ' A' ' 171' ' ' ILE . 1.4 mp -84.07 149.6 4.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 124.423 1.077 . . . . 71.23 109.321 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.453 ' CD1' HG12 ' A' ' 170' ' ' VAL . 47.6 mt -131.35 108.02 9.35 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.507 1.13 . . . . 74.01 109.356 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.603 ' O ' ' CD2' ' A' ' 143' ' ' PHE . 1.4 mm? -62.35 93.25 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.502 1.126 . . . . 72.1 109.306 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.444 ' CD2' HG22 ' A' ' 185' ' ' THR . 6.3 tp -69.12 99.15 1.08 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.55 1.156 . . . . 73.14 109.334 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' THR . . . . . 0.427 ' O ' ' N ' ' A' ' 144' ' ' LEU . 2.5 m -127.05 162.68 25.47 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.568 1.167 . . . . 74.21 110.401 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -69.41 -29.95 67.81 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.5 1.125 . . . . 70.5 110.329 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -89.61 -25.06 21.49 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.457 1.098 . . . . 70.24 109.318 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.636 ' CE2' ' CG2' ' A' ' 147' ' ' THR . 82.0 t80 -90.16 -19.8 23.82 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.472 1.107 . . . . 73.02 111.016 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' A' ' 140' ' ' THR . 2.7 tm? -53.62 -67.61 0.24 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.602 1.188 . . . . 75.43 109.292 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 54.6 mmm-85 -57.98 -16.38 12.25 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.545 1.153 . . . . 71.01 110.273 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -77.47 -34.68 54.27 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.522 1.139 . . . . 64.12 109.336 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.636 ' CG2' ' CE2' ' A' ' 143' ' ' PHE . 2.1 p -102.87 -8.3 20.85 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.555 1.16 . . . . 73.33 110.406 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.421 ' N ' ' O ' ' A' ' 144' ' ' LEU . 0.3 OUTLIER -95.85 -25.35 16.05 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.077 -1.082 . . . . 75.11 108.077 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 16.8 t -92.53 -37.71 12.34 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.534 1.146 . . . . 71.34 108.275 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' ASN . . . . . 0.516 ' O ' ' CG ' ' A' ' 154' ' ' TYR . 68.7 m-20 -68.47 -49.65 58.25 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.52 1.137 . . . . 73.44 109.255 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.649 ' CE2' ' CG2' ' A' ' 161' ' ' VAL . 6.4 m-30 -60.88 -55.33 34.34 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.505 1.128 . . . . 71.43 111.007 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 30.3 tp60 -48.1 -47.74 34.16 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.517 1.136 . . . . 71.32 110.323 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -74.1 -20.3 60.31 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.495 1.122 . . . . 74.24 110.962 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.516 ' CG ' ' O ' ' A' ' 150' ' ' ASN . 15.8 m-30 -117.79 83.2 1.95 Allowed 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.49 1.119 . . . . 71.42 111.032 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.3 t -49.7 -22.84 1.49 Allowed 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.429 1.081 . . . . 73.25 110.364 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 11.3 p -62.03 -40.58 96.22 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.49 1.119 . . . . 73.41 109.992 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.472 ' CD1' ' CD1' ' A' ' 125' ' ' LEU . 6.4 mt -68.5 -47.41 67.07 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.441 1.088 . . . . 65.0 109.272 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' MET . . . . . 0.41 ' HE2' ' CB ' ' A' ' 161' ' ' VAL . 5.3 mmt -47.04 -33.04 4.45 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.512 1.133 . . . . 64.42 111.0 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -66.11 -44.76 83.36 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 124.496 1.122 . . . . 54.33 109.328 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' SER . . . . . 0.475 ' HB3' ' CG2' ' A' ' 170' ' ' VAL . 1.4 m -71.83 -28.76 63.79 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.542 1.151 . . . . 74.24 110.011 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . 0.649 ' CG2' ' CE2' ' A' ' 151' ' ' PHE . 3.5 t -56.84 -18.08 6.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.508 1.13 . . . . 73.25 109.318 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' ASN . . . . . 0.479 ' O ' ' N ' ' A' ' 164' ' ' GLN . 1.5 t-20 -90.61 20.97 4.24 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.491 1.12 . . . . 74.14 109.354 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.422 ' C ' ' O ' ' A' ' 162' ' ' ASN . 0.1 OUTLIER 36.43 31.79 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.492 1.12 . . . . 74.33 110.294 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . 0.479 ' N ' ' O ' ' A' ' 162' ' ' ASN . 34.1 mt-30 -38.34 132.03 1.12 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.471 1.107 . . . . 73.23 110.224 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' HIS . . . . . 0.527 ' CG ' ' O ' ' A' ' 165' ' ' HIS . 5.4 p80 -69.47 72.2 0.32 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.513 1.133 . . . . 73.43 109.565 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . 0.44 ' O ' ' NE2' ' A' ' 218' ' ' GLN . 0.5 OUTLIER -125.13 -178.7 4.28 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.467 1.104 . . . . 71.1 109.336 179.928 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 167' ' ' TYR . . . . . 0.414 ' N ' HG22 ' A' ' 221' ' ' ILE . 37.8 p90 -49.82 -35.83 24.38 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.662 1.226 . . . . 73.0 111.029 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -117.12 129.41 55.95 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.52 1.138 . . . . 74.3 109.323 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -119.87 155.59 32.37 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.436 1.085 . . . . 62.51 109.992 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.475 ' CG2' ' HB3' ' A' ' 160' ' ' SER . 18.5 t -118.82 122.06 68.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.437 1.086 . . . . 74.22 109.26 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . 0.411 ' O ' ' HA ' ' A' ' 136' ' ' ILE . 1.7 mp -127.1 112.84 21.71 Favored Pre-proline 0 C--N 1.324 -0.522 0 O-C-N 124.503 1.127 . . . . 74.22 109.348 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . 0.496 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.96 106.6 2.3 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.518 1.799 . . . . 75.33 111.024 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 11.0 ttt -82.92 166.32 18.99 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.531 1.144 . . . . 74.33 110.943 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 17.0 mmm-85 -131.21 126.47 21.47 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.485 1.115 . . . . 74.21 110.356 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.01 163.18 35.83 Favored 'Trans proline' 0 C--N 1.36 1.14 0 O-C-N 124.481 1.78 . . . . 73.44 110.984 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . 0.626 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -94.85 -47.19 6.56 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.531 1.144 . . . . 75.33 109.289 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -71.27 -25.27 62.39 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.533 1.146 . . . . 73.35 109.365 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -109.39 100.95 43.78 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.551 1.157 . . . . 72.52 109.305 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.03 138.92 23.59 Favored 'Trans proline' 0 C--N 1.361 1.205 0 O-C-N 124.488 1.783 . . . . 72.31 111.037 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -141.18 96.76 7.08 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.465 1.103 . . . . 73.43 109.314 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.95 166.31 29.51 Favored 'Trans proline' 0 C--N 1.361 1.22 0 O-C-N 124.51 1.795 . . . . 61.51 111.039 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 26.2 mtm105 -60.38 -26.72 66.86 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.467 1.104 . . . . 75.42 110.283 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -61.49 -18.74 60.42 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.514 1.134 . . . . 72.41 110.367 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -113.09 -0.59 14.66 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.508 1.13 . . . . 74.12 110.265 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 185' ' ' THR . . . . . 0.444 HG22 ' CD2' ' A' ' 139' ' ' LEU . 20.6 m -108.53 143.66 27.94 Favored Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.493 1.12 . . . . 62.22 110.368 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 186' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 185' ' ' THR . 18.5 Cg_endo -74.95 155.78 43.18 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.428 1.751 . . . . 75.31 111.027 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 187' ' ' PHE . . . . . 0.502 ' O ' ' CG2' ' A' ' 191' ' ' THR . 49.3 p90 -69.45 -7.27 36.43 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.541 1.151 . . . . 74.51 111.024 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.81 -52.91 4.23 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.551 1.157 . . . . 53.43 109.305 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 44.6 mt -68.57 -42.3 78.49 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.515 1.134 . . . . 72.12 109.285 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -63.73 -11.09 23.26 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.551 1.157 . . . . 75.44 110.334 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 191' ' ' THR . . . . . 0.502 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 35.5 p -113.35 6.91 17.49 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.451 1.095 . . . . 64.42 110.383 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.476 ' CG2' ' N ' ' A' ' 193' ' ' ASN . 7.5 mt -103.79 162.2 4.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.465 1.103 . . . . 74.31 109.315 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 193' ' ' ASN . . . . . 0.476 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 30.8 p-10 -66.57 74.44 0.1 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.553 1.158 . . . . 75.11 109.251 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . 0.496 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -79.3 128.58 33.5 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.617 1.198 . . . . 74.32 109.298 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 195' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.47 124.8 24.56 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.45 1.094 . . . . 71.43 109.241 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -109.18 111.18 22.65 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.468 1.105 . . . . 72.32 110.379 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . 0.594 ' OE2' ' CD1' ' A' ' 202' ' ' PHE . 35.6 tp10 -87.7 -22.45 24.63 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.547 1.154 . . . . 75.31 110.278 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . 0.47 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 7.3 pt-20 -95.08 22.86 6.16 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.451 1.095 . . . . 74.44 110.275 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 4.0 t -127.58 143.91 51.12 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.548 1.155 . . . . 74.13 109.936 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 55.1 mtt180 -58.79 -20.93 54.38 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.537 1.148 . . . . 71.23 110.29 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -88.77 11.53 68.46 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.517 1.136 . . . . 55.34 110.97 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 202' ' ' PHE . . . . . 0.594 ' CD1' ' OE2' ' A' ' 197' ' ' GLU . 0.1 OUTLIER -53.45 -45.19 98.64 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.531 0.783 . . . . 72.1 110.976 179.967 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 203' ' ' PRO . . . . . 0.594 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.07 -37.89 1.8 Allowed 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.518 1.799 . . . . 70.4 110.944 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.49 -49.54 72.28 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.506 1.129 . . . . 75.4 110.367 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -68.86 -41.35 78.53 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.51 1.131 . . . . 74.22 110.314 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 206' ' ' VAL . . . . . 0.508 ' CG2' ' O ' ' A' ' 202' ' ' PHE . 69.3 t -64.64 -27.37 42.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.476 1.11 . . . . 75.03 109.283 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -80.64 -51.1 9.1 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.45 1.094 . . . . 72.44 110.349 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 87.6 mtt-85 -64.43 -62.31 1.68 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.461 1.101 . . . . 73.43 110.278 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 209' ' ' ILE . . . . . 0.639 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 90.9 mt -46.87 -44.75 7.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.454 1.096 . . . . 75.11 109.286 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 210' ' ' PHE . . . . . 0.639 ' CE1' ' CG2' ' A' ' 209' ' ' ILE . 1.3 m-85 -111.92 67.82 0.66 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.521 1.138 . . . . 74.42 111.066 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -110.7 143.61 40.92 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.508 1.13 . . . . 71.32 110.267 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . 0.456 ' O ' ' N ' ' A' ' 215' ' ' TYR . 23.8 tt0 -49.58 -54.66 16.95 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.403 1.064 . . . . 70.12 110.273 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.89 -24.29 0.98 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.571 1.169 . . . . 72.12 110.005 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 40.0 t -96.15 -29.71 3.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.489 1.118 . . . . 72.44 109.294 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 215' ' ' TYR . . . . . 0.456 ' N ' ' O ' ' A' ' 212' ' ' GLU . 6.3 t80 -64.5 -34.08 77.38 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.477 1.111 . . . . 72.52 111.006 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp -55.59 -59.88 4.21 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 71.01 109.326 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 217' ' ' THR . . . . . 0.456 ' O ' ' N ' ' A' ' 220' ' ' THR . 99.2 m -58.43 -66.45 0.49 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.523 1.139 . . . . 75.14 110.386 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 218' ' ' GLN . . . . . 0.44 ' NE2' ' O ' ' A' ' 166' ' ' LYS . 28.0 mm-40 -39.44 -40.48 0.83 Allowed 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.527 1.142 . . . . 72.42 110.313 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 219' ' ' GLN . . . . . 0.449 ' O ' ' NE2' ' A' ' 219' ' ' GLN . 16.9 tp60 -65.96 -46.66 77.32 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.441 1.088 . . . . 70.43 110.254 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 220' ' ' THR . . . . . 0.456 ' N ' ' O ' ' A' ' 217' ' ' THR . 1.3 m -68.04 -23.1 64.94 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.506 1.129 . . . . 64.45 110.435 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 221' ' ' ILE . . . . . 0.438 HD11 ' CG2' ' A' ' 217' ' ' THR . 17.1 mt -78.6 -32.5 16.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 O-C-N 124.508 1.13 . . . . 75.51 109.33 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 222' ' ' TRP . . . . . 0.426 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 26.5 t90 -71.13 -50.59 31.94 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.539 1.15 . . . . 75.15 108.038 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.95 -18.04 63.85 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.425 1.078 . . . . 74.3 109.285 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 . . . . . 0 C--N 1.325 -0.495 0 O-C-N 124.47 1.106 . . . . 75.34 110.28 179.966 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.41 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 5.8 p . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 109.329 -0.619 . . . . 72.11 109.329 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.404 ' O ' ' C ' ' A' ' 79' ' ' LEU . 55.1 p90 -88.56 24.37 1.99 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.436 1.085 . . . . 74.23 110.966 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.404 ' C ' ' O ' ' A' ' 78' ' ' PHE . 6.6 tp -40.14 152.77 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.463 1.102 . . . . 74.34 109.27 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.47 ' CD ' HG22 ' A' ' 106' ' ' ILE . 6.4 ttmt -92.43 -60.29 1.87 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.522 1.139 . . . . 73.21 109.281 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.548 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.4 OUTLIER -162.14 138.69 7.95 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.532 1.145 . . . . 75.41 110.969 179.996 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.485 ' CG1' ' O ' ' A' ' 128' ' ' ALA . 2.8 p -89.63 160.23 2.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 O-C-N 124.567 1.167 . . . . 73.32 109.347 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.413 ' N ' HG23 ' A' ' 82' ' ' VAL . 4.3 mp -118.13 92.46 2.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.499 1.124 . . . . 73.3 109.33 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.437 ' HG ' ' CB ' ' A' ' 128' ' ' ALA . 6.1 mt -70.18 118.73 13.38 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.54 1.15 . . . . 73.25 109.291 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.576 ' CE1' ' OG1' ' A' ' 90' ' ' THR . 0.0 OUTLIER -143.89 174.53 10.75 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.463 1.102 . . . . 75.22 109.574 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -110.85 152.1 27.07 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.463 1.102 . . . . 74.34 109.273 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.09 -18.34 5.33 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.439 1.087 . . . . 75.23 110.277 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -69.97 -46.35 65.42 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.586 1.179 . . . . 72.44 109.225 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.435 ' CG ' ' ND2' ' A' ' 178' ' ' ASN . 2.5 m-20 -130.16 43.76 3.07 Favored 'General case' 0 C--N 1.323 -0.557 0 O-C-N 124.497 1.123 . . . . 73.03 109.319 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.576 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -73.91 -20.85 60.27 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.54 1.15 . . . . 74.21 110.412 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -81.44 -39.13 25.34 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.568 1.167 . . . . 71.41 109.301 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -59.86 -50.46 73.7 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 124.535 1.147 . . . . 71.11 110.261 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.537 ' CB ' ' CD2' ' A' ' 138' ' ' LEU . . . -59.93 -35.09 74.17 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.446 1.091 . . . . 61.42 109.286 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.503 ' CD2' ' C ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -68.66 -44.62 73.72 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.518 1.136 . . . . 73.03 109.306 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.408 ' N ' HD13 ' A' ' 94' ' ' LEU . 8.8 tpt180 -48.94 -31.57 7.56 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.58 1.175 . . . . 72.32 110.261 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.504 ' CG2' ' OE2' ' A' ' 197' ' ' GLU . 2.1 t -78.64 -65.26 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.557 1.16 . . . . 61.31 109.288 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.436 ' NE2' ' O ' ' A' ' 109' ' ' GLY . 0.0 OUTLIER -40.3 -27.35 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.486 1.117 . . . . 75.13 110.315 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.455 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.3 t-20 -71.75 -60.48 2.21 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.475 1.11 . . . . 73.04 109.288 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.47 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -61.6 -22.55 65.32 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.542 1.151 . . . . 74.22 109.339 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.417 ' N ' HD23 ' A' ' 99' ' ' LEU . 26.7 mt -65.59 -50.81 63.73 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.492 1.12 . . . . 74.41 109.277 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -76.97 55.69 1.14 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.469 1.105 . . . . 75.12 110.311 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.0 t70 179.71 -63.29 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.489 1.118 . . . . 73.14 109.299 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.559 ' HB3' ' CD1' ' A' ' 104' ' ' PHE . 64.0 t0 -43.99 -53.71 6.03 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.488 1.117 . . . . 75.32 109.292 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.559 ' CD1' ' HB3' ' A' ' 103' ' ' ASP . 0.3 OUTLIER -113.43 -23.87 9.61 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.496 1.123 . . . . 72.34 111.014 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.98 37.68 4.33 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.509 1.131 . . . . 74.44 111.036 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.47 HG22 ' CD ' ' A' ' 80' ' ' LYS . 8.1 mm -81.97 81.14 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.436 0.727 . . . . 75.13 109.362 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.483 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -128.21 156.76 76.06 Favored Pre-proline 0 C--N 1.325 -0.459 0 O-C-N 124.537 1.148 . . . . 65.24 109.276 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.483 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.93 152.89 98.8 Favored 'Cis proline' 0 C--N 1.36 1.141 0 C-N-CA 121.052 -2.479 . . . . 74.14 111.015 -0.062 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . 0.436 ' O ' ' NE2' ' A' ' 97' ' ' GLN . . . -119.28 110.86 1.95 Allowed Glycine 0 CA--C 1.531 1.043 0 O-C-N 124.513 1.133 . . . . 62.33 111.018 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.473 ' CD1' ' HA ' ' A' ' 115' ' ' MET . 0.3 OUTLIER -129.02 144.68 37.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.54 0.788 . . . . 72.32 109.32 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . 0.408 ' HB ' ' NE2' ' A' ' 85' ' ' HIS . 20.7 pt -97.16 -177.3 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.499 1.124 . . . . 71.33 109.275 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.509 ' CD1' ' SD ' ' A' ' 115' ' ' MET . 2.2 t80 -81.77 -18.85 42.73 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.464 1.103 . . . . 75.04 110.964 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -96.44 -2.55 45.2 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.479 1.112 . . . . 73.13 109.312 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.401 ' CG ' ' CG1' ' A' ' 111' ' ' ILE . 67.1 mm-40 -110.44 -26.69 9.39 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.465 1.103 . . . . 73.53 110.328 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.509 ' SD ' ' CD1' ' A' ' 112' ' ' PHE . 1.2 ptp -70.02 135.03 87.4 Favored Pre-proline 0 C--N 1.325 -0.462 0 O-C-N 124.534 1.146 . . . . 73.01 111.016 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo . . . . . 0 C--N 1.36 1.163 0 O-C-N 124.51 1.795 . . . . 53.45 111.004 179.991 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.496 ' CD2' ' OD1' ' A' ' 150' ' ' ASN . 1.0 OUTLIER . . . . . 0 N--CA 1.454 -0.271 0 N-CA-C 109.296 -0.631 . . . . 65.03 109.296 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.407 ' O ' ' N ' ' A' ' 129' ' ' VAL . 10.9 t70 -49.69 -37.49 29.05 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.47 1.106 . . . . 74.21 109.26 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -50.88 -41.31 58.14 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.551 1.157 . . . . 75.12 109.335 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.485 ' O ' ' CG1' ' A' ' 82' ' ' VAL . . . -69.99 -26.44 64.08 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.493 1.12 . . . . 75.41 109.246 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.482 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 63.1 t -89.11 14.38 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.509 1.131 . . . . 64.24 109.281 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -111.55 140.06 46.47 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.464 1.102 . . . . 75.44 109.272 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . 0.485 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 39.29 77.78 0.06 OUTLIER Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.485 1.116 . . . . 73.25 110.98 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -163.48 167.02 22.04 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.475 0.75 . . . . 75.22 110.017 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . 0.644 ' CB ' ' CZ3' ' A' ' 134' ' ' TRP . . . -95.67 -36.0 11.38 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.549 1.156 . . . . 71.43 109.285 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.644 ' CZ3' ' CB ' ' A' ' 133' ' ' ALA . 1.1 m-90 -161.57 170.13 20.42 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.505 1.128 . . . . 74.32 108.039 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 56.2 p -138.78 138.19 37.37 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.573 1.171 . . . . 73.25 110.41 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 39.2 mm -84.35 140.97 15.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.491 1.119 . . . . 64.41 109.28 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -128.61 86.97 2.51 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.509 1.131 . . . . 72.3 109.323 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.537 ' CD2' ' CB ' ' A' ' 93' ' ' ALA . 0.3 OUTLIER -62.74 88.06 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.48 1.112 . . . . 74.53 109.306 -179.99 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.81 116.64 4.99 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.503 1.127 . . . . 75.42 109.246 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' THR . . . . . 0.456 ' HB ' ' CB ' ' A' ' 143' ' ' PHE . 7.4 m -136.41 169.69 17.26 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.491 1.12 . . . . 71.53 110.381 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -64.25 -39.74 94.58 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.559 1.162 . . . . 75.52 110.275 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . 0.441 ' CG ' ' N ' ' A' ' 143' ' ' PHE . 7.9 p30 -89.54 -46.74 8.46 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.45 1.094 . . . . 73.33 109.279 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.626 ' CE1' ' CG2' ' A' ' 147' ' ' THR . 7.1 t80 -53.07 -25.94 14.47 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.481 1.113 . . . . 72.12 110.951 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.483 ' C ' ' CD1' ' A' ' 144' ' ' LEU . 1.8 tm? -54.46 -68.11 0.21 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.54 1.15 . . . . 75.35 109.319 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.459 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 28.5 mmm180 -65.94 -14.33 61.38 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.415 1.072 . . . . 61.41 110.313 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -70.69 -51.87 24.82 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.511 1.132 . . . . 74.23 109.349 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.626 ' CG2' ' CE1' ' A' ' 143' ' ' PHE . 4.3 p -92.75 -52.99 4.35 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.513 1.133 . . . . 74.31 110.422 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.498 ' CH2' ' CB ' ' A' ' 186' ' ' PRO . 20.5 t-105 -41.87 -47.4 4.22 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.565 1.165 . . . . 74.32 107.977 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' CYS . . . . . 0.459 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 7.4 t -69.85 -44.54 69.66 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.436 1.085 . . . . 52.24 108.322 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' ASN . . . . . 0.496 ' OD1' ' CD2' ' A' ' 125' ' ' LEU . 34.2 t-20 -51.7 -29.52 18.63 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.465 1.103 . . . . 74.13 109.302 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.564 ' CZ ' ' HB ' ' A' ' 147' ' ' THR . 8.2 m-30 -77.6 -44.94 26.73 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.472 1.108 . . . . 75.32 111.005 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 42.2 tp60 -41.46 -39.73 1.59 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.437 1.086 . . . . 74.15 110.256 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -80.78 -34.3 34.27 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.453 1.096 . . . . 74.42 110.959 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.441 ' N ' ' O ' ' A' ' 151' ' ' PHE . 3.3 m-85 -117.05 87.52 2.72 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.558 1.161 . . . . 75.23 111.015 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 2.3 t -60.14 -25.17 65.3 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.451 1.095 . . . . 72.11 110.368 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 54.7 p -58.57 -16.88 17.62 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 124.527 1.142 . . . . 72.14 109.998 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.564 ' HG ' ' CD1' ' A' ' 151' ' ' PHE . 0.2 OUTLIER -75.85 -51.73 11.91 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.451 1.094 . . . . 73.52 109.316 -179.97 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' MET . . . . . 0.446 ' HA ' ' CE ' ' A' ' 158' ' ' MET . 5.6 mmt -50.04 -32.99 16.79 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.436 1.085 . . . . 64.01 110.962 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -64.16 -38.6 91.63 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.524 1.14 . . . . 74.45 109.312 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' SER . . . . . 0.433 ' CB ' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -66.19 -33.1 75.0 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.555 1.159 . . . . 73.43 109.948 -179.962 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . 0.496 ' O ' ' CD1' ' A' ' 192' ' ' ILE . 48.3 t -59.09 -18.16 13.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.425 1.078 . . . . 71.11 109.358 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 30.8 m-20 -77.95 -27.71 49.35 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.46 1.1 . . . . 73.34 109.308 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.404 ' O ' ' O ' ' A' ' 164' ' ' GLN . 21.3 mtp180 68.78 29.06 5.3 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.464 1.102 . . . . 74.4 110.253 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . 0.404 ' O ' ' O ' ' A' ' 163' ' ' ARG . 8.8 mt-30 -50.75 -177.84 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.527 1.142 . . . . 72.23 110.315 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -78.93 70.64 5.3 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.577 1.173 . . . . 75.31 109.567 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.92 177.47 5.75 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.496 1.122 . . . . 74.22 109.353 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 167' ' ' TYR . . . . . 0.417 ' N ' HG23 ' A' ' 221' ' ' ILE . 49.9 p90 -90.02 29.85 1.16 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.489 1.118 . . . . 75.22 110.957 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . 0.467 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 3.5 p30 -169.56 108.8 0.42 Allowed 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.435 1.085 . . . . 70.24 109.29 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 6.3 m -102.04 164.04 11.92 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.436 1.085 . . . . 73.42 110.003 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.433 HG21 ' CB ' ' A' ' 160' ' ' SER . 76.0 t -130.5 125.03 58.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 124.459 1.099 . . . . 75.52 109.273 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.5 mp -131.48 113.75 15.61 Favored Pre-proline 0 C--N 1.326 -0.445 0 O-C-N 124.475 1.109 . . . . 63.42 109.237 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . 0.502 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.04 111.72 3.39 Favored 'Trans proline' 0 C--N 1.36 1.139 0 O-C-N 124.539 1.81 . . . . 73.35 110.975 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 173' ' ' MET . . . . . 0.424 ' HE2' ' CG2' ' A' ' 96' ' ' VAL . 4.5 ttt -92.74 152.08 19.69 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.531 1.144 . . . . 72.02 111.004 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 21.2 mtp180 -110.85 116.66 51.7 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.546 1.154 . . . . 74.51 110.239 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.01 164.61 33.01 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.474 1.776 . . . . 74.44 111.006 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . 0.449 HD21 ' N ' ' A' ' 198' ' ' GLU . 0.1 OUTLIER -104.02 -44.4 5.02 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.597 1.186 . . . . 72.41 109.264 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -72.13 -20.81 61.56 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.409 1.068 . . . . 73.25 109.266 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 178' ' ' ASN . . . . . 0.435 ' ND2' ' CG ' ' A' ' 89' ' ' ASP . 0.6 OUTLIER -110.2 107.49 58.64 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.539 1.149 . . . . 74.45 109.293 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 118.12 5.15 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.549 1.815 . . . . 72.44 111.041 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . 0.473 HD22 ' CB ' ' A' ' 184' ' ' ARG . 1.1 tm? -140.42 96.56 7.78 Favored Pre-proline 0 C--N 1.325 -0.475 0 O-C-N 124.505 1.128 . . . . 73.43 109.28 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.95 168.23 25.3 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.47 1.774 . . . . 74.32 111.025 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -56.48 -27.69 57.7 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.435 1.084 . . . . 73.33 110.302 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -61.35 -26.56 67.9 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 124.474 1.109 . . . . 71.04 110.262 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 184' ' ' ARG . . . . . 0.473 ' CB ' HD22 ' A' ' 180' ' ' LEU . 69.0 mmt-85 -96.4 -24.51 16.1 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.455 1.097 . . . . 72.44 110.288 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 185' ' ' THR . . . . . . . . . . . . . 18.9 m -74.77 143.94 79.25 Favored Pre-proline 0 C--N 1.325 -0.468 0 O-C-N 124.436 1.085 . . . . 72.13 110.396 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 186' ' ' PRO . . . . . 0.498 ' CB ' ' CH2' ' A' ' 148' ' ' TRP . 18.4 Cg_endo -74.94 155.41 43.21 Favored 'Trans proline' 0 C--N 1.36 1.142 0 O-C-N 124.476 1.777 . . . . 75.13 110.983 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 187' ' ' PHE . . . . . 0.498 ' O ' ' CG2' ' A' ' 191' ' ' THR . 17.1 p90 -69.76 -6.89 35.15 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.461 1.101 . . . . 75.31 111.035 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -94.37 -52.96 4.11 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.491 1.12 . . . . 75.43 109.289 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.472 ' CD2' ' HG3' ' A' ' 172' ' ' PRO . 51.5 mt -68.45 -42.08 79.31 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.378 1.049 . . . . 74.12 109.268 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -64.48 -10.09 23.03 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.485 1.116 . . . . 73.23 110.327 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 191' ' ' THR . . . . . 0.498 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 39.9 p -115.08 11.12 16.32 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.545 1.153 . . . . 74.02 110.343 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.496 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 4.0 mt -125.46 148.82 29.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.457 1.098 . . . . 74.21 109.255 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 -47.55 102.64 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.392 1.058 . . . . 74.04 109.254 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . 0.502 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -99.54 129.84 45.74 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.499 1.124 . . . . 65.41 109.327 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 195' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.58 136.9 56.3 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.49 1.119 . . . . 73.45 109.316 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . 0.447 ' CB ' ' HB3' ' A' ' 199' ' ' SER . 31.3 mt-10 -114.93 131.48 56.87 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.463 1.102 . . . . 73.11 110.325 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . 0.504 ' OE2' ' CG2' ' A' ' 96' ' ' VAL . 3.4 tt0 -109.47 -23.19 11.64 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.492 1.12 . . . . 64.33 110.321 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . 0.449 ' N ' HD21 ' A' ' 176' ' ' LEU . 0.0 OUTLIER -107.09 8.44 30.22 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.483 1.115 . . . . 72.15 110.269 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 199' ' ' SER . . . . . 0.447 ' HB3' ' CB ' ' A' ' 196' ' ' GLU . 28.6 t -99.91 163.49 12.43 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.545 1.153 . . . . 75.04 109.982 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 5.8 tpm_? -75.81 -20.83 57.88 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.477 1.111 . . . . 74.02 110.301 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -99.88 26.26 25.12 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.53 1.143 . . . . 70.41 111.045 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 202' ' ' PHE . . . . . 0.616 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 0.2 OUTLIER -60.87 -43.9 93.08 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.483 0.755 . . . . 72.13 110.983 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 203' ' ' PRO . . . . . 0.616 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -74.96 -37.89 1.85 Allowed 'Trans proline' 0 C--N 1.361 1.19 0 O-C-N 124.447 1.761 . . . . 61.51 110.944 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.04 -57.99 9.47 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.558 1.161 . . . . 71.34 110.431 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 205' ' ' GLN . . . . . 0.441 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 1.1 mt-30 -59.57 -45.64 91.25 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.45 1.094 . . . . 74.31 110.293 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 206' ' ' VAL . . . . . 0.542 HG12 ' CE1' ' A' ' 104' ' ' PHE . 55.0 t -56.48 -33.8 39.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 O-C-N 124.477 1.11 . . . . 74.43 109.269 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -73.57 -60.0 2.45 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.496 1.123 . . . . 64.5 110.241 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 80.5 mtt-85 -56.06 -63.38 1.2 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.538 1.149 . . . . 74.15 110.332 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 209' ' ' ILE . . . . . 0.578 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 25.7 mt -46.45 -62.46 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.554 1.159 . . . . 72.21 109.339 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 210' ' ' PHE . . . . . 0.578 ' CE1' ' CG2' ' A' ' 209' ' ' ILE . 1.8 m-85 -97.09 68.8 2.29 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.502 1.126 . . . . 74.43 111.034 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.79 144.52 39.65 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.497 1.123 . . . . 74.11 110.299 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 215' ' ' TYR . 39.6 tt0 -49.21 -55.16 13.41 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.479 1.112 . . . . 65.54 110.355 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.26 -23.96 1.04 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.452 1.095 . . . . 72.13 110.005 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 40.6 t -96.25 -29.19 3.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.412 1.07 . . . . 71.03 109.237 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 215' ' ' TYR . . . . . 0.45 ' N ' ' O ' ' A' ' 212' ' ' GLU . 5.8 t80 -62.98 -32.42 73.76 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.469 1.106 . . . . 73.31 110.966 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 45.6 mmtt -63.33 -46.95 84.24 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.51 1.131 . . . . 74.41 109.27 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 87.9 m -53.49 -66.45 0.39 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.457 1.098 . . . . 63.41 110.372 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 12.5 mp0 -55.5 -18.54 7.43 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.451 1.094 . . . . 74.42 110.23 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 219' ' ' GLN . . . . . 0.438 ' O ' ' NE2' ' A' ' 219' ' ' GLN . 23.8 tp60 -84.62 -33.31 23.33 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 124.471 1.107 . . . . 75.21 110.28 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 220' ' ' THR . . . . . 0.451 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 3.0 m -82.42 -28.93 31.06 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.508 1.13 . . . . 51.41 110.458 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 221' ' ' ILE . . . . . 0.417 HG23 ' N ' ' A' ' 167' ' ' TYR . 8.9 mt -75.07 -34.67 32.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.462 1.101 . . . . 74.43 109.323 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 222' ' ' TRP . . . . . 0.485 ' CD1' ' HA2' ' A' ' 131' ' ' GLY . 35.8 t90 -71.51 -57.84 4.05 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.492 1.12 . . . . 75.4 107.985 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . 0.451 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -52.74 -24.09 8.06 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.522 1.139 . . . . 74.21 109.239 179.989 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 . . . . . 0 C--N 1.325 -0.482 0 O-C-N 124.501 1.126 . . . . 62.12 110.373 179.977 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.59 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 7.3 p . . . . . 0 N--CA 1.453 -0.296 0 N-CA-C 109.262 -0.644 . . . . 75.43 109.262 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.404 ' O ' ' C ' ' A' ' 79' ' ' LEU . 31.9 t80 -86.83 18.25 3.58 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.473 1.108 . . . . 74.24 110.969 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.404 ' C ' ' O ' ' A' ' 78' ' ' PHE . 3.9 tp -39.31 157.33 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.498 1.124 . . . . 75.34 109.318 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.488 ' CG ' ' N ' ' A' ' 81' ' ' PHE . 4.9 ptmm? -104.69 -51.59 3.04 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.472 1.108 . . . . 74.4 109.335 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.589 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.2 OUTLIER -167.51 142.83 3.94 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.479 1.112 . . . . 73.31 111.043 179.99 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.475 HG23 ' CE ' ' A' ' 115' ' ' MET . 7.4 p -97.98 172.7 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.51 1.131 . . . . 72.31 109.272 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.456 ' CG2' ' HB ' ' A' ' 136' ' ' ILE . 5.3 mp -129.55 96.87 3.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.481 1.113 . . . . 71.5 109.288 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.463 ' HG ' ' CB ' ' A' ' 128' ' ' ALA . 5.5 mt -70.41 117.62 12.18 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.537 1.148 . . . . 74.52 109.317 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.577 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -142.22 174.57 10.49 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.559 1.162 . . . . 73.52 109.622 179.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.455 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -117.0 149.55 40.07 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.492 1.12 . . . . 63.55 109.282 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.08 -21.34 1.83 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.459 1.099 . . . . 74.34 110.28 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -66.66 -45.87 77.52 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.543 1.152 . . . . 74.24 109.304 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -132.0 44.22 2.93 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.453 1.096 . . . . 74.52 109.328 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.577 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -74.73 -23.83 58.63 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.466 1.104 . . . . 73.14 110.44 179.955 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -76.3 -39.04 55.18 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.464 1.103 . . . . 75.1 109.264 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.409 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 0.1 OUTLIER -61.57 -50.54 72.2 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.482 1.114 . . . . 71.22 110.285 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.539 ' CB ' ' CD2' ' A' ' 138' ' ' LEU . . . -59.71 -27.95 66.9 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.569 1.168 . . . . 71.1 109.348 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.424 ' O ' ' CD2' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -82.87 -33.38 27.02 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.524 1.14 . . . . 74.14 109.323 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 9.3 tpp180 -57.16 -28.51 62.82 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.517 1.136 . . . . 72.33 110.368 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.453 ' CG2' ' HE1' ' A' ' 173' ' ' MET . 1.7 t -84.48 -65.35 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.435 1.085 . . . . 75.52 109.324 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.434 ' HG3' ' N ' ' A' ' 98' ' ' ASN . 0.0 OUTLIER -39.99 -28.12 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.538 1.149 . . . . 71.42 110.319 179.993 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.442 ' N ' ' O ' ' A' ' 96' ' ' VAL . 2.1 t-20 -69.85 -52.67 22.91 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.504 1.128 . . . . 74.13 109.252 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.507 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -71.03 -21.58 62.25 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.549 1.155 . . . . 71.34 109.355 179.981 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.485 HD23 ' CD2' ' A' ' 99' ' ' LEU . 25.4 mt -60.15 -58.23 9.44 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.508 1.13 . . . . 74.24 109.277 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -75.28 59.13 1.0 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.534 1.146 . . . . 71.32 110.336 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -178.2 -64.06 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.439 1.087 . . . . 70.42 109.241 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -49.73 -50.68 43.19 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.491 1.119 . . . . 74.33 109.324 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.463 ' CZ ' HG11 ' A' ' 206' ' ' VAL . 2.6 m-85 -114.42 -22.47 9.84 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.494 1.121 . . . . 73.03 110.997 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.49 44.7 3.93 Favored Glycine 0 CA--C 1.53 1.021 0 O-C-N 124.524 1.14 . . . . 44.41 110.987 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.455 ' CG2' ' HD3' ' A' ' 80' ' ' LYS . 3.6 mm -86.97 87.66 2.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.476 0.75 . . . . 73.21 109.323 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.481 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -132.36 158.5 75.46 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.555 1.159 . . . . 70.14 109.28 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.481 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.01 167.06 81.6 Favored 'Cis proline' 0 C--N 1.36 1.175 0 C-N-CA 121.033 -2.486 . . . . 73.42 110.979 0.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.75 129.07 6.06 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.547 1.155 . . . . 74.41 110.989 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -148.05 132.4 9.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.502 0.766 . . . . 72.44 109.318 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 44.2 pt -91.83 -178.35 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.457 1.098 . . . . 75.33 109.318 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -81.53 -19.1 42.84 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.522 1.139 . . . . 70.55 111.006 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.465 ' CB ' HG21 ' A' ' 90' ' ' THR . . . -91.54 -3.05 56.92 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.455 1.097 . . . . 74.13 109.332 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -109.79 -26.75 9.66 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.465 1.103 . . . . 71.12 110.314 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.475 ' CE ' HG23 ' A' ' 82' ' ' VAL . 23.4 tpp -39.93 111.06 0.69 Allowed Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.571 1.169 . . . . 74.3 111.017 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 C--N 1.36 1.16 0 O-C-N 124.479 1.779 . . . . 75.13 111.021 179.98 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.293 0 N-CA-C 109.263 -0.643 . . . . 72.24 109.263 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.438 ' O ' ' N ' ' A' ' 129' ' ' VAL . 2.4 t70 -64.44 -22.24 66.9 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.526 1.141 . . . . 75.23 109.29 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -49.91 -23.48 1.98 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.501 1.126 . . . . 75.12 109.363 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.463 ' CB ' ' HG ' ' A' ' 84' ' ' LEU . . . -89.3 -33.16 17.03 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.469 1.105 . . . . 62.13 109.261 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.488 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 73.6 t -92.94 30.48 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.499 1.124 . . . . 74.1 109.299 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -135.29 118.89 16.99 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.544 1.152 . . . . 74.33 109.234 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . 0.561 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 66.59 62.97 4.17 Favored Glycine 0 CA--C 1.531 1.033 0 O-C-N 124.51 1.131 . . . . 73.21 111.009 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -154.92 -176.87 6.15 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.552 0.796 . . . . 75.54 110.068 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . 0.576 ' HB1' ' CE3' ' A' ' 134' ' ' TRP . . . -113.23 -32.22 6.36 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.438 1.086 . . . . 73.3 109.235 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.576 ' CE3' ' HB1' ' A' ' 133' ' ' ALA . 1.4 m-90 -161.48 160.2 28.93 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.489 1.118 . . . . 73.24 107.997 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.9 p -132.82 131.49 41.1 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.487 1.117 . . . . 74.41 110.428 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.456 ' HB ' ' CG2' ' A' ' 83' ' ' ILE . 9.8 mm -84.6 138.64 18.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.524 1.14 . . . . 74.03 109.334 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.407 ' CD1' HG12 ' A' ' 170' ' ' VAL . 4.1 mt -130.34 94.5 3.68 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.477 1.111 . . . . 74.03 109.341 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.539 ' CD2' ' CB ' ' A' ' 93' ' ' ALA . 0.5 OUTLIER -62.55 99.63 0.15 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.528 1.142 . . . . 71.33 109.32 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.55 116.35 5.54 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.43 1.081 . . . . 75.14 109.334 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' THR . . . . . 0.429 ' HB ' ' CB ' ' A' ' 143' ' ' PHE . 5.8 m -139.4 179.69 6.4 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.559 1.162 . . . . 72.52 110.397 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -84.87 -36.67 21.39 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.482 1.114 . . . . 74.15 110.227 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -88.44 -32.82 18.09 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.494 1.121 . . . . 74.11 109.308 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.573 ' CD2' HG22 ' A' ' 147' ' ' THR . 51.1 t80 -72.44 -36.75 68.63 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.437 1.086 . . . . 72.33 110.926 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.483 ' CD1' ' N ' ' A' ' 145' ' ' ARG . 1.5 tm? -54.7 -67.49 0.26 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.533 1.145 . . . . 73.31 109.32 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.483 ' N ' ' CD1' ' A' ' 144' ' ' LEU . 0.0 OUTLIER -55.39 -18.4 6.7 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.551 1.157 . . . . 73.42 110.312 -179.975 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.69 -32.93 25.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.466 1.104 . . . . 72.22 109.321 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.603 ' O ' ' CD1' ' A' ' 151' ' ' PHE . 80.8 p -97.39 -7.02 32.76 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.552 1.158 . . . . 74.04 110.388 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.487 ' CH2' ' CB ' ' A' ' 186' ' ' PRO . 0.1 OUTLIER -94.24 -26.55 16.59 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.951 -1.129 . . . . 74.13 107.951 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 51.6 t -95.62 -26.39 15.77 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.488 1.117 . . . . 63.44 108.316 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 9.6 m-20 -77.92 -42.79 31.97 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.506 1.129 . . . . 72.15 109.347 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.647 ' CE2' ' CD1' ' A' ' 157' ' ' LEU . 4.0 m-85 -69.39 -51.08 40.11 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 73.13 110.981 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -46.6 -47.78 19.84 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.518 1.136 . . . . 73.35 110.266 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -68.83 -22.66 64.22 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.54 1.15 . . . . 72.13 110.983 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -118.9 91.94 3.68 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.464 1.103 . . . . 73.03 110.949 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.6 t -60.87 -15.65 32.93 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.537 1.148 . . . . 74.34 110.372 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 93.0 p -69.86 -20.7 63.4 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.449 1.093 . . . . 75.53 109.966 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.647 ' CD1' ' CE2' ' A' ' 151' ' ' PHE . 0.0 OUTLIER -86.27 -37.17 18.84 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.563 1.164 . . . . 75.24 109.279 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' MET . . . . . 0.435 ' HE2' ' CG1' ' A' ' 161' ' ' VAL . 18.4 mmt -62.95 -11.58 19.67 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.517 1.136 . . . . 71.51 111.001 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -62.47 -68.48 0.33 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.513 1.133 . . . . 74.13 109.29 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -34.21 71.86 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.506 1.129 . . . . 74.51 110.042 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . 0.508 ' CG1' ' CB ' ' A' ' 188' ' ' ALA . 87.5 t -55.68 -18.99 5.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.516 1.135 . . . . 75.02 109.357 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -92.03 35.7 0.98 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.555 1.16 . . . . 74.22 109.278 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.466 ' CD ' ' CG1' ' A' ' 192' ' ' ILE . 0.1 OUTLIER 40.18 64.31 0.93 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.494 1.121 . . . . 72.3 110.294 -179.998 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -96.28 -174.78 3.16 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.479 1.112 . . . . 73.33 110.293 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 31.9 p80 -141.72 55.75 1.5 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.479 1.112 . . . . 73.3 109.598 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.2 tptm -90.89 -175.46 4.36 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.497 1.123 . . . . 74.2 109.272 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 167' ' ' TYR . . . . . 0.662 ' CD1' ' CG2' ' A' ' 221' ' ' ILE . 10.8 m-85 -37.65 -46.86 0.91 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.435 1.084 . . . . 74.35 110.893 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . 0.435 ' ND2' ' O ' ' A' ' 129' ' ' VAL . 0.6 OUTLIER -112.58 164.11 13.71 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.467 1.104 . . . . 74.44 109.305 -179.99 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 169' ' ' SER . . . . . 0.418 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 5.9 m -124.66 175.11 7.42 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.515 1.135 . . . . 72.42 110.057 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.407 HG12 ' CD1' ' A' ' 137' ' ' LEU . 2.1 t -133.88 122.44 42.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 O-C-N 124.491 1.119 . . . . 75.43 109.319 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.4 mp -132.72 103.24 13.36 Favored Pre-proline 0 C--N 1.324 -0.506 0 O-C-N 124.583 1.177 . . . . 73.21 109.254 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . 0.488 ' CB ' ' HB3' ' A' ' 189' ' ' LEU . 18.3 Cg_endo -74.99 112.65 3.61 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.51 1.795 . . . . 72.11 111.025 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 173' ' ' MET . . . . . 0.453 ' HE1' ' CG2' ' A' ' 96' ' ' VAL . 5.5 ttt -92.92 157.55 16.29 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.443 1.089 . . . . 73.15 110.961 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -113.54 120.26 39.96 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.511 1.132 . . . . 75.34 110.288 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.01 154.47 42.46 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.455 1.766 . . . . 73.12 110.963 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . 0.613 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -88.22 -43.21 11.77 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.528 1.143 . . . . 75.52 109.249 -179.996 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -72.23 -27.15 62.34 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.461 1.101 . . . . 72.31 109.296 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 9.8 m-20 -110.33 99.39 40.15 Favored Pre-proline 0 C--N 1.325 -0.483 0 O-C-N 124.484 1.115 . . . . 75.02 109.279 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -74.97 124.61 8.77 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.493 1.786 . . . . 74.13 111.058 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . 0.469 HD11 ' CB ' ' A' ' 184' ' ' ARG . 0.4 OUTLIER -136.0 96.34 13.02 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.531 1.145 . . . . 71.01 109.304 -179.983 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -75.07 171.7 17.79 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.481 1.78 . . . . 73.04 110.998 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 17.2 ptt180 -59.37 -32.27 69.97 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 73.31 110.255 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -60.74 -14.82 23.58 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.487 1.117 . . . . 75.3 110.328 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 184' ' ' ARG . . . . . 0.469 ' CB ' HD11 ' A' ' 180' ' ' LEU . 30.8 mmt180 -113.79 -28.61 7.37 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.48 1.113 . . . . 72.11 110.232 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 185' ' ' THR . . . . . . . . . . . . . 61.0 m -66.51 139.47 96.1 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.49 1.119 . . . . 73.33 110.422 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 186' ' ' PRO . . . . . 0.487 ' CB ' ' CH2' ' A' ' 148' ' ' TRP . 18.4 Cg_endo -74.96 145.4 31.53 Favored 'Trans proline' 0 C--N 1.36 1.132 0 O-C-N 124.488 1.783 . . . . 61.23 110.997 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 187' ' ' PHE . . . . . 0.479 ' O ' ' CD1' ' A' ' 187' ' ' PHE . 5.2 t80 -59.73 -13.67 11.05 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.512 1.133 . . . . 72.23 110.985 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . 0.508 ' CB ' ' CG1' ' A' ' 161' ' ' VAL . . . -86.92 -53.77 4.71 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.509 1.131 . . . . 74.43 109.301 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.488 ' HB3' ' CB ' ' A' ' 172' ' ' PRO . 23.9 mt -76.57 -11.8 59.92 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.41 1.068 . . . . 74.5 109.261 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 190' ' ' GLN . . . . . 0.499 ' CG ' ' O ' ' A' ' 190' ' ' GLN . 4.7 tt0 -86.81 -0.78 57.03 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.494 1.121 . . . . 53.14 110.283 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 191' ' ' THR . . . . . 0.416 ' HB ' ' CZ ' ' A' ' 163' ' ' ARG . 3.4 p -115.72 -30.7 6.05 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.517 1.135 . . . . 74.54 110.426 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.466 ' CG1' ' CD ' ' A' ' 163' ' ' ARG . 7.2 mt -65.1 169.36 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.507 1.129 . . . . 74.23 109.3 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -76.17 57.32 1.11 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.497 1.123 . . . . 72.43 109.32 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . 0.445 ' O ' ' NE2' ' A' ' 205' ' ' GLN . . . -43.07 142.08 1.03 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.451 1.094 . . . . 72.3 109.307 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 195' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.9 126.1 35.24 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.499 1.125 . . . . 63.42 109.297 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . 0.404 ' HB3' ' CB ' ' A' ' 199' ' ' SER . 38.7 mt-10 -101.44 130.57 47.7 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.549 1.156 . . . . 72.42 110.326 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . 0.465 ' HG3' ' CD2' ' A' ' 176' ' ' LEU . 8.8 tp10 -113.61 -23.94 9.49 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.517 1.135 . . . . 75.13 110.311 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -103.06 4.03 36.72 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.498 1.124 . . . . 72.01 110.296 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 199' ' ' SER . . . . . 0.404 ' CB ' ' HB3' ' A' ' 196' ' ' GLU . 14.7 t -97.59 174.9 6.42 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.489 1.118 . . . . 70.35 109.98 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -70.64 -60.36 2.3 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.515 1.134 . . . . 74.44 110.244 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -78.82 51.34 3.76 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.459 1.099 . . . . 71.41 110.976 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 202' ' ' PHE . . . . . 0.614 ' CD1' ' C ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -78.39 -47.27 2.0 Allowed Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.526 0.78 . . . . 74.15 110.972 -179.993 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 203' ' ' PRO . . . . . 0.58 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.3 Cg_endo -75.02 -27.44 9.97 Favored 'Trans proline' 0 C--N 1.36 1.145 0 O-C-N 124.444 1.76 . . . . 71.23 110.99 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.51 -50.77 71.38 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.615 1.197 . . . . 73.44 110.438 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 205' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 0.2 OUTLIER -58.75 -63.18 1.38 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.518 1.136 . . . . 75.12 110.31 -179.989 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 206' ' ' VAL . . . . . 0.58 ' CG1' ' HA ' ' A' ' 203' ' ' PRO . 2.7 p -38.82 -33.86 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.495 1.122 . . . . 71.2 109.304 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 207' ' ' GLU . . . . . 0.414 ' N ' ' C ' ' A' ' 205' ' ' GLN . 1.0 OUTLIER -76.39 -65.68 0.9 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.541 1.151 . . . . 71.51 110.283 -179.961 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 82.9 mtt-85 -47.82 -58.07 4.82 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.53 1.144 . . . . 71.54 110.276 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 209' ' ' ILE . . . . . 0.595 HG23 ' CE1' ' A' ' 210' ' ' PHE . 3.3 mt -52.56 -70.75 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.481 1.113 . . . . 73.12 109.341 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 210' ' ' PHE . . . . . 0.595 ' CE1' HG23 ' A' ' 209' ' ' ILE . 0.7 OUTLIER -84.9 65.28 9.11 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.534 1.146 . . . . 72.32 111.045 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 211' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' A' ' 215' ' ' TYR . 0.2 OUTLIER -110.59 146.65 35.73 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.447 1.092 . . . . 75.22 110.262 -179.968 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' A' ' 215' ' ' TYR . 60.7 tt0 -48.33 -55.39 10.8 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 73.43 110.334 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.3 m -48.6 -25.23 1.64 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.544 1.152 . . . . 74.45 109.995 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 32.8 t -96.21 -26.35 4.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.485 1.116 . . . . 70.2 109.304 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 215' ' ' TYR . . . . . 0.455 ' N ' ' O ' ' A' ' 212' ' ' GLU . 8.5 t80 -69.27 -33.83 73.82 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.519 1.137 . . . . 75.43 110.987 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . 0.442 ' O ' ' N ' ' A' ' 220' ' ' THR . 4.2 mmtp -52.18 -54.84 25.92 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.486 1.116 . . . . 75.53 109.265 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 217' ' ' THR . . . . . 0.452 ' O ' ' N ' ' A' ' 220' ' ' THR . 1.3 m -54.82 -65.19 0.62 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.478 1.111 . . . . 61.35 110.38 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -48.87 -28.35 3.7 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.472 1.107 . . . . 71.03 110.284 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 39.1 tp60 -84.68 -27.75 26.85 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.483 1.115 . . . . 73.23 110.328 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 220' ' ' THR . . . . . 0.452 ' N ' ' O ' ' A' ' 217' ' ' THR . 1.0 OUTLIER -79.96 -17.41 53.03 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.529 1.143 . . . . 71.45 110.465 179.923 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 221' ' ' ILE . . . . . 0.662 ' CG2' ' CD1' ' A' ' 167' ' ' TYR . 7.4 mt -89.21 -45.58 15.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.559 1.162 . . . . 74.51 109.329 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 222' ' ' TRP . . . . . 0.59 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 41.7 t90 -68.57 -18.74 64.4 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.573 1.171 . . . . 74.2 107.982 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.76 -24.12 20.46 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.448 1.093 . . . . 71.12 109.271 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 . . . . . 0 C--N 1.324 -0.514 0 O-C-N 124.495 1.122 . . . . 75.13 110.294 179.998 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.61 ' O ' ' CZ2' ' A' ' 222' ' ' TRP . 3.2 p . . . . . 0 N--CA 1.454 -0.268 0 N-CA-C 109.257 -0.646 . . . . 70.44 109.257 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.438 ' CE1' ' NE2' ' A' ' 219' ' ' GLN . 5.8 t80 -87.75 26.9 1.22 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.511 1.132 . . . . 75.45 110.969 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.402 ' O ' ' O ' ' A' ' 78' ' ' PHE . 4.5 tp -41.03 160.89 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.538 1.149 . . . . 74.42 109.309 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.486 ' HZ3' ' N ' ' A' ' 107' ' ' LYS . 6.4 ptmt -111.9 -47.22 3.15 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.529 1.143 . . . . 71.53 109.336 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.596 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.2 OUTLIER -167.32 139.58 3.31 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.516 1.135 . . . . 74.02 110.998 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.471 ' CG2' ' CE ' ' A' ' 115' ' ' MET . 7.3 p -96.72 165.42 2.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.544 1.152 . . . . 72.41 109.322 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.448 HG13 ' CG1' ' A' ' 136' ' ' ILE . 5.3 mp -126.01 97.2 4.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.569 1.168 . . . . 71.44 109.283 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.515 HD22 ' CG ' ' A' ' 112' ' ' PHE . 10.9 mt -70.88 117.37 12.3 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.525 1.14 . . . . 74.2 109.341 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.562 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -138.66 174.26 10.72 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.449 1.093 . . . . 70.1 109.646 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.453 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -124.83 149.08 47.83 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.499 1.125 . . . . 74.32 109.306 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -44.6 -27.05 0.43 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.436 1.085 . . . . 72.34 110.262 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 57.3 t0 -66.62 -44.83 80.99 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.542 1.151 . . . . 70.42 109.309 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.452 ' N ' ' O ' ' A' ' 86' ' ' ALA . 22.9 m-20 -124.01 41.27 3.53 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.515 1.135 . . . . 74.1 109.296 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.562 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -70.51 -41.11 73.03 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.469 1.106 . . . . 74.12 110.442 179.947 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -69.92 -31.96 70.0 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.468 1.105 . . . . 74.51 109.319 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -60.16 -69.45 0.22 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.525 1.141 . . . . 74.14 110.288 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.469 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -46.09 -28.87 1.31 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.526 1.141 . . . . 62.12 109.269 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.37 -57.63 5.04 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.516 1.135 . . . . 71.13 109.286 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 11.4 tpp180 -41.4 -36.2 0.8 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.457 1.098 . . . . 74.52 110.347 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.44 ' C ' ' N ' ' A' ' 98' ' ' ASN . 1.9 t -77.75 -65.15 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 O-C-N 124.493 1.121 . . . . 74.42 109.334 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.432 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.1 OUTLIER -45.14 -21.84 0.09 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.52 1.138 . . . . 74.12 110.309 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.44 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.1 t-20 -78.57 -59.64 2.7 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.519 1.137 . . . . 71.41 109.3 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.511 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -61.8 -22.11 65.18 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.556 1.16 . . . . 74.11 109.312 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 15.5 mt -64.64 -55.55 19.46 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.534 1.147 . . . . 63.12 109.252 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -78.82 54.01 1.47 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.506 1.129 . . . . 74.42 110.287 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -174.78 -67.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.515 1.135 . . . . 75.31 109.242 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -45.26 -51.86 10.29 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.523 1.14 . . . . 73.01 109.346 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.555 ' CE2' HG13 ' A' ' 206' ' ' VAL . 4.6 m-85 -113.4 -24.92 9.05 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.41 1.069 . . . . 75.22 110.942 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.406 ' C ' ' CD ' ' A' ' 107' ' ' LYS . . . 92.59 44.72 3.89 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.538 1.149 . . . . 74.24 111.031 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 8.5 mm -84.35 75.22 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 O-C-N 124.497 0.763 . . . . 73.22 109.35 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.506 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -119.56 156.38 53.51 Favored Pre-proline 0 C--N 1.326 -0.451 0 O-C-N 124.417 1.073 . . . . 71.21 109.282 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.506 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.95 161.36 94.99 Favored 'Cis proline' 0 C--N 1.359 1.111 0 C-N-CA 121.001 -2.499 . . . . 70.55 111.015 -0.048 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -135.91 118.7 1.89 Allowed Glycine 0 CA--C 1.53 0.995 0 O-C-N 124.422 1.076 . . . . 73.22 111.016 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 1.3 tt -136.06 149.89 27.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.55 0.794 . . . . 74.52 109.296 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 33.5 pt -98.11 161.0 3.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.439 1.087 . . . . 73.24 109.336 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.524 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 2.5 t80 -62.04 -19.21 62.66 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.52 1.138 . . . . 74.34 111.059 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -87.33 -11.6 48.96 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.517 1.136 . . . . 74.13 109.386 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -104.08 -20.88 13.69 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.486 1.117 . . . . 73.41 110.321 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.471 ' CE ' ' CG2' ' A' ' 82' ' ' VAL . 21.9 tpp -44.57 134.36 4.66 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 124.464 1.102 . . . . 61.24 110.98 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 C--N 1.36 1.177 0 O-C-N 124.531 1.806 . . . . 61.4 110.992 -179.981 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.271 0 N-CA-C 109.291 -0.633 . . . . 75.23 109.291 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.432 ' HA ' ' CG2' ' A' ' 129' ' ' VAL . 0.6 OUTLIER -41.31 -59.02 1.66 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.481 1.113 . . . . 73.3 109.307 -179.996 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -43.64 -46.95 7.54 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.492 1.12 . . . . 71.55 109.333 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.524 ' HB2' ' CE1' ' A' ' 112' ' ' PHE . . . -61.52 -46.66 89.0 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.427 1.079 . . . . 73.21 109.268 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.432 ' CG2' ' HA ' ' A' ' 126' ' ' ASP . 35.2 m -92.38 30.94 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.525 1.14 . . . . 63.43 109.309 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.403 ' N ' ' O ' ' A' ' 126' ' ' ASP . 8.9 t30 -148.46 118.48 7.2 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.494 1.121 . . . . 75.54 109.32 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 102.78 34.15 4.16 Favored Glycine 0 CA--C 1.53 1.028 0 O-C-N 124.515 1.135 . . . . 74.52 110.928 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' SER . . . . . 0.403 ' O ' ' O ' ' A' ' 167' ' ' TYR . 0.7 OUTLIER -163.54 -173.81 3.46 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.503 0.767 . . . . 74.23 110.025 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . 0.568 ' HB1' ' CE3' ' A' ' 134' ' ' TRP . . . -91.09 -68.59 0.78 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.456 1.097 . . . . 74.35 109.275 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.58 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 0.9 OUTLIER -121.52 174.86 6.51 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.509 1.131 . . . . 73.42 108.021 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' THR . . . . . 0.437 ' N ' ' O ' ' A' ' 169' ' ' SER . 2.5 p -143.28 136.0 27.56 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.483 1.114 . . . . 72.32 110.374 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.448 ' CG1' HG13 ' A' ' 83' ' ' ILE . 14.5 mm -89.5 113.46 25.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.477 1.111 . . . . 73.42 109.29 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.593 ' CD1' ' CG1' ' A' ' 170' ' ' VAL . 2.8 mt -99.06 89.65 4.34 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.536 1.147 . . . . 75.24 109.278 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.409 ' O ' ' CG ' ' A' ' 143' ' ' PHE . 2.4 tp -62.2 102.3 0.29 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.472 1.107 . . . . 65.12 109.286 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 55.2 mt -77.37 121.24 23.5 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.461 1.101 . . . . 73.52 109.344 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' THR . . . . . 0.463 ' HB ' ' CB ' ' A' ' 143' ' ' PHE . 10.6 m -139.74 162.19 35.73 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.523 1.14 . . . . 70.53 110.397 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -53.65 -40.86 66.21 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.566 1.166 . . . . 74.43 110.295 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . 0.418 ' ND2' ' N ' ' A' ' 143' ' ' PHE . 2.5 p-10 -89.76 -52.32 5.05 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.442 1.089 . . . . 72.31 109.326 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.463 ' CB ' ' HB ' ' A' ' 140' ' ' THR . 6.6 t80 -49.51 -27.64 4.58 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.481 1.113 . . . . 74.55 110.926 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.475 ' O ' ' CB ' ' A' ' 148' ' ' TRP . 2.1 tm? -63.0 -67.98 0.38 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.471 1.107 . . . . 70.43 109.336 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.463 ' CD ' ' C ' ' A' ' 145' ' ' ARG . 0.2 OUTLIER -65.32 -14.7 61.39 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.507 1.129 . . . . 71.31 110.242 -179.977 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -67.51 -60.64 2.4 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.498 1.124 . . . . 74.41 109.313 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.511 ' HB ' ' CE1' ' A' ' 151' ' ' PHE . 2.3 p -84.91 -47.52 10.22 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.519 1.137 . . . . 75.22 110.416 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.475 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 33.0 t-105 -45.7 -30.52 1.61 Allowed 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.517 1.136 . . . . 73.05 108.084 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' CYS . . . . . 0.452 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 40.5 t -78.47 -45.68 21.52 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.462 1.101 . . . . 75.32 108.27 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' ASN . . . . . 0.463 ' N ' ' O ' ' A' ' 147' ' ' THR . 17.2 m-80 -67.41 -13.66 62.22 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.475 1.109 . . . . 75.13 109.289 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.567 ' CZ ' HD22 ' A' ' 157' ' ' LEU . 5.4 m-30 -80.62 -51.05 9.17 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.505 1.128 . . . . 72.41 111.025 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -50.91 -40.36 56.78 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.541 1.151 . . . . 73.34 110.349 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 51.4 t80 -83.8 -17.37 41.29 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.489 1.118 . . . . 62.4 111.017 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.453 ' CD2' ' OG ' ' A' ' 156' ' ' SER . 1.3 t80 -136.9 105.7 5.89 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.515 1.134 . . . . 72.11 110.946 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 4.0 t -78.06 -2.96 39.8 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.411 1.07 . . . . 72.22 110.461 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' SER . . . . . 0.453 ' OG ' ' CD2' ' A' ' 154' ' ' TYR . 10.2 p -44.39 -49.42 9.68 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.474 1.109 . . . . 54.44 110.032 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.567 HD22 ' CZ ' ' A' ' 151' ' ' PHE . 4.4 mp -70.76 -42.47 70.39 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.458 1.099 . . . . 72.11 109.278 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' MET . . . . . 0.424 ' HE2' ' CD2' ' A' ' 151' ' ' PHE . 0.3 OUTLIER -50.57 -21.53 1.58 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.512 1.132 . . . . 73.51 111.002 -179.943 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' ASN . . . . . 0.437 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 74.1 m-20 -82.87 -32.77 27.26 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.549 1.156 . . . . 73.34 109.289 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 160' ' ' SER . . . . . 0.455 ' CB ' HG22 ' A' ' 170' ' ' VAL . 6.0 m -79.88 -31.56 40.35 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.55 1.156 . . . . 74.04 110.014 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . 0.543 ' CG1' ' CD1' ' A' ' 192' ' ' ILE . 96.5 t -61.28 -18.59 18.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.482 1.114 . . . . 74.2 109.264 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -66.41 -20.54 66.09 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.526 1.141 . . . . 61.03 109.267 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.467 ' NH1' ' H ' ' A' ' 193' ' ' ASN . 15.7 mmm-85 69.03 43.79 1.09 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.543 1.152 . . . . 74.31 110.301 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . 0.437 ' NE2' ' O ' ' A' ' 159' ' ' ASN . 12.3 mt-30 -69.99 176.73 3.55 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.484 1.115 . . . . 63.14 110.255 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 11.2 m80 -90.69 39.58 0.99 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.523 1.14 . . . . 71.02 109.607 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -90.74 -178.73 5.34 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.53 1.144 . . . . 73.33 109.319 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 167' ' ' TYR . . . . . 0.413 ' N ' HG22 ' A' ' 221' ' ' ILE . 0.4 OUTLIER -85.63 44.46 1.11 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.514 1.133 . . . . 74.33 110.976 -179.983 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . 0.408 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 7.7 p30 -170.36 124.27 0.71 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.505 1.128 . . . . 74.45 109.301 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 169' ' ' SER . . . . . 0.452 ' N ' ' O ' ' A' ' 133' ' ' ALA . 2.5 m -125.0 111.52 15.49 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.486 1.116 . . . . 60.5 110.017 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.593 ' CG1' ' CD1' ' A' ' 137' ' ' LEU . 3.8 t -79.45 112.78 17.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.57 1.168 . . . . 62.35 109.296 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.7 mp -129.15 102.53 18.79 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.524 1.14 . . . . 75.4 109.264 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . 0.504 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.03 114.8 4.11 Favored 'Trans proline' 0 C--N 1.36 1.164 0 O-C-N 124.479 1.779 . . . . 70.41 111.056 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 173' ' ' MET . . . . . 0.466 ' HE1' ' CG ' ' A' ' 197' ' ' GLU . 6.1 ttt -80.2 161.55 25.14 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.527 1.142 . . . . 75.23 110.982 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 195' ' ' LEU . 75.0 mtt-85 -107.63 112.1 62.39 Favored Pre-proline 0 C--N 1.326 -0.435 0 O-C-N 124.528 1.142 . . . . 74.12 110.259 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.98 154.69 42.79 Favored 'Trans proline' 0 C--N 1.36 1.168 0 O-C-N 124.446 1.761 . . . . 74.03 110.987 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . 0.5 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -100.36 -45.34 5.61 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.453 1.095 . . . . 73.21 109.312 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . 0.436 ' H ' ' ND2' ' A' ' 177' ' ' ASN . 2.1 p30 -72.73 -25.12 61.1 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 73.12 109.323 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -108.75 101.7 44.89 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.507 1.129 . . . . 72.43 109.211 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.05 117.61 4.96 Favored 'Trans proline' 0 C--N 1.36 1.184 0 O-C-N 124.499 1.789 . . . . 73.13 111.001 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . 0.406 HD23 ' CB ' ' A' ' 184' ' ' ARG . 0.9 OUTLIER -132.97 96.67 17.57 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.561 1.163 . . . . 71.25 109.279 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.04 164.31 33.54 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.471 1.774 . . . . 63.42 110.991 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.04 -38.98 54.79 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.473 1.108 . . . . 73.24 110.279 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -49.45 -33.16 13.46 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.483 1.115 . . . . 74.24 110.325 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 184' ' ' ARG . . . . . 0.406 ' CB ' HD23 ' A' ' 180' ' ' LEU . 58.7 mmt-85 -91.83 -21.77 20.47 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.584 1.178 . . . . 73.23 110.317 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 185' ' ' THR . . . . . 0.425 ' HA ' ' HD3' ' A' ' 186' ' ' PRO . 19.4 m -84.36 143.86 42.54 Favored Pre-proline 0 C--N 1.325 -0.468 0 O-C-N 124.452 1.095 . . . . 74.41 110.412 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 186' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 185' ' ' THR . 18.3 Cg_endo -74.99 156.56 43.04 Favored 'Trans proline' 0 C--N 1.36 1.164 0 O-C-N 124.496 1.787 . . . . 63.42 111.007 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 187' ' ' PHE . . . . . 0.451 ' O ' ' CG2' ' A' ' 191' ' ' THR . 32.3 p90 -70.03 -7.03 37.71 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.493 1.121 . . . . 74.11 110.996 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -94.26 -52.9 4.16 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.46 1.1 . . . . 72.25 109.23 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 44.2 mt -68.48 -42.09 79.19 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.513 1.133 . . . . 75.25 109.334 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 190' ' ' GLN . . . . . 0.417 ' CG ' HG22 ' A' ' 191' ' ' THR . 1.4 pt20 -64.01 -9.9 18.67 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.523 1.139 . . . . 75.45 110.27 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 191' ' ' THR . . . . . 0.451 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 41.4 p -116.56 20.0 14.32 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.451 1.095 . . . . 75.32 110.38 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.543 ' CD1' ' CG1' ' A' ' 161' ' ' VAL . 6.5 mt -120.58 154.43 23.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.478 1.111 . . . . 74.41 109.285 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 193' ' ' ASN . . . . . 0.467 ' H ' ' NH1' ' A' ' 163' ' ' ARG . 35.4 t30 -64.84 77.47 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.491 1.12 . . . . 72.15 109.294 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . 0.504 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -73.51 174.78 7.75 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.496 1.123 . . . . 74.21 109.28 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 195' ' ' LEU . . . . . 0.447 ' O ' ' N ' ' A' ' 174' ' ' ARG . 0.4 OUTLIER -108.3 150.88 26.73 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.472 1.108 . . . . 71.34 109.348 179.97 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . 0.421 ' N ' HD13 ' A' ' 195' ' ' LEU . 26.3 mt-10 -141.92 141.4 32.98 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.429 1.08 . . . . 75.54 110.338 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . 0.466 ' CG ' ' HE1' ' A' ' 173' ' ' MET . 1.2 pt-20 -113.21 -28.78 7.5 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.474 1.109 . . . . 72.1 110.283 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . 0.432 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 21.0 pt-20 -88.37 3.01 51.37 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.488 1.117 . . . . 74.01 110.3 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 5.5 t -97.84 144.47 27.39 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.503 1.127 . . . . 73.35 110.03 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 4.8 tpm_? -61.87 -17.52 56.82 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.454 1.096 . . . . 71.23 110.253 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -103.07 19.05 47.63 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.47 1.106 . . . . 64.33 111.02 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 202' ' ' PHE . . . . . 0.597 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 0.1 OUTLIER -55.03 -44.34 99.55 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.469 0.747 . . . . 71.31 111.025 179.969 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 203' ' ' PRO . . . . . 0.597 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.05 -35.01 3.35 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.516 1.798 . . . . 60.05 110.963 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.98 -48.3 78.74 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.498 1.124 . . . . 74.23 110.362 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 205' ' ' GLN . . . . . 0.454 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 3.1 mt-30 -71.34 -38.7 71.64 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.443 1.09 . . . . 74.54 110.267 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 206' ' ' VAL . . . . . 0.571 HG23 ' CE1' ' A' ' 202' ' ' PHE . 70.7 t -65.71 -28.96 45.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.544 1.153 . . . . 73.31 109.327 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 207' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 2.8 mt-10 -78.04 -47.37 18.54 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.49 1.119 . . . . 72.51 110.337 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -68.97 -62.39 1.4 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.497 1.123 . . . . 70.12 110.253 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 209' ' ' ILE . . . . . 0.588 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 59.8 mt -47.92 -58.28 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.491 1.119 . . . . 73.41 109.328 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 210' ' ' PHE . . . . . 0.588 ' CE1' ' CG2' ' A' ' 209' ' ' ILE . 1.7 m-85 -99.46 66.68 1.48 Allowed 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.547 1.154 . . . . 71.35 110.996 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 211' ' ' GLN . . . . . 0.405 ' CB ' ' O ' ' A' ' 207' ' ' GLU . 0.0 OUTLIER -108.5 144.75 35.74 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.543 1.152 . . . . 75.32 110.321 179.974 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' A' ' 215' ' ' TYR . 29.3 tt0 -48.79 -55.26 12.06 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.575 1.172 . . . . 74.05 110.243 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.43 -24.85 1.39 Allowed 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.484 1.115 . . . . 74.42 110.017 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 43.9 t -96.71 -26.66 4.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.431 1.082 . . . . 72.12 109.277 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 215' ' ' TYR . . . . . 0.488 ' O ' ' CB ' ' A' ' 219' ' ' GLN . 1.8 t80 -69.2 -29.87 67.93 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.481 1.113 . . . . 75.12 110.98 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 29.8 mmtt -65.13 -66.32 0.56 Allowed 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.502 1.126 . . . . 74.44 109.322 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 10.1 m -44.44 -66.46 0.39 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.453 1.095 . . . . 74.21 110.376 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 218' ' ' GLN . . . . . 0.468 ' HA ' ' CD1' ' A' ' 221' ' ' ILE . 6.3 mp0 -47.29 -62.36 1.46 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.54 1.15 . . . . 72.45 110.285 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 219' ' ' GLN . . . . . 0.488 ' CB ' ' O ' ' A' ' 215' ' ' TYR . 33.8 tp60 -40.01 -46.03 2.02 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.452 1.095 . . . . 75.13 110.281 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.1 m -66.09 -44.39 84.52 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.463 1.102 . . . . 71.12 110.4 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 221' ' ' ILE . . . . . 0.468 ' CD1' ' HA ' ' A' ' 218' ' ' GLN . 15.4 mt -56.19 -24.4 17.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 O-C-N 124.559 1.162 . . . . 74.44 109.274 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 222' ' ' TRP . . . . . 0.61 ' CZ2' ' O ' ' A' ' 77' ' ' VAL . 73.4 t90 -78.24 -74.09 0.29 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.529 1.143 . . . . 73.21 108.006 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . 0.42 ' HG3' ' N ' ' A' ' 224' ' ' GLU . 0.3 OUTLIER -44.28 -26.08 0.29 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.44 1.087 . . . . 75.21 109.334 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . 0.436 ' N ' ' C ' ' A' ' 222' ' ' TRP . 3.2 mm-40 . . . . . 0 C--N 1.326 -0.436 0 O-C-N 124.521 1.138 . . . . 73.31 110.263 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.491 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.5 p . . . . . 0 N--CA 1.453 -0.325 0 N-CA-C 109.332 -0.618 . . . . 73.51 109.332 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.565 ' CE2' ' HD3' ' A' ' 108' ' ' PRO . 8.5 p90 -89.61 29.35 1.15 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.422 1.076 . . . . 72.05 110.99 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 5.8 tp -39.9 155.66 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.529 1.143 . . . . 74.14 109.328 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.414 ' NZ ' HD13 ' A' ' 106' ' ' ILE . 1.4 ttpt -95.69 -58.54 2.08 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.548 1.155 . . . . 72.03 109.31 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.61 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.2 OUTLIER -165.05 146.69 7.76 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.468 1.105 . . . . 70.24 111.056 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.528 ' CG2' ' CE ' ' A' ' 115' ' ' MET . 12.0 p -99.62 151.37 4.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.559 1.162 . . . . 72.23 109.335 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.483 ' CG1' HG13 ' A' ' 136' ' ' ILE . 4.6 mp -114.77 99.41 8.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.525 1.141 . . . . 74.1 109.268 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.428 HD12 ' CB ' ' A' ' 128' ' ' ALA . 1.9 mp -73.45 117.46 15.24 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.566 1.166 . . . . 75.52 109.31 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.594 ' CE1' ' OG1' ' A' ' 90' ' ' THR . 0.0 OUTLIER -135.58 166.49 23.1 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.531 1.144 . . . . 75.51 109.611 -179.999 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.453 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -105.03 155.61 18.81 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.566 1.166 . . . . 72.13 109.341 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -57.49 -17.03 11.4 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.536 1.148 . . . . 75.12 110.349 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -82.99 -43.16 16.71 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.465 1.103 . . . . 63.52 109.292 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.441 ' N ' ' OD1' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -119.1 42.97 2.7 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.525 1.141 . . . . 73.32 109.306 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.594 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -80.62 -25.97 38.07 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.571 1.169 . . . . 71.41 110.409 179.979 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.441 ' O ' ' N ' ' A' ' 95' ' ' ARG . 0.8 OUTLIER -79.81 -35.44 38.43 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.477 1.111 . . . . 75.53 109.334 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.462 ' O ' ' N ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -62.75 -66.89 0.47 Allowed 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.499 1.124 . . . . 71.42 110.259 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.481 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -47.31 -36.89 9.92 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.523 1.139 . . . . 54.41 109.302 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.415 HD21 ' CG ' ' A' ' 97' ' ' GLN . 0.1 OUTLIER -74.97 -33.39 61.88 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 124.483 1.115 . . . . 73.24 109.298 -179.966 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 92' ' ' GLU . 11.6 tpt180 -54.09 -46.67 72.13 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.515 1.135 . . . . 75.14 110.293 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.543 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 0.3 OUTLIER -76.21 -52.39 17.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.415 1.072 . . . . 74.21 109.327 179.978 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.543 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -48.15 -23.49 0.86 Allowed 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.521 1.138 . . . . 74.31 110.343 179.951 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -75.65 -38.59 58.72 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.557 1.161 . . . . 73.42 109.298 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.455 HD21 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -83.26 -21.67 33.26 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.515 1.134 . . . . 71.12 109.318 179.954 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.478 ' CD2' HG21 ' A' ' 206' ' ' VAL . 51.1 mt -61.97 -51.84 66.44 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.485 1.116 . . . . 74.1 109.285 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -76.39 55.1 0.97 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.524 1.14 . . . . 75.04 110.281 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -179.71 -67.43 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.497 1.123 . . . . 74.33 109.318 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -40.73 -60.96 1.03 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.523 1.139 . . . . 73.32 109.36 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.401 ' CZ ' HG13 ' A' ' 206' ' ' VAL . 1.3 m-85 -104.25 -19.47 14.1 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.477 1.111 . . . . 71.13 110.977 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.06 45.18 4.22 Favored Glycine 0 CA--C 1.529 0.945 0 O-C-N 124.493 1.121 . . . . 73.24 111.042 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.414 HD13 ' NZ ' ' A' ' 80' ' ' LYS . 6.6 mm -85.29 86.36 2.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.436 0.727 . . . . 74.02 109.298 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.494 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -138.06 157.2 73.39 Favored Pre-proline 0 C--N 1.326 -0.454 0 O-C-N 124.475 1.11 . . . . 74.2 109.322 179.951 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.565 ' HD3' ' CE2' ' A' ' 78' ' ' PHE . 18.0 Cg_endo -75.12 150.17 94.83 Favored 'Cis proline' 0 C--N 1.36 1.141 0 C-N-CA 120.938 -2.526 . . . . 75.42 110.987 0.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -122.65 137.73 11.44 Favored Glycine 0 CA--C 1.53 1.0 0 O-C-N 124.484 1.115 . . . . 75.4 110.955 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 1.2 tt -153.72 148.26 13.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.516 0.774 . . . . 73.3 109.334 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . 0.421 HD12 ' NE2' ' A' ' 85' ' ' HIS . 32.4 pt -101.39 161.45 3.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.482 1.114 . . . . 73.02 109.272 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -61.55 -19.6 62.33 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.46 1.1 . . . . 73.4 110.95 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -87.64 -12.41 45.59 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.536 1.148 . . . . 71.3 109.304 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -103.83 -17.49 15.03 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.528 1.142 . . . . 72.11 110.276 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.528 ' CE ' ' CG2' ' A' ' 82' ' ' VAL . 9.1 ttm -50.84 143.52 14.93 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.523 1.139 . . . . 71.21 110.996 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo . . . . . 0 C--N 1.359 1.13 0 O-C-N 124.532 1.806 . . . . 72.54 111.057 -179.999 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.495 ' CD1' ' O ' ' A' ' 150' ' ' ASN . 2.9 mt . . . . . 0 N--CA 1.454 -0.256 0 N-CA-C 109.339 -0.615 . . . . 71.14 109.339 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.474 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 0.2 OUTLIER -40.31 -44.23 1.88 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.49 1.119 . . . . 73.34 109.278 -179.995 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -50.07 -49.68 50.54 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.477 1.11 . . . . 55.54 109.362 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.453 ' N ' ' O ' ' A' ' 125' ' ' LEU . . . -68.87 -38.56 79.8 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.53 1.144 . . . . 73.21 109.324 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.473 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 86.9 t -92.93 30.64 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.462 1.101 . . . . 74.4 109.288 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.474 ' CB ' ' O ' ' A' ' 126' ' ' ASP . 6.2 t30 -138.47 152.3 48.18 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.437 1.086 . . . . 75.44 109.296 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 51.35 53.51 27.83 Favored Glycine 0 CA--C 1.53 0.983 0 O-C-N 124.448 1.092 . . . . 32.35 110.982 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 1.2 p -163.4 -179.73 6.74 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.501 0.766 . . . . 74.43 109.974 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . 0.597 ' CB ' ' CZ3' ' A' ' 134' ' ' TRP . . . -104.25 -46.26 4.46 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.524 1.14 . . . . 74.12 109.29 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.597 ' CZ3' ' CB ' ' A' ' 133' ' ' ALA . 0.5 OUTLIER -145.51 174.29 11.28 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.567 1.167 . . . . 75.23 108.042 -179.978 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' THR . . . . . 0.438 HG23 ' CG1' ' A' ' 82' ' ' VAL . 2.4 p -139.22 129.18 25.01 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.497 1.123 . . . . 63.3 110.387 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.483 HG13 ' CG1' ' A' ' 83' ' ' ILE . 15.0 mm -84.4 95.0 3.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.393 1.058 . . . . 74.03 109.292 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 13.2 mt -82.69 94.19 7.53 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.486 1.116 . . . . 72.54 109.344 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.59 ' O ' ' CD1' ' A' ' 143' ' ' PHE . 3.3 tp -61.3 97.71 0.07 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.513 1.133 . . . . 75.23 109.345 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.426 HD13 ' CD1' ' A' ' 189' ' ' LEU . 2.0 tp -70.22 105.75 3.07 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.478 1.112 . . . . 74.13 109.296 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' THR . . . . . 0.419 ' HB ' ' CB ' ' A' ' 143' ' ' PHE . 4.8 m -133.63 154.88 50.56 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.471 1.107 . . . . 73.3 110.389 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -49.96 -39.1 39.59 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.546 1.154 . . . . 74.02 110.302 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -89.0 -53.89 4.38 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.53 1.144 . . . . 61.11 109.318 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.59 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 16.8 t80 -51.19 -20.53 1.59 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.521 1.138 . . . . 73.11 111.044 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.519 ' O ' ' CB ' ' A' ' 148' ' ' TRP . 2.0 tm? -60.85 -68.06 0.34 Allowed 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.45 1.094 . . . . 71.21 109.336 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.451 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 2.0 mpt_? -67.52 -12.21 59.81 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.462 1.101 . . . . 75.04 110.3 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . 0.4 ' O ' ' CG ' ' A' ' 150' ' ' ASN . 27.6 t0 -65.84 -61.45 2.05 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.563 1.164 . . . . 73.43 109.303 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.555 ' OG1' ' CE1' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -88.23 -46.5 9.19 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.554 1.159 . . . . 62.54 110.407 -179.981 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.519 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 32.1 t-105 -44.52 -34.4 2.09 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.522 1.139 . . . . 65.21 107.979 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' CYS . . . . . 0.451 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 42.3 t -77.87 -45.43 24.24 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.502 1.126 . . . . 62.13 108.304 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' ASN . . . . . 0.495 ' O ' ' CD1' ' A' ' 125' ' ' LEU . 31.1 m-20 -62.51 -16.93 58.41 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.446 1.091 . . . . 74.43 109.306 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.568 ' CZ ' ' CD1' ' A' ' 157' ' ' LEU . 8.7 m-30 -82.19 -47.8 12.05 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.515 1.135 . . . . 72.01 111.063 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -48.15 -39.83 21.93 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.499 1.124 . . . . 74.04 110.291 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -83.96 -23.23 31.18 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.47 1.106 . . . . 75.33 110.924 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -129.13 97.99 4.78 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.467 1.105 . . . . 74.14 111.016 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.45 -2.7 57.64 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.523 1.139 . . . . 74.5 110.411 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 1.8 m -53.88 -38.23 64.53 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.513 1.133 . . . . 73.22 110.01 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.568 ' CD1' ' CZ ' ' A' ' 151' ' ' PHE . 2.3 pp -89.58 -27.66 20.08 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.451 1.094 . . . . 75.11 109.315 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' MET . . . . . . . . . . . . . 12.4 tpp -54.66 -26.28 32.28 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.487 1.117 . . . . 64.34 110.972 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' ASN . . . . . 0.423 ' HB3' ' NE2' ' A' ' 164' ' ' GLN . 54.6 m-80 -66.56 -31.17 71.7 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.559 1.162 . . . . 75.25 109.322 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 160' ' ' SER . . . . . 0.462 ' HB3' ' CG2' ' A' ' 170' ' ' VAL . 0.3 OUTLIER -74.86 -28.15 60.55 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.521 1.138 . . . . 75.03 110.077 179.922 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . 0.454 HG11 ' CD1' ' A' ' 192' ' ' ILE . 82.4 t -57.39 -17.85 7.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.487 1.117 . . . . 74.31 109.348 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -91.42 35.71 0.94 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.622 1.201 . . . . 73.3 109.211 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.428 ' HE ' ' N ' ' A' ' 163' ' ' ARG . 0.0 OUTLIER 47.34 32.44 2.22 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.49 1.119 . . . . 72.02 110.294 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . 0.423 ' NE2' ' HB3' ' A' ' 159' ' ' ASN . 0.2 OUTLIER -56.42 129.01 38.8 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.469 1.106 . . . . 71.42 110.261 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 16.0 t-80 -85.97 48.57 1.63 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.507 1.129 . . . . 75.1 109.589 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 3.0 tptp -95.63 171.89 8.39 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.506 1.129 . . . . 75.13 109.204 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 167' ' ' TYR . . . . . 0.787 ' CE2' ' CD1' ' A' ' 222' ' ' TRP . 3.4 t80 -38.45 -64.49 0.42 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.501 1.125 . . . . 75.54 111.075 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . 0.431 ' ND2' ' CG1' ' A' ' 129' ' ' VAL . 1.2 p-10 -90.78 133.07 35.47 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.428 1.08 . . . . 72.24 109.271 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 169' ' ' SER . . . . . 0.454 ' N ' ' O ' ' A' ' 133' ' ' ALA . 1.8 t -108.78 177.24 4.83 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.569 1.168 . . . . 65.44 109.98 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.462 ' CG2' ' HB3' ' A' ' 160' ' ' SER . 3.2 t -137.36 103.36 2.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.498 1.124 . . . . 75.31 109.279 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.7 mp -121.95 99.95 43.57 Favored Pre-proline 0 C--N 1.324 -0.513 0 O-C-N 124.527 1.142 . . . . 72.42 109.274 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . 0.519 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.3 Cg_endo -75.03 118.85 5.4 Favored 'Trans proline' 0 C--N 1.36 1.178 0 O-C-N 124.444 1.76 . . . . 73.44 110.98 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 173' ' ' MET . . . . . 0.412 ' CE ' HG12 ' A' ' 96' ' ' VAL . 4.1 ttt -89.09 151.64 22.11 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.471 1.107 . . . . 64.32 110.962 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . 0.544 ' NH2' ' H ' ' A' ' 180' ' ' LEU . 0.2 OUTLIER -105.68 117.52 57.71 Favored Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.469 1.105 . . . . 74.3 110.286 -179.991 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.04 150.0 37.34 Favored 'Trans proline' 0 C--N 1.359 1.112 0 O-C-N 124.515 1.797 . . . . 72.34 110.99 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . 0.496 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -88.64 -38.86 14.48 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.528 1.142 . . . . 74.51 109.331 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -72.78 -26.48 61.55 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.459 1.099 . . . . 74.42 109.255 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 178' ' ' ASN . . . . . 0.437 ' O ' ' NH2' ' A' ' 174' ' ' ARG . 4.0 m-80 -110.76 103.03 53.9 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.55 1.156 . . . . 75.31 109.297 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.05 115.65 4.34 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.543 1.812 . . . . 71.14 110.963 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . 0.544 ' H ' ' NH2' ' A' ' 174' ' ' ARG . 0.4 OUTLIER -116.98 97.09 50.28 Favored Pre-proline 0 C--N 1.325 -0.484 0 O-C-N 124.557 1.161 . . . . 73.34 109.3 179.969 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 164.51 33.22 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.467 1.772 . . . . 75.22 111.016 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 59.4 mtt180 -67.13 -16.64 64.45 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.544 1.152 . . . . 72.31 110.335 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -74.81 -17.09 60.67 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.512 1.133 . . . . 65.4 110.342 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -117.41 16.69 14.71 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.525 1.141 . . . . 73.41 110.357 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 185' ' ' THR . . . . . 0.498 ' OG1' ' CD1' ' A' ' 180' ' ' LEU . 19.1 m -116.86 143.6 31.82 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.456 1.098 . . . . 73.24 110.435 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 186' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 185' ' ' THR . 18.5 Cg_endo -75.04 155.99 42.77 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.539 1.81 . . . . 73.54 111.022 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 187' ' ' PHE . . . . . 0.503 ' O ' ' CG2' ' A' ' 191' ' ' THR . 37.9 p90 -69.74 -7.26 37.95 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.516 1.135 . . . . 72.34 110.956 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.87 -52.74 4.29 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.502 1.126 . . . . 70.3 109.312 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.426 ' CD1' HD13 ' A' ' 139' ' ' LEU . 43.4 mt -68.45 -42.31 78.99 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.521 1.138 . . . . 73.42 109.29 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -63.98 -10.76 23.35 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.46 1.1 . . . . 75.4 110.344 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 191' ' ' THR . . . . . 0.503 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 35.7 p -113.64 19.92 16.37 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.535 1.147 . . . . 75.24 110.383 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.454 ' CD1' HG11 ' A' ' 161' ' ' VAL . 28.1 mt -113.28 160.64 12.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.486 1.116 . . . . 74.45 109.262 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 193' ' ' ASN . . . . . 0.44 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 35.7 t30 -76.39 62.88 1.89 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.502 1.127 . . . . 74.1 109.301 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . 0.519 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -56.96 143.41 38.03 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.441 1.088 . . . . 74.13 109.308 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 195' ' ' LEU . . . . . 0.423 HD21 ' N ' ' A' ' 206' ' ' VAL . 0.7 OUTLIER -80.26 123.49 28.01 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.47 1.106 . . . . 71.45 109.27 -179.926 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -103.43 137.5 41.44 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.453 1.096 . . . . 73.32 110.294 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . 0.444 ' HG3' ' CD1' ' A' ' 176' ' ' LEU . 0.6 OUTLIER -113.71 -24.73 9.02 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.552 1.157 . . . . 74.21 110.292 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . 0.414 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 6.5 pt-20 -102.51 21.72 14.75 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.518 1.136 . . . . 62.11 110.269 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -117.34 162.99 17.02 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 124.513 1.133 . . . . 63.4 110.014 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 21.5 ttt-85 -64.88 -42.77 94.55 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.499 1.124 . . . . 71.24 110.316 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -90.9 41.62 2.91 Favored Glycine 0 CA--C 1.531 1.072 0 O-C-N 124.475 1.11 . . . . 71.33 110.97 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 202' ' ' PHE . . . . . 0.611 ' CD1' ' C ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -77.63 -47.71 2.36 Favored Pre-proline 0 C--N 1.325 -0.495 0 O-C-N 124.555 0.797 . . . . 71.23 110.974 -179.983 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 203' ' ' PRO . . . . . 0.578 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.5 Cg_endo -75.02 -25.94 11.35 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.528 1.804 . . . . 73.21 111.053 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 204' ' ' THR . . . . . 0.43 ' O ' ' HD3' ' A' ' 208' ' ' ARG . 0.8 OUTLIER -61.69 -55.45 30.31 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.572 1.17 . . . . 73.23 110.407 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 205' ' ' GLN . . . . . 0.452 ' HB3' ' CD1' ' A' ' 209' ' ' ILE . 2.1 mt-30 -54.55 -62.43 1.66 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.599 1.187 . . . . 75.11 110.377 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 206' ' ' VAL . . . . . 0.578 ' CG1' ' HA ' ' A' ' 203' ' ' PRO . 3.2 p -40.75 -30.98 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.518 1.136 . . . . 75.3 109.351 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 207' ' ' GLU . . . . . 0.402 ' N ' ' C ' ' A' ' 205' ' ' GLN . 0.9 OUTLIER -79.56 -65.88 0.94 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.516 1.135 . . . . 72.21 110.302 179.969 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . 0.43 ' HD3' ' O ' ' A' ' 204' ' ' THR . 4.8 mpt_? -46.13 -58.0 4.01 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.507 1.129 . . . . 74.41 110.264 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 209' ' ' ILE . . . . . 0.488 HG22 ' CE1' ' A' ' 210' ' ' PHE . 15.3 mt -54.57 -66.43 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 O-C-N 124.474 1.109 . . . . 74.23 109.26 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 210' ' ' PHE . . . . . 0.578 ' HA ' ' CZ2' ' A' ' 134' ' ' TRP . 0.4 OUTLIER -90.06 65.95 6.64 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.493 1.121 . . . . 74.15 111.024 -179.986 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -110.31 146.35 35.88 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.595 1.184 . . . . 72.23 110.297 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . 0.458 ' O ' ' N ' ' A' ' 215' ' ' TYR . 22.8 tt0 -48.88 -55.48 11.6 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 124.441 1.088 . . . . 72.22 110.293 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.41 -24.09 1.14 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.48 1.112 . . . . 74.13 109.993 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 24.1 t -96.16 -28.46 3.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.559 1.162 . . . . 73.11 109.297 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 215' ' ' TYR . . . . . 0.458 ' N ' ' O ' ' A' ' 212' ' ' GLU . 12.8 t80 -64.92 -23.41 67.22 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.524 1.14 . . . . 75.44 111.006 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -66.19 0.58 Allowed 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.525 1.141 . . . . 74.3 109.264 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 217' ' ' THR . . . . . 0.483 ' CG2' ' CD1' ' A' ' 221' ' ' ILE . 25.7 m -41.1 -66.12 0.36 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.514 1.134 . . . . 54.53 110.372 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 218' ' ' GLN . . . . . 0.47 ' H ' ' NE2' ' A' ' 218' ' ' GLN . 0.0 OUTLIER -39.66 -53.56 2.15 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.408 1.068 . . . . 74.31 110.292 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 11.8 tp60 -53.92 -53.8 47.63 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.496 1.123 . . . . 72.22 110.261 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 220' ' ' THR . . . . . 0.414 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 1.3 m -62.87 -19.21 63.92 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.498 1.124 . . . . 65.21 110.438 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 221' ' ' ILE . . . . . 0.483 ' CD1' ' CG2' ' A' ' 217' ' ' THR . 56.3 mt -83.62 -25.36 7.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.525 1.141 . . . . 73.31 109.328 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 222' ' ' TRP . . . . . 0.787 ' CD1' ' CE2' ' A' ' 167' ' ' TYR . 6.9 t90 -78.13 -43.36 29.06 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.54 1.15 . . . . 73.15 107.999 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . 0.414 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -68.39 -33.57 74.47 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.542 1.151 . . . . 70.02 109.313 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . 0.414 ' N ' ' HD3' ' A' ' 223' ' ' LYS . 1.8 mm-40 . . . . . 0 C--N 1.325 -0.47 0 O-C-N 124.538 1.149 . . . . 74.44 110.367 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.471 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 4.2 p . . . . . 0 N--CA 1.453 -0.277 0 N-CA-C 109.254 -0.647 . . . . 73.13 109.254 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.411 ' O ' ' C ' ' A' ' 79' ' ' LEU . 20.0 m-85 -88.39 26.88 1.34 Allowed 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.527 1.142 . . . . 74.31 110.989 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.411 ' C ' ' O ' ' A' ' 78' ' ' PHE . 12.4 tp -39.65 152.05 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.497 1.123 . . . . 73.11 109.337 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.461 ' O ' ' N ' ' A' ' 133' ' ' ALA . 1.4 ttpt -90.09 -60.4 1.94 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.553 1.158 . . . . 73.25 109.337 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.592 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.6 OUTLIER -161.28 131.61 5.05 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.515 1.134 . . . . 75.41 111.014 179.968 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.448 HG12 ' CB ' ' A' ' 128' ' ' ALA . 11.6 p -84.73 162.36 2.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 124.463 1.102 . . . . 65.21 109.29 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.419 HG13 ' CG1' ' A' ' 136' ' ' ILE . 4.9 mp -125.41 96.25 3.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.48 1.113 . . . . 75.54 109.274 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.45 HD22 ' CD1' ' A' ' 112' ' ' PHE . 6.8 mt -69.87 123.55 21.77 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.532 1.145 . . . . 74.43 109.292 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.59 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -146.15 174.46 11.29 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.513 1.133 . . . . 75.3 109.59 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.468 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -127.91 152.3 48.03 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.509 1.13 . . . . 74.31 109.366 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -46.31 -24.25 0.46 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.516 1.135 . . . . 75.35 110.305 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -63.45 -46.52 85.87 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.469 1.106 . . . . 73.21 109.267 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.449 ' OD1' ' ND2' ' A' ' 178' ' ' ASN . 0.0 OUTLIER -134.91 44.81 2.59 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.435 1.085 . . . . 74.41 109.307 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.59 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -75.18 -26.58 59.15 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.567 1.167 . . . . 73.31 110.417 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -82.43 -21.44 35.71 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.576 1.172 . . . . 73.2 109.314 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.3 -54.89 6.13 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.597 1.185 . . . . 71.32 110.261 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.488 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -59.06 -30.48 68.09 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.495 1.122 . . . . 72.33 109.371 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.434 HD21 ' CG ' ' A' ' 97' ' ' GLN . 0.0 OUTLIER -78.62 -51.6 9.65 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.481 1.113 . . . . 74.31 109.326 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 2.2 tmt_? -41.19 -43.19 2.26 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.573 1.17 . . . . 74.55 110.264 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.55 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 0.3 OUTLIER -75.57 -52.96 16.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.479 1.112 . . . . 73.33 109.259 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.55 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -48.87 -20.89 0.55 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.436 1.085 . . . . 73.4 110.304 -179.988 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.41 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -79.82 -41.2 26.89 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.555 1.16 . . . . 64.12 109.235 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.467 HD22 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -77.97 -22.09 49.96 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.44 1.088 . . . . 73.34 109.29 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.467 ' N ' HD22 ' A' ' 99' ' ' LEU . 36.8 mt -67.62 -44.72 77.35 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.513 1.133 . . . . 73.51 109.299 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -82.04 49.62 1.42 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.443 1.089 . . . . 75.31 110.237 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -174.44 -64.95 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.571 1.169 . . . . 74.14 109.294 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -41.56 -52.4 3.73 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.495 1.122 . . . . 75.34 109.241 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -111.03 -30.03 7.66 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.537 1.148 . . . . 71.41 110.995 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.464 ' O ' ' CD ' ' A' ' 107' ' ' LYS . . . 109.1 26.97 5.01 Favored Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.581 1.176 . . . . 72.41 110.979 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.443 HG23 ' CE ' ' A' ' 80' ' ' LYS . 25.4 mm -70.82 95.42 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 O-C-N 124.473 0.749 . . . . 74.42 109.257 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.482 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -142.02 158.48 61.76 Favored Pre-proline 0 C--N 1.326 -0.451 0 O-C-N 124.487 1.117 . . . . 75.21 109.313 179.968 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.482 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.01 161.68 94.36 Favored 'Cis proline' 0 C--N 1.36 1.171 0 C-N-CA 121.009 -2.496 . . . . 73.53 111.011 0.057 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -117.29 112.12 2.41 Favored Glycine 0 CA--C 1.529 0.948 0 O-C-N 124.46 1.1 . . . . 73.23 111.009 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.84 128.81 47.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.44 0.729 . . . . 63.52 109.289 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . 0.41 HD12 ' NE2' ' A' ' 85' ' ' HIS . 43.4 pt -91.44 -176.59 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.528 1.143 . . . . 63.51 109.306 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.45 ' CD1' HD22 ' A' ' 84' ' ' LEU . 1.7 t80 -81.67 -19.99 40.5 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.474 1.109 . . . . 52.1 110.942 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -90.49 -3.45 57.63 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.496 1.122 . . . . 75.14 109.289 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -110.23 -26.58 9.55 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.577 1.173 . . . . 70.54 110.306 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 26.8 tpp -38.77 110.88 0.6 Allowed Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.512 1.132 . . . . 74.13 110.995 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 C--N 1.36 1.141 0 O-C-N 124.481 1.78 . . . . 72.22 110.951 -179.965 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.492 ' CD2' ' OG1' ' A' ' 147' ' ' THR . 0.3 OUTLIER . . . . . 0 N--CA 1.454 -0.234 0 N-CA-C 109.287 -0.634 . . . . 74.44 109.287 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.4 ' C ' ' O ' ' A' ' 125' ' ' LEU . 0.7 OUTLIER -40.14 -30.02 0.09 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.557 1.161 . . . . 63.14 109.36 179.987 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.434 ' N ' ' C ' ' A' ' 125' ' ' LEU . 1.0 OUTLIER -57.78 -53.42 58.37 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.474 1.109 . . . . 75.33 109.316 179.919 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.448 ' CB ' HG12 ' A' ' 82' ' ' VAL . . . -67.21 -25.13 65.96 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.573 1.17 . . . . 75.11 109.298 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.438 ' O ' ' CB ' ' A' ' 168' ' ' ASN . 67.2 t -89.99 15.62 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.429 1.08 . . . . 74.54 109.263 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.406 ' O ' ' C ' ' A' ' 131' ' ' GLY . 3.9 m-20 -129.85 165.79 21.3 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.519 1.137 . . . . 74.33 109.276 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . 0.406 ' C ' ' O ' ' A' ' 130' ' ' ASN . . . 37.15 54.43 1.56 Allowed Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.448 1.093 . . . . 74.13 111.027 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 7.8 m -163.33 174.23 12.26 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.484 0.755 . . . . 73.23 110.022 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . 0.675 ' CB ' ' CZ3' ' A' ' 134' ' ' TRP . . . -105.45 -28.12 11.03 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.537 1.148 . . . . 73.42 109.258 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.675 ' CZ3' ' CB ' ' A' ' 133' ' ' ALA . 1.1 m-90 -161.95 178.71 8.64 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.974 -1.121 . . . . 74.13 107.974 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' THR . . . . . 0.452 ' OG1' ' HA ' ' A' ' 170' ' ' VAL . 74.8 p -147.64 135.46 21.1 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.464 1.103 . . . . 63.23 110.359 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.436 ' O ' ' O ' ' A' ' 84' ' ' LEU . 6.9 mm -84.18 97.76 5.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 124.49 1.119 . . . . 73.34 109.304 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -77.89 87.41 4.09 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.499 1.125 . . . . 54.44 109.374 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.592 ' O ' ' CD1' ' A' ' 143' ' ' PHE . 2.3 tp -62.07 103.12 0.34 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.514 1.134 . . . . 72.3 109.318 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.411 ' N ' HD11 ' A' ' 139' ' ' LEU . 0.0 OUTLIER -75.25 106.46 6.78 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.435 1.085 . . . . 74.3 109.328 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' THR . . . . . 0.503 ' O ' ' CB ' ' A' ' 144' ' ' LEU . 2.5 m -135.24 162.64 31.98 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.344 1.027 . . . . 73.54 110.459 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -63.44 -34.8 78.54 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.507 1.129 . . . . 73.33 110.227 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . 0.407 ' H ' ' ND2' ' A' ' 142' ' ' ASN . 1.9 p30 -89.35 -53.34 4.59 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.569 1.168 . . . . 75.22 109.262 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.592 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 31.2 t80 -53.32 -36.88 61.75 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.528 1.143 . . . . 61.43 110.958 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.503 ' CB ' ' O ' ' A' ' 140' ' ' THR . 2.1 tm? -60.81 -68.15 0.33 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.471 1.107 . . . . 73.12 109.293 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.418 ' N ' HD13 ' A' ' 144' ' ' LEU . 6.8 mmt85 -55.01 -18.97 5.84 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.461 1.101 . . . . 74.24 110.344 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -75.57 -73.12 0.27 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.504 1.128 . . . . 72.33 109.253 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.51 ' CG2' ' N ' ' A' ' 148' ' ' TRP . 1.2 t -65.79 -52.02 54.25 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.502 1.126 . . . . 72.12 110.317 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.51 ' N ' ' CG2' ' A' ' 147' ' ' THR . 22.7 t-105 -43.5 -50.99 6.95 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.578 1.174 . . . . 74.22 107.971 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' CYS . . . . . 0.404 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 4.6 t -47.31 -45.86 24.74 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.482 1.114 . . . . 75.15 108.329 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' ASN . . . . . 0.455 ' N ' ' O ' ' A' ' 147' ' ' THR . 23.3 m120 -64.36 -56.66 12.86 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.458 1.099 . . . . 72.1 109.316 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.537 ' CZ ' ' CD2' ' A' ' 157' ' ' LEU . 8.6 m-30 -42.93 -38.05 2.08 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.492 1.12 . . . . 73.53 111.005 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -61.29 -45.02 96.2 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.54 1.15 . . . . 73.15 110.261 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.433 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 1.7 t80 -56.6 -25.68 53.49 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.518 1.136 . . . . 74.11 110.986 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.502 ' CD1' ' O ' ' A' ' 154' ' ' TYR . 20.3 p90 -163.61 125.43 2.43 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.45 1.094 . . . . 75.53 110.982 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' THR . . . . . 0.4 ' O ' ' OD1' ' A' ' 159' ' ' ASN . 6.3 t -70.39 -6.07 32.88 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.505 1.128 . . . . 74.44 110.47 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' SER . . . . . 0.402 ' HA ' ' ND2' ' A' ' 159' ' ' ASN . 1.6 m -39.51 -63.65 0.55 Allowed 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.493 1.121 . . . . 55.31 109.948 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.537 ' CD2' ' CZ ' ' A' ' 151' ' ' PHE . 2.9 tt -64.89 -40.28 94.84 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.514 1.133 . . . . 74.44 109.281 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' MET . . . . . 0.493 ' SD ' ' CZ3' ' A' ' 148' ' ' TRP . 3.4 tpt -58.76 -15.18 11.0 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.494 1.121 . . . . 73.42 111.027 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' ASN . . . . . 0.414 ' HB3' ' NE2' ' A' ' 164' ' ' GLN . 37.7 m-20 -81.59 -44.89 16.63 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.44 1.087 . . . . 72.15 109.339 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.63 -20.63 61.26 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.466 1.104 . . . . 70.02 110.069 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . 0.469 HG21 ' CE ' ' A' ' 158' ' ' MET . 4.4 t -64.21 -18.01 22.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.571 1.17 . . . . 75.2 109.34 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -86.48 10.23 15.85 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.467 1.104 . . . . 74.42 109.3 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.463 ' CZ ' HG22 ' A' ' 192' ' ' ILE . 0.7 OUTLIER 53.29 63.63 2.15 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.54 1.15 . . . . 75.54 110.32 179.97 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . 0.414 ' NE2' ' HB3' ' A' ' 159' ' ' ASN . 19.7 mt-30 -62.35 -174.49 0.06 Allowed 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.552 1.157 . . . . 75.55 110.222 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -99.77 38.26 1.48 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.52 1.138 . . . . 75.25 109.567 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -100.9 162.26 13.03 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.586 1.178 . . . . 72.33 109.284 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 167' ' ' TYR . . . . . 0.527 ' CD1' ' C ' ' A' ' 167' ' ' TYR . 3.2 p90 -66.89 -9.09 34.29 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 124.402 1.064 . . . . 71.31 111.014 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . 0.438 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 0.1 OUTLIER -112.01 130.13 55.97 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.506 1.129 . . . . 75.35 109.32 -179.967 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 169' ' ' SER . . . . . 0.452 ' C ' ' CG1' ' A' ' 170' ' ' VAL . 1.2 m -128.53 172.93 10.7 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.511 1.132 . . . . 74.22 109.997 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.452 ' HA ' ' OG1' ' A' ' 135' ' ' THR . 0.9 OUTLIER -151.95 119.87 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.412 1.07 . . . . 73.13 109.284 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 11.5 mm -111.29 121.0 41.57 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 124.576 1.173 . . . . 72.11 109.308 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . 0.516 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.92 106.9 2.36 Favored 'Trans proline' 0 C--N 1.36 1.139 0 O-C-N 124.479 1.779 . . . . 61.04 110.997 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 173' ' ' MET . . . . . 0.408 ' SD ' ' CG2' ' A' ' 136' ' ' ILE . 4.0 ttt -94.22 153.5 18.03 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.481 1.113 . . . . 74.03 110.989 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 41.8 ttm-85 -114.39 126.28 28.17 Favored Pre-proline 0 C--N 1.326 -0.448 0 O-C-N 124.477 1.11 . . . . 75.23 110.345 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 157.49 42.74 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.443 1.76 . . . . 73.24 111.034 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . 0.476 ' CD2' ' HG3' ' A' ' 197' ' ' GLU . 0.2 OUTLIER -99.58 -50.85 3.93 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.459 1.099 . . . . 62.22 109.289 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -71.74 -22.13 61.66 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.465 1.103 . . . . 72.12 109.321 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 178' ' ' ASN . . . . . 0.449 ' ND2' ' OD1' ' A' ' 89' ' ' ASP . 0.4 OUTLIER -107.67 107.79 60.77 Favored Pre-proline 0 C--N 1.325 -0.484 0 O-C-N 124.474 1.109 . . . . 64.03 109.335 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.96 127.54 10.79 Favored 'Trans proline' 0 C--N 1.36 1.158 0 O-C-N 124.543 1.812 . . . . 64.14 111.047 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . 0.403 HD12 ' CB ' ' A' ' 184' ' ' ARG . 0.4 OUTLIER -141.27 96.66 7.05 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.524 1.14 . . . . 73.24 109.274 179.976 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.02 168.96 23.66 Favored 'Trans proline' 0 C--N 1.36 1.166 0 O-C-N 124.495 1.787 . . . . 74.42 111.021 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . 0.424 ' CB ' ' OE1' ' A' ' 190' ' ' GLN . 0.2 OUTLIER -58.45 -28.42 65.28 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.511 1.132 . . . . 73.45 110.327 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -62.85 -12.74 26.79 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.425 1.078 . . . . 72.45 110.339 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 184' ' ' ARG . . . . . 0.403 ' CB ' HD12 ' A' ' 180' ' ' LEU . 39.4 mmt180 -112.87 -28.26 7.81 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.467 1.104 . . . . 75.24 110.255 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 185' ' ' THR . . . . . . . . . . . . . 31.3 m -80.0 144.13 58.64 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.417 1.073 . . . . 73.13 110.342 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.98 147.45 34.01 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.59 1.837 . . . . 74.43 110.995 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 187' ' ' PHE . . . . . 0.47 ' O ' ' CG2' ' A' ' 191' ' ' THR . 4.4 p90 -63.21 -11.34 20.28 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.489 1.118 . . . . 74.0 111.039 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -87.96 -54.12 4.39 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.545 1.153 . . . . 73.1 109.298 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.468 HD23 ' CG2' ' A' ' 161' ' ' VAL . 24.8 mt -72.61 -19.41 61.47 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.525 1.141 . . . . 74.32 109.333 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 190' ' ' GLN . . . . . 0.484 ' CG ' ' O ' ' A' ' 190' ' ' GLN . 7.4 tt0 -86.54 -0.52 56.28 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.596 1.185 . . . . 71.14 110.295 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 191' ' ' THR . . . . . 0.47 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 69.1 p -130.21 18.59 5.43 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.453 1.095 . . . . 75.0 110.39 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.463 HG22 ' CZ ' ' A' ' 163' ' ' ARG . 3.1 mt -127.79 154.63 38.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.483 1.114 . . . . 73.1 109.269 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -51.52 92.38 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.433 1.083 . . . . 71.32 109.266 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . 0.516 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -90.79 143.54 26.62 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.546 1.153 . . . . 72.13 109.343 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 195' ' ' LEU . . . . . 0.401 ' N ' ' O ' ' A' ' 172' ' ' PRO . 0.2 OUTLIER -76.56 150.0 36.57 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 72.24 109.331 -179.971 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -143.42 132.98 23.58 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.499 1.124 . . . . 72.15 110.271 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . 0.476 ' HG3' ' CD2' ' A' ' 176' ' ' LEU . 0.6 OUTLIER -113.86 -16.81 12.17 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 124.487 1.117 . . . . 62.3 110.248 -179.998 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . 0.468 ' HB3' ' CD2' ' A' ' 176' ' ' LEU . 0.3 OUTLIER -95.71 5.07 52.3 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.436 1.085 . . . . 73.1 110.266 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.92 172.91 6.93 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.523 1.139 . . . . 72.11 110.034 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -85.4 -18.39 33.82 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.468 1.105 . . . . 72.25 110.279 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -104.42 24.05 29.94 Favored Glycine 0 CA--C 1.53 1.024 0 O-C-N 124.464 1.102 . . . . 71.24 111.088 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 202' ' ' PHE . . . . . 0.623 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 0.2 OUTLIER -59.2 -43.01 96.26 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.521 0.777 . . . . 75.11 110.987 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 203' ' ' PRO . . . . . 0.623 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.2 Cg_endo -75.04 -35.55 3.04 Favored 'Trans proline' 0 C--N 1.36 1.158 0 O-C-N 124.566 1.824 . . . . 75.31 111.018 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.92 -57.03 12.48 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.527 1.142 . . . . 71.44 110.433 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 205' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' A' ' 209' ' ' ILE . 3.0 mt-30 -61.92 -48.73 79.15 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.543 1.152 . . . . 73.31 110.357 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 206' ' ' VAL . . . . . 0.51 ' CG2' ' O ' ' A' ' 202' ' ' PHE . 92.7 t -57.25 -29.97 33.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 124.473 1.108 . . . . 73.12 109.284 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -79.42 -41.12 28.37 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.457 1.098 . . . . 74.44 110.266 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -75.45 -68.09 0.6 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.514 1.134 . . . . 73.22 110.311 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 209' ' ' ILE . . . . . 0.557 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 98.0 mt -40.42 -48.03 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.447 1.092 . . . . 74.11 109.261 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 210' ' ' PHE . . . . . 0.557 ' CE1' ' CG2' ' A' ' 209' ' ' ILE . 1.9 m-85 -105.71 75.7 1.15 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.492 1.12 . . . . 72.23 110.981 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 211' ' ' GLN . . . . . 0.489 ' CG ' ' HB ' ' A' ' 214' ' ' VAL . 10.3 pt20 -111.32 141.7 44.52 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.512 1.132 . . . . 70.23 110.277 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . 0.579 ' HA ' ' CD2' ' A' ' 215' ' ' TYR . 16.1 tt0 -53.08 -48.38 67.79 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.448 1.093 . . . . 74.33 110.265 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.4 t -52.58 -18.61 1.82 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.421 1.076 . . . . 73.24 109.969 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.489 ' HB ' ' CG ' ' A' ' 211' ' ' GLN . 2.3 t -97.66 -44.52 12.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 124.534 1.146 . . . . 74.44 109.276 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 215' ' ' TYR . . . . . 0.579 ' CD2' ' HA ' ' A' ' 212' ' ' GLU . 9.5 m-30 -37.39 -32.36 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.452 1.095 . . . . 75.3 110.964 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . 0.513 ' N ' ' CD ' ' A' ' 216' ' ' LYS . 5.6 mmtt -68.51 -54.59 15.87 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.482 1.113 . . . . 73.45 109.324 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 217' ' ' THR . . . . . 0.446 ' N ' ' O ' ' A' ' 214' ' ' VAL . 1.5 m -40.24 -66.41 0.31 Allowed 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.559 1.162 . . . . 70.21 110.46 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -46.76 -59.94 2.72 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.492 1.12 . . . . 74.2 110.272 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 219' ' ' GLN . . . . . 0.471 ' O ' ' N ' ' A' ' 223' ' ' LYS . 28.9 tp60 -41.34 -61.12 1.09 Allowed 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.556 1.16 . . . . 74.44 110.357 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.1 m -46.22 -45.94 17.32 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.528 1.142 . . . . 75.5 110.369 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 221' ' ' ILE . . . . . 0.414 HG23 ' N ' ' A' ' 167' ' ' TYR . 6.5 mt -66.95 -29.59 46.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.46 1.1 . . . . 74.54 109.334 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 222' ' ' TRP . . . . . 0.471 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 14.3 t90 -81.63 -19.44 41.78 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.574 1.171 . . . . 74.34 108.07 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . 0.471 ' N ' ' O ' ' A' ' 219' ' ' GLN . 0.0 OUTLIER -91.86 -20.06 21.85 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.486 1.116 . . . . 63.33 109.386 179.93 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 . . . . . 0 C--N 1.325 -0.482 0 O-C-N 124.526 1.141 . . . . 72.23 110.276 -179.959 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.468 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 6.3 p . . . . . 0 N--CA 1.453 -0.314 0 N-CA-C 109.32 -0.622 . . . . 74.11 109.32 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.558 ' CG ' ' O ' ' A' ' 78' ' ' PHE . 28.7 t80 -86.63 22.02 2.02 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.492 1.12 . . . . 73.43 110.937 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.406 ' C ' ' O ' ' A' ' 78' ' ' PHE . 6.6 tp -39.91 151.55 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.519 1.137 . . . . 74.24 109.198 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -91.04 -60.65 1.85 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.535 1.147 . . . . 75.01 109.307 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.596 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -161.44 136.46 7.42 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.424 1.078 . . . . 70.31 110.974 179.966 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.444 ' CG2' ' N ' ' A' ' 83' ' ' ILE . 4.0 p -89.36 167.71 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 O-C-N 124.515 1.135 . . . . 72.41 109.35 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.45 ' CG2' ' HB ' ' A' ' 136' ' ' ILE . 5.2 mp -131.35 96.76 2.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.466 1.104 . . . . 75.12 109.308 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.438 ' HG ' ' CB ' ' A' ' 128' ' ' ALA . 3.1 mt -72.92 118.9 16.43 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.505 1.128 . . . . 73.41 109.296 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.573 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -141.18 174.46 10.51 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.425 1.078 . . . . 75.35 109.529 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -105.14 156.46 18.07 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.493 1.12 . . . . 71.51 109.254 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.71 -14.54 21.62 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.517 1.135 . . . . 75.53 110.317 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -84.52 -46.3 11.74 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.499 1.124 . . . . 75.45 109.316 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.41 ' N ' ' OD2' ' A' ' 89' ' ' ASP . 0.5 OUTLIER -112.1 43.72 1.54 Allowed 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.519 1.137 . . . . 74.22 109.311 179.976 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.573 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -80.09 -22.25 42.41 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.55 1.156 . . . . 72.13 110.418 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -83.36 -27.21 29.83 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.425 1.078 . . . . 72.4 109.241 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -70.78 -55.56 8.3 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.529 1.143 . . . . 74.22 110.363 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.461 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -58.79 -34.74 71.82 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.483 1.114 . . . . 75.41 109.261 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -41.6 62.69 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.532 1.145 . . . . 73.45 109.315 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -51.03 -31.17 17.54 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.479 1.112 . . . . 75.31 110.314 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.458 ' O ' ' N ' ' A' ' 99' ' ' LEU . 2.0 t -82.88 -63.69 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.437 1.085 . . . . 70.33 109.221 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.443 ' N ' HG12 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -41.49 -26.27 0.06 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.473 1.108 . . . . 73.4 110.34 -180.0 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.447 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.5 t-20 -71.68 -49.69 37.4 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.496 1.123 . . . . 71.23 109.347 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.479 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -73.79 -22.88 59.67 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.463 1.102 . . . . 73.22 109.267 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.476 ' CD2' HG23 ' A' ' 206' ' ' VAL . 37.2 mt -63.27 -55.26 26.25 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.528 1.143 . . . . 75.52 109.291 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.67 59.35 1.16 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.459 1.099 . . . . 74.22 110.224 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.4 t70 175.87 -65.99 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.552 1.158 . . . . 74.31 109.254 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -42.77 -55.07 3.8 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.434 1.084 . . . . 63.05 109.25 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.571 ' CE2' HG23 ' A' ' 206' ' ' VAL . 1.9 m-85 -111.92 -20.22 12.09 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.488 1.118 . . . . 74.03 110.976 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.54 45.92 3.6 Favored Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.512 1.133 . . . . 64.23 110.997 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 7.2 mm -88.0 90.45 3.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.517 0.775 . . . . 74.15 109.279 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.48 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -137.7 158.24 72.06 Favored Pre-proline 0 C--N 1.324 -0.507 0 O-C-N 124.496 1.122 . . . . 74.35 109.29 -179.969 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.48 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -74.96 150.3 95.24 Favored 'Cis proline' 0 C--N 1.36 1.14 0 C-N-CA 121.0 -2.5 . . . . 71.41 110.983 -0.046 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -119.69 132.38 9.44 Favored Glycine 0 CA--C 1.531 1.061 0 O-C-N 124.491 1.12 . . . . 74.52 110.885 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.482 ' CD1' ' HA ' ' A' ' 115' ' ' MET . 0.4 OUTLIER -151.41 144.09 16.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.581 0.812 . . . . 72.34 109.255 179.95 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 38.6 pt -97.17 177.02 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 O-C-N 124.528 1.143 . . . . 75.32 109.273 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.459 ' CD1' ' SD ' ' A' ' 115' ' ' MET . 1.8 t80 -76.13 -18.7 59.03 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.555 1.159 . . . . 75.31 110.975 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -95.97 -2.32 47.26 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.556 1.16 . . . . 63.21 109.303 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -111.35 -26.56 9.06 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.458 1.099 . . . . 75.11 110.234 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.482 ' HA ' ' CD1' ' A' ' 110' ' ' ILE . 1.2 ptp -70.88 134.89 85.6 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.532 1.145 . . . . 75.13 110.977 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo . . . . . 0 C--N 1.36 1.149 0 O-C-N 124.498 1.788 . . . . 72.15 111.034 179.919 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.414 ' C ' ' N ' ' A' ' 127' ' ' ASP . 0.9 OUTLIER . . . . . 0 N--CA 1.453 -0.28 0 N-CA-C 109.363 -0.606 . . . . 70.14 109.363 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.404 ' O ' ' N ' ' A' ' 129' ' ' VAL . 0.7 OUTLIER -41.23 -30.01 0.15 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.502 1.126 . . . . 74.41 109.345 179.928 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.414 ' N ' ' C ' ' A' ' 125' ' ' LEU . 3.8 t0 -44.35 -51.66 8.32 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.484 1.115 . . . . 55.11 109.266 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.438 ' CB ' ' HG ' ' A' ' 84' ' ' LEU . . . -66.12 -34.42 78.01 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.514 1.134 . . . . 75.03 109.288 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.504 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 70.2 t -92.99 30.64 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.501 1.126 . . . . 71.3 109.382 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -131.75 130.47 41.93 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.479 1.112 . . . . 73.1 109.36 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 48.5 72.62 0.43 Allowed Glycine 0 CA--C 1.531 1.063 0 O-C-N 124.488 1.118 . . . . 73.25 110.985 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.3 m -160.71 167.82 26.11 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.578 0.811 . . . . 74.53 110.047 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . 0.654 ' CB ' ' CZ3' ' A' ' 134' ' ' TRP . . . -100.07 -33.89 10.29 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.428 1.08 . . . . 74.34 109.317 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.654 ' CZ3' ' CB ' ' A' ' 133' ' ' ALA . 1.0 OUTLIER -161.87 151.74 16.66 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.608 1.192 . . . . 75.25 107.965 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 47.2 p -120.22 145.37 47.08 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.466 1.104 . . . . 74.13 110.419 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.45 ' HB ' ' CG2' ' A' ' 83' ' ' ILE . 20.6 mm -99.25 131.01 47.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.495 1.122 . . . . 62.54 109.351 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.42 ' N ' HD23 ' A' ' 137' ' ' LEU . 0.4 OUTLIER -124.74 99.65 6.26 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.493 1.121 . . . . 73.11 109.328 -179.973 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.464 ' O ' ' CD1' ' A' ' 143' ' ' PHE . 0.1 OUTLIER -62.22 90.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.425 1.078 . . . . 74.32 109.243 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.34 103.01 0.2 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.527 1.142 . . . . 73.31 109.312 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 6.7 m -130.49 179.95 5.63 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.426 1.079 . . . . 53.24 110.427 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -75.54 -39.55 58.11 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.466 1.104 . . . . 75.23 110.313 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -89.46 -50.85 5.86 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.556 1.16 . . . . 74.15 109.352 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.464 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 52.9 t80 -50.26 -21.24 1.29 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 74.21 110.94 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.499 ' O ' ' CB ' ' A' ' 148' ' ' TRP . 1.8 tm? -64.45 -67.84 0.4 Allowed 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.53 1.143 . . . . 71.14 109.253 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.445 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 0.0 OUTLIER -60.18 -15.29 22.81 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.521 1.138 . . . . 74.41 110.247 -179.957 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -67.5 -64.57 0.83 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.467 1.104 . . . . 72.1 109.277 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.445 ' CG2' ' N ' ' A' ' 148' ' ' TRP . 1.0 OUTLIER -85.43 -48.18 9.25 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.502 1.126 . . . . 73.1 110.41 179.961 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.499 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 26.0 t-105 -42.51 -48.34 5.26 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.577 1.173 . . . . 71.14 108.022 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' CYS . . . . . 0.445 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 27.0 t -65.14 -44.98 86.87 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.495 1.122 . . . . 53.41 108.242 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' ASN . . . . . 0.439 ' N ' ' O ' ' A' ' 147' ' ' THR . 0.3 OUTLIER -48.13 -41.28 26.12 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.589 1.18 . . . . 75.33 109.331 -179.978 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.545 ' CE1' HD11 ' A' ' 157' ' ' LEU . 14.4 m-30 -66.99 -35.85 80.86 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.482 1.114 . . . . 73.43 111.01 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -49.25 -46.44 46.13 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.486 1.116 . . . . 61.33 110.332 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -85.33 -15.19 44.09 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.532 1.145 . . . . 61.31 111.04 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -132.9 85.66 2.24 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.501 1.125 . . . . 74.31 111.036 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.58 -14.25 40.47 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 124.526 1.141 . . . . 75.24 110.402 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 23.2 m -53.68 -22.89 9.84 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.471 1.107 . . . . 61.1 109.978 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.545 HD11 ' CE1' ' A' ' 151' ' ' PHE . 0.6 OUTLIER -82.89 -45.89 13.66 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.467 1.105 . . . . 74.5 109.251 -179.95 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' MET . . . . . 0.467 ' HA ' ' CE ' ' A' ' 158' ' ' MET . 26.6 mmt -42.34 -32.74 0.55 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.507 1.129 . . . . 71.51 111.026 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -65.27 -49.77 68.29 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.524 1.14 . . . . 74.3 109.313 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 160' ' ' SER . . . . . 0.467 ' CB ' HG22 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -68.66 -29.04 67.43 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.527 1.142 . . . . 62.01 109.994 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . 0.476 ' O ' ' CD1' ' A' ' 192' ' ' ILE . 6.2 t -55.06 -19.49 4.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.543 1.152 . . . . 73.41 109.344 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 162' ' ' ASN . . . . . 0.468 ' O ' ' N ' ' A' ' 164' ' ' GLN . 6.6 t-20 -91.05 20.84 4.62 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.539 1.149 . . . . 74.45 109.321 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.43 ' C ' ' O ' ' A' ' 162' ' ' ASN . 0.5 OUTLIER 35.6 33.55 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.514 1.133 . . . . 75.53 110.297 -179.956 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . 0.468 ' N ' ' O ' ' A' ' 162' ' ' ASN . 2.6 mt-30 -48.22 176.74 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.49 1.118 . . . . 70.25 110.291 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 165' ' ' HIS . . . . . 0.41 ' CD2' ' H ' ' A' ' 165' ' ' HIS . 2.9 p80 -93.42 71.96 4.41 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.425 1.078 . . . . 72.32 109.586 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . 0.553 ' HG3' ' CD2' ' A' ' 167' ' ' TYR . 2.2 tppt? -123.13 157.12 33.61 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.551 1.157 . . . . 72.44 109.306 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 167' ' ' TYR . . . . . 0.62 ' CD1' ' N ' ' A' ' 168' ' ' ASN . 45.0 p90 -38.75 -45.94 1.19 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.501 1.126 . . . . 74.42 110.99 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . 0.62 ' N ' ' CD1' ' A' ' 167' ' ' TYR . 1.7 p-10 -99.34 129.92 45.59 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.482 1.114 . . . . 75.32 109.237 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 14.0 m -110.73 158.35 18.75 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.457 1.098 . . . . 61.44 109.968 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.467 HG22 ' CB ' ' A' ' 160' ' ' SER . 42.9 t -116.56 111.35 34.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.481 1.113 . . . . 74.24 109.323 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . 0.401 ' CG1' ' HB3' ' A' ' 134' ' ' TRP . 21.9 mm -122.86 93.75 48.06 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.514 1.134 . . . . 75.13 109.325 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . 0.504 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 17.9 Cg_endo -75.01 107.65 2.53 Favored 'Trans proline' 0 C--N 1.36 1.142 0 O-C-N 124.566 1.824 . . . . 74.14 110.976 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 173' ' ' MET . . . . . 0.455 ' HE2' ' CG2' ' A' ' 96' ' ' VAL . 4.1 ttt -83.65 152.8 24.59 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.475 1.109 . . . . 65.54 110.996 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 25.5 mmm-85 -110.88 118.21 48.77 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.453 1.096 . . . . 71.34 110.32 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 154.96 42.86 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.508 1.794 . . . . 74.14 111.012 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . 0.561 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -95.58 -38.09 10.56 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 124.53 1.144 . . . . 70.43 109.372 179.951 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . 0.44 HD21 ' N ' ' A' ' 177' ' ' ASN . 1.4 m-80 -72.8 -22.38 60.83 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.461 1.101 . . . . 75.11 109.35 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -110.42 108.35 58.44 Favored Pre-proline 0 C--N 1.326 -0.441 0 O-C-N 124.44 1.087 . . . . 61.33 109.275 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.96 124.06 8.37 Favored 'Trans proline' 0 C--N 1.36 1.149 0 O-C-N 124.5 1.789 . . . . 74.34 110.987 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -139.94 96.98 8.09 Favored Pre-proline 0 C--N 1.324 -0.525 0 O-C-N 124.49 1.119 . . . . 74.12 109.354 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.02 155.43 42.82 Favored 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.474 1.776 . . . . 75.34 111.012 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.2 -28.3 39.9 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 124.541 1.151 . . . . 74.41 110.232 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -53.55 -29.33 36.5 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.496 1.122 . . . . 74.32 110.346 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 27.4 mmt180 -99.42 -16.72 18.28 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.492 1.12 . . . . 74.34 110.282 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 185' ' ' THR . . . . . 0.409 ' HA ' ' HD3' ' A' ' 186' ' ' PRO . 20.8 m -80.08 144.02 58.12 Favored Pre-proline 0 C--N 1.325 -0.458 0 O-C-N 124.534 1.146 . . . . 74.13 110.382 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 186' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 185' ' ' THR . 18.3 Cg_endo -74.96 155.58 43.12 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.466 1.771 . . . . 75.44 110.974 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 187' ' ' PHE . . . . . 0.509 ' O ' ' CG2' ' A' ' 191' ' ' THR . 7.7 p90 -69.44 -7.09 34.71 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.462 1.101 . . . . 75.1 110.972 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -94.08 -52.88 4.19 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.484 1.115 . . . . 75.24 109.314 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 48.3 mt -68.48 -42.28 78.93 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.494 1.121 . . . . 74.33 109.365 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -64.04 -10.46 22.15 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 124.45 1.094 . . . . 72.33 110.306 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 191' ' ' THR . . . . . 0.509 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 33.5 p -113.4 17.74 18.24 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 124.525 1.141 . . . . 72.3 110.396 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.476 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 4.8 mt -117.57 157.87 18.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.54 1.15 . . . . 62.32 109.334 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 193' ' ' ASN . . . . . 0.407 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 28.7 t30 -78.58 70.33 4.91 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.551 1.157 . . . . 72.1 109.305 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . 0.504 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -61.76 178.21 0.35 Allowed 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.494 1.121 . . . . 72.3 109.267 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 195' ' ' LEU . . . . . 0.414 HD22 ' N ' ' A' ' 206' ' ' VAL . 0.8 OUTLIER -105.88 122.99 47.25 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.465 1.103 . . . . 74.3 109.314 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -102.27 141.82 34.5 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.423 1.077 . . . . 74.23 110.332 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -111.67 -22.27 11.27 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.488 1.118 . . . . 73.11 110.292 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . 0.416 ' N ' HD12 ' A' ' 176' ' ' LEU . 2.4 pp20? -106.2 11.24 31.45 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.548 1.155 . . . . 74.44 110.268 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 32.8 t -94.68 171.5 8.75 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.523 1.139 . . . . 74.11 110.028 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -77.74 -42.16 35.2 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.511 1.132 . . . . 74.52 110.34 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -90.33 16.74 56.81 Favored Glycine 0 CA--C 1.53 1.009 0 O-C-N 124.442 1.089 . . . . 63.34 111.018 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 202' ' ' PHE . . . . . 0.619 ' CD1' ' C ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -48.75 -47.58 71.89 Favored Pre-proline 0 C--N 1.326 -0.454 0 O-C-N 124.532 0.784 . . . . 65.22 111.013 -179.991 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 203' ' ' PRO . . . . . 0.568 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.0 Cg_endo -75.04 -28.11 9.38 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.533 1.807 . . . . 74.23 110.969 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.88 -48.01 80.85 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.412 1.07 . . . . 74.23 110.439 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 205' ' ' GLN . . . . . 0.444 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 9.3 mt-30 -60.89 -61.91 2.24 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.477 1.111 . . . . 74.21 110.299 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 206' ' ' VAL . . . . . 0.574 ' HA ' ' CE2' ' A' ' 210' ' ' PHE . 2.7 p -39.58 -34.05 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 124.547 1.154 . . . . 74.45 109.298 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 207' ' ' GLU . . . . . 0.404 ' N ' ' C ' ' A' ' 205' ' ' GLN . 3.2 mm-40 -75.06 -65.06 0.92 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.486 1.116 . . . . 75.14 110.265 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -49.62 -59.58 3.65 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.567 1.167 . . . . 75.22 110.337 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 209' ' ' ILE . . . . . 0.563 HG23 ' CD1' ' A' ' 210' ' ' PHE . 64.5 mt -50.04 -68.82 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.436 1.085 . . . . 73.44 109.335 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 210' ' ' PHE . . . . . 0.574 ' CE2' ' HA ' ' A' ' 206' ' ' VAL . 0.4 OUTLIER -89.42 66.92 7.57 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.491 1.12 . . . . 73.25 110.999 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 211' ' ' GLN . . . . . 0.406 ' HG3' ' N ' ' A' ' 213' ' ' SER . 0.2 OUTLIER -110.48 148.19 32.58 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.539 1.149 . . . . 61.21 110.261 -179.992 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . 0.425 ' O ' ' HB3' ' A' ' 215' ' ' TYR . 5.8 tt0 -53.75 -52.38 60.38 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.566 1.166 . . . . 72.42 110.285 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 213' ' ' SER . . . . . 0.406 ' N ' ' HG3' ' A' ' 211' ' ' GLN . 0.6 OUTLIER -50.42 -21.3 1.39 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.449 1.093 . . . . 74.43 109.97 -179.993 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 21.7 t -95.21 -37.5 7.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.533 1.145 . . . . 74.43 109.339 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 215' ' ' TYR . . . . . 0.425 ' HB3' ' O ' ' A' ' 212' ' ' GLU . 5.1 t80 -51.7 -47.55 63.87 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.43 1.081 . . . . 74.33 110.967 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 2.8 mtmt -43.17 -55.28 4.01 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.467 1.104 . . . . 65.23 109.259 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 217' ' ' THR . . . . . 0.469 ' CG2' ' CD1' ' A' ' 221' ' ' ILE . 33.9 m -56.11 -66.43 0.43 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.435 1.085 . . . . 73.15 110.392 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 41.5 mm-40 -47.99 -23.53 0.82 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.438 1.086 . . . . 74.44 110.278 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 219' ' ' GLN . . . . . 0.443 ' O ' ' NE2' ' A' ' 219' ' ' GLN . 19.9 tp60 -82.36 -37.76 25.19 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.51 1.131 . . . . 73.2 110.312 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 220' ' ' THR . . . . . 0.414 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 1.2 m -78.57 -21.42 48.67 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.493 1.121 . . . . 65.23 110.343 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 221' ' ' ILE . . . . . 0.469 ' CD1' ' CG2' ' A' ' 217' ' ' THR . 12.7 mt -83.81 -37.17 12.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.477 1.111 . . . . 75.15 109.346 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 222' ' ' TRP . . . . . 0.468 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 27.3 t90 -66.84 -44.44 81.06 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.548 1.155 . . . . 71.24 107.963 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . 0.414 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -68.13 -23.01 64.84 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.516 1.135 . . . . 63.1 109.283 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 . . . . . 0 C--N 1.326 -0.422 0 O-C-N 124.399 1.062 . . . . 73.22 110.359 179.93 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.591 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 9.0 p . . . . . 0 N--CA 1.453 -0.295 0 N-CA-C 109.333 -0.617 . . . . 74.31 109.333 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.477 ' CE2' ' OH ' ' A' ' 215' ' ' TYR . 3.3 t80 -87.48 20.73 2.76 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.463 1.102 . . . . 75.23 111.038 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.407 ' C ' ' O ' ' A' ' 78' ' ' PHE . 6.3 tp -39.31 156.84 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.416 1.072 . . . . 74.41 109.286 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.573 ' NZ ' ' CG2' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -104.47 -57.28 2.05 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.516 1.135 . . . . 64.34 109.293 -179.973 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.617 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.1 OUTLIER -161.92 150.7 15.45 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.559 1.162 . . . . 74.42 110.945 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.443 HG21 ' CE ' ' A' ' 115' ' ' MET . 3.9 p -103.13 159.48 4.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.484 1.115 . . . . 75.33 109.331 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.494 HD12 ' CE1' ' A' ' 81' ' ' PHE . 4.2 mp -122.36 88.29 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.439 1.087 . . . . 74.45 109.336 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.517 ' HG ' ' CD1' ' A' ' 112' ' ' PHE . 5.1 mp -70.01 114.88 8.6 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.452 1.095 . . . . 71.2 109.245 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.572 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -131.52 174.79 9.74 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.466 1.104 . . . . 74.12 109.529 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -111.21 157.3 20.25 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.489 1.118 . . . . 75.33 109.322 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.17 -11.27 19.41 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.426 1.079 . . . . 64.54 110.225 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -84.25 -40.28 18.23 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.556 1.16 . . . . 64.43 109.288 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -127.25 41.0 3.6 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.409 1.068 . . . . 73.55 109.303 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.572 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -74.28 -53.61 9.37 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.578 1.174 . . . . 63.23 110.36 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.18 -17.85 21.68 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.476 1.11 . . . . 72.4 109.252 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -78.84 -55.84 4.85 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.521 1.138 . . . . 75.31 110.247 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.491 ' CB ' HD21 ' A' ' 138' ' ' LEU . . . -65.15 -20.24 66.36 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.597 1.185 . . . . 54.15 109.29 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.13 -52.9 5.38 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.482 1.114 . . . . 73.13 109.35 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -43.47 -36.2 1.91 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.445 1.091 . . . . 72.25 110.249 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.464 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 11.0 p -80.34 -55.84 7.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 124.526 1.141 . . . . 73.22 109.296 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.464 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -47.77 -23.43 0.72 Allowed 'General case' 0 C--N 1.323 -0.547 0 O-C-N 124.493 1.12 . . . . 75.21 110.323 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.24 -38.91 55.69 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.494 1.121 . . . . 74.23 109.359 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.46 ' N ' ' O ' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -80.66 -23.13 39.86 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.503 1.127 . . . . 74.45 109.261 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 32.5 mt -62.76 -44.38 96.36 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.475 1.11 . . . . 74.12 109.288 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . 0.481 ' CG ' ' O ' ' A' ' 101' ' ' GLN . 0.0 OUTLIER -85.76 55.44 3.52 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.521 1.138 . . . . 73.53 110.302 -179.985 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -178.18 -63.46 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.513 1.133 . . . . 44.53 109.273 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -43.79 -56.04 4.09 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.481 1.113 . . . . 65.43 109.378 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -109.43 -28.12 9.1 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.496 1.122 . . . . 73.11 110.998 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 101.02 39.52 3.08 Favored Glycine 0 CA--C 1.53 0.982 0 O-C-N 124.561 1.163 . . . . 63.22 111.023 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.573 ' CG2' ' NZ ' ' A' ' 80' ' ' LYS . 8.2 mm -83.37 90.05 2.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 O-C-N 124.5 0.765 . . . . 75.1 109.33 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.487 ' CB ' ' HA ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -142.72 161.82 47.3 Favored Pre-proline 0 C--N 1.325 -0.484 0 O-C-N 124.48 1.112 . . . . 72.32 109.332 179.98 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.487 ' HA ' ' CB ' ' A' ' 107' ' ' LYS . 18.6 Cg_endo -74.98 149.43 93.83 Favored 'Cis proline' 0 C--N 1.36 1.177 0 C-N-CA 120.983 -2.507 . . . . 71.44 111.043 -0.047 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -121.95 131.07 8.29 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.456 1.098 . . . . 75.13 111.039 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -142.76 148.01 20.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 O-C-N 124.513 0.772 . . . . 71.55 109.327 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . 0.41 HD11 ' NE2' ' A' ' 85' ' ' HIS . 32.2 pt -102.09 -177.16 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.477 1.11 . . . . 74.43 109.259 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.517 ' CD1' ' HG ' ' A' ' 84' ' ' LEU . 2.6 t80 -81.81 -23.21 36.65 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.569 1.168 . . . . 74.42 110.973 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -86.71 -5.32 59.16 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.465 1.103 . . . . 53.33 109.329 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -109.44 -26.61 9.89 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.507 1.129 . . . . 74.21 110.273 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.443 ' CE ' HG21 ' A' ' 82' ' ' VAL . 13.0 ttm -41.84 110.69 0.81 Allowed Pre-proline 0 C--N 1.325 -0.482 0 O-C-N 124.456 1.098 . . . . 72.45 110.996 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo . . . . . 0 C--N 1.361 1.185 0 O-C-N 124.481 1.78 . . . . 75.42 110.985 179.994 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.511 HD13 ' CE2' ' A' ' 154' ' ' TYR . 4.0 pp . . . . . 0 N--CA 1.452 -0.355 0 N-CA-C 109.25 -0.648 . . . . 73.31 109.25 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.443 ' O ' ' N ' ' A' ' 129' ' ' VAL . 1.7 t70 -42.22 -65.27 0.48 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.582 1.176 . . . . 72.24 109.298 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -46.49 -40.66 12.81 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.398 1.061 . . . . 74.52 109.326 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.46 ' HB2' ' CD1' ' A' ' 84' ' ' LEU . . . -58.47 -38.96 78.66 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.501 1.126 . . . . 72.43 109.294 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.492 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 77.1 t -90.45 18.41 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.54 1.15 . . . . 75.04 109.35 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -127.55 152.11 48.03 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.535 1.147 . . . . 73.22 109.322 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 47.5 56.17 8.56 Favored Glycine 0 CA--C 1.529 0.954 0 O-C-N 124.522 1.139 . . . . 73.41 111.031 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.9 p -163.76 163.73 23.95 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.473 0.749 . . . . 75.34 109.979 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . 0.56 ' O ' ' CD1' ' A' ' 134' ' ' TRP . . . -103.58 -23.78 13.46 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.451 1.094 . . . . 64.43 109.327 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.584 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 1.6 m-90 -161.79 157.5 24.27 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.026 -1.102 . . . . 74.11 108.026 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 33.8 p -131.15 127.02 37.17 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.464 1.103 . . . . 74.24 110.381 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.485 HG13 ' CG1' ' A' ' 83' ' ' ILE . 4.3 mm -84.32 141.53 14.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.51 1.132 . . . . 74.12 109.301 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 34.0 mt -134.97 110.66 9.24 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.457 1.098 . . . . 75.33 109.268 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.491 HD21 ' CB ' ' A' ' 93' ' ' ALA . 1.1 mm? -63.06 88.58 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.51 1.131 . . . . 61.22 109.27 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.43 100.64 0.11 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.538 1.149 . . . . 71.01 109.304 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' THR . . . . . 0.403 ' O ' ' CB ' ' A' ' 144' ' ' LEU . 11.0 m -129.68 -177.55 4.32 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 72.32 110.417 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -79.24 -35.95 40.71 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.485 1.116 . . . . 75.22 110.31 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 17.6 p30 -89.51 -34.49 16.37 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.503 1.127 . . . . 73.33 109.295 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.511 ' CE1' HG21 ' A' ' 147' ' ' THR . 6.6 t80 -71.63 -39.34 70.48 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.566 1.166 . . . . 73.42 111.048 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.53 ' CD1' ' N ' ' A' ' 145' ' ' ARG . 1.1 tm? -51.32 -67.47 0.25 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.47 1.106 . . . . 73.32 109.336 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.53 ' N ' ' CD1' ' A' ' 144' ' ' LEU . 0.0 OUTLIER -54.6 -19.14 5.4 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.56 1.163 . . . . 75.24 110.321 179.946 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -74.66 -43.13 56.81 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.582 1.177 . . . . 74.53 109.311 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.542 ' O ' ' CG ' ' A' ' 151' ' ' PHE . 9.4 p -93.69 -7.57 43.36 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.453 1.096 . . . . 73.51 110.445 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.436 ' N ' ' O ' ' A' ' 144' ' ' LEU . 2.7 t-105 -86.53 -27.08 24.2 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.554 1.159 . . . . 73.41 108.01 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 13.2 t -83.57 -45.16 13.84 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.494 1.121 . . . . 64.34 108.366 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' ASN . . . . . 0.408 ' ND2' HD21 ' A' ' 125' ' ' LEU . 0.1 OUTLIER -63.27 -42.49 99.15 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.53 1.144 . . . . 72.41 109.35 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.56 ' CE1' ' HB3' ' A' ' 157' ' ' LEU . 5.1 m-30 -62.9 -34.66 77.89 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.542 1.151 . . . . 75.33 111.027 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -55.34 -48.76 73.72 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.515 1.135 . . . . 74.23 110.268 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.485 ' O ' ' CG ' ' A' ' 153' ' ' PHE . 11.5 t80 -86.78 0.28 55.06 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.476 1.11 . . . . 74.22 110.978 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.526 ' CE1' ' HB3' ' A' ' 156' ' ' SER . 0.4 OUTLIER -134.13 86.69 2.3 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.512 1.132 . . . . 74.35 111.003 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -67.26 -16.12 64.09 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.467 1.105 . . . . 71.55 110.412 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' SER . . . . . 0.526 ' HB3' ' CE1' ' A' ' 154' ' ' TYR . 1.8 t -61.85 -22.99 65.98 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.5 1.125 . . . . 72.03 110.004 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.56 ' HB3' ' CE1' ' A' ' 151' ' ' PHE . 2.4 mm? -87.93 -26.35 22.74 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.52 1.137 . . . . 73.21 109.274 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' MET . . . . . 0.509 ' O ' ' CG2' ' A' ' 161' ' ' VAL . 25.2 mmt -66.23 -22.25 66.33 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.563 1.164 . . . . 74.23 111.041 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' ASN . . . . . 0.454 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 9.9 m-20 -93.88 -17.79 22.66 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.486 1.116 . . . . 73.13 109.294 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 160' ' ' SER . . . . . 0.447 ' O ' ' N ' ' A' ' 163' ' ' ARG . 69.4 p -81.2 -34.6 32.17 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.485 1.116 . . . . 74.13 110.028 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . 0.509 ' CG2' ' O ' ' A' ' 158' ' ' MET . 1.5 m -51.07 -21.51 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.601 1.188 . . . . 62.3 109.267 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 162' ' ' ASN . . . . . 0.415 ' O ' ' C ' ' A' ' 163' ' ' ARG . 75.1 m-20 -90.09 25.75 2.06 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.538 1.149 . . . . 70.2 109.297 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 160' ' ' SER . 0.1 OUTLIER 37.91 34.22 0.06 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.478 1.111 . . . . 74.34 110.313 -179.948 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . 0.454 ' NE2' ' O ' ' A' ' 159' ' ' ASN . 9.4 mt-30 -38.7 126.88 1.52 Allowed 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.495 1.122 . . . . 72.32 110.339 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 39.5 m-70 -72.03 68.52 0.69 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.56 1.163 . . . . 73.03 109.654 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . 0.452 ' O ' ' NE2' ' A' ' 218' ' ' GLN . 0.1 OUTLIER -122.54 -174.39 2.9 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.486 1.116 . . . . 73.44 109.281 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 167' ' ' TYR . . . . . 0.749 ' CE1' ' CD1' ' A' ' 222' ' ' TRP . 8.2 t80 -45.56 -39.6 7.72 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.428 1.08 . . . . 74.01 110.992 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -128.17 149.02 50.62 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.569 1.168 . . . . 75.4 109.273 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 169' ' ' SER . . . . . 0.426 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 1.5 t -126.56 168.38 14.36 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.502 1.126 . . . . 74.44 110.034 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 2.0 t -129.52 117.06 41.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 O-C-N 124.557 1.161 . . . . 73.31 109.285 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 17.1 mm -124.25 99.91 36.53 Favored Pre-proline 0 C--N 1.326 -0.441 0 O-C-N 124.446 1.091 . . . . 73.12 109.287 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . 0.514 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.95 106.95 2.37 Favored 'Trans proline' 0 C--N 1.361 1.199 0 O-C-N 124.446 1.761 . . . . 74.11 111.017 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 173' ' ' MET . . . . . 0.402 ' CB ' HG23 ' A' ' 136' ' ' ILE . 3.5 ttt -87.77 152.44 22.12 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.442 1.088 . . . . 75.52 111.017 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 -106.43 123.9 37.39 Favored Pre-proline 0 C--N 1.325 -0.499 0 O-C-N 124.495 1.122 . . . . 74.45 110.293 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 175' ' ' PRO . . . . . 0.468 ' HB3' ' CD1' ' A' ' 138' ' ' LEU . 18.3 Cg_endo -74.94 155.0 43.19 Favored 'Trans proline' 0 C--N 1.36 1.175 0 O-C-N 124.528 1.804 . . . . 72.22 110.974 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . 0.565 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -96.0 -38.0 10.41 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.487 1.117 . . . . 74.25 109.304 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -72.9 -23.92 60.77 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.438 1.086 . . . . 71.04 109.336 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -110.38 110.24 58.12 Favored Pre-proline 0 C--N 1.325 -0.491 0 O-C-N 124.518 1.137 . . . . 74.5 109.313 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.93 115.5 4.31 Favored 'Trans proline' 0 C--N 1.359 1.094 0 O-C-N 124.525 1.802 . . . . 74.12 111.031 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . 0.5 ' CD1' ' OG1' ' A' ' 185' ' ' THR . 0.7 OUTLIER -118.11 96.98 50.41 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.535 1.147 . . . . 75.21 109.331 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.02 169.38 22.76 Favored 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.479 1.778 . . . . 71.31 110.996 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 12.3 ptt180 -70.55 -16.06 62.84 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.49 1.119 . . . . 65.22 110.374 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -78.74 -2.41 39.28 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.556 1.16 . . . . 64.33 110.318 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -128.4 8.04 5.93 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.473 1.108 . . . . 72.35 110.289 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 185' ' ' THR . . . . . 0.5 ' OG1' ' CD1' ' A' ' 180' ' ' LEU . 19.6 m -110.03 143.69 28.49 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.585 1.178 . . . . 74.51 110.371 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 186' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 185' ' ' THR . 18.3 Cg_endo -74.95 155.87 43.18 Favored 'Trans proline' 0 C--N 1.36 1.146 0 O-C-N 124.545 1.813 . . . . 64.44 110.983 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 187' ' ' PHE . . . . . 0.503 ' O ' ' CG2' ' A' ' 191' ' ' THR . 28.9 p90 -69.34 -7.38 36.78 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.488 1.118 . . . . 73.52 111.008 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.76 -53.17 4.13 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.449 1.093 . . . . 72.01 109.29 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.465 ' CD2' ' HG3' ' A' ' 172' ' ' PRO . 61.1 mt -68.27 -42.33 79.75 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.484 1.115 . . . . 75.33 109.328 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -63.77 -11.04 23.15 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.563 1.164 . . . . 65.03 110.279 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 191' ' ' THR . . . . . 0.503 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 34.4 p -113.0 -3.9 13.97 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.518 1.136 . . . . 73.51 110.411 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.499 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 7.9 mt -93.18 157.07 3.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 O-C-N 124.406 1.066 . . . . 72.11 109.301 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 193' ' ' ASN . . . . . 0.447 ' ND2' ' O ' ' A' ' 193' ' ' ASN . 25.4 t30 -76.97 56.95 1.27 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.417 1.073 . . . . 63.14 109.31 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . 0.514 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -50.99 163.18 0.21 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.58 1.175 . . . . 63.54 109.364 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 195' ' ' LEU . . . . . 0.471 HD21 ' CD1' ' A' ' 209' ' ' ILE . 0.2 OUTLIER -86.65 127.87 34.96 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 74.43 109.29 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -108.35 128.84 55.11 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.543 1.152 . . . . 72.13 110.345 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . 0.54 ' OE1' ' CD1' ' A' ' 202' ' ' PHE . 5.6 tp10 -109.74 -22.09 12.08 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.482 1.114 . . . . 74.25 110.322 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . 0.432 ' N ' HD13 ' A' ' 176' ' ' LEU . 2.2 pt-20 -94.82 19.12 10.59 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.495 1.122 . . . . 62.14 110.279 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -127.59 146.81 50.41 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.51 1.131 . . . . 62.33 110.001 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 12.6 tpp85 -63.18 -12.16 26.04 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.467 1.104 . . . . 75.14 110.298 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -93.76 16.43 60.82 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.545 1.153 . . . . 60.31 111.007 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 202' ' ' PHE . . . . . 0.701 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 5.3 t80 -67.83 -38.35 14.37 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.533 0.784 . . . . 74.23 110.986 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 203' ' ' PRO . . . . . 0.701 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.5 Cg_endo -74.98 -30.13 7.52 Favored 'Trans proline' 0 C--N 1.361 1.187 0 O-C-N 124.5 1.789 . . . . 62.35 111.073 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -64.08 -65.46 0.68 Allowed 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.521 1.138 . . . . 75.41 110.392 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -51.1 -42.28 60.55 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.423 1.077 . . . . 74.32 110.244 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 206' ' ' VAL . . . . . 0.543 ' CG2' ' O ' ' A' ' 202' ' ' PHE . 55.2 t -58.85 -28.41 37.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.487 1.117 . . . . 72.32 109.331 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -82.88 -47.6 11.66 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.521 1.138 . . . . 64.3 110.27 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -64.25 -64.01 0.99 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.459 1.099 . . . . 73.22 110.278 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 209' ' ' ILE . . . . . 0.549 HG22 ' CD1' ' A' ' 210' ' ' PHE . 54.2 mt -48.35 -53.01 6.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.515 1.135 . . . . 63.44 109.297 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 210' ' ' PHE . . . . . 0.584 ' HA ' ' CH2' ' A' ' 134' ' ' TRP . 0.8 OUTLIER -101.84 66.15 1.03 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.526 1.142 . . . . 75.25 111.016 179.993 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -110.92 146.37 36.69 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.504 1.128 . . . . 75.42 110.271 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . 0.452 ' O ' ' N ' ' A' ' 215' ' ' TYR . 63.9 tt0 -48.86 -55.62 11.13 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.503 1.127 . . . . 63.41 110.275 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -48.24 -24.03 1.06 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.522 1.138 . . . . 75.21 110.011 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 22.6 t -95.86 -29.02 3.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.493 1.121 . . . . 71.43 109.281 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 215' ' ' TYR . . . . . 0.477 ' OH ' ' CE2' ' A' ' 78' ' ' PHE . 12.3 t80 -65.1 -20.26 66.39 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 124.535 1.147 . . . . 72.41 110.922 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . 0.46 ' O ' ' CB ' ' A' ' 220' ' ' THR . 5.9 mmpt? -69.23 -57.3 5.52 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.57 1.169 . . . . 63.55 109.372 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 217' ' ' THR . . . . . 0.468 HG21 ' CD1' ' A' ' 221' ' ' ILE . 1.2 m -47.87 -53.66 15.03 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.505 1.128 . . . . 73.35 110.41 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 218' ' ' GLN . . . . . 0.452 ' NE2' ' O ' ' A' ' 166' ' ' LYS . 94.5 mm-40 -55.78 -66.94 0.34 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.455 1.097 . . . . 73.15 110.325 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 219' ' ' GLN . . . . . 0.456 ' O ' ' NE2' ' A' ' 219' ' ' GLN . 40.2 tp60 -54.57 -18.79 4.83 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.547 1.154 . . . . 71.45 110.304 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 220' ' ' THR . . . . . 0.46 ' CB ' ' O ' ' A' ' 216' ' ' LYS . 2.9 m -83.27 -28.41 29.16 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.565 1.165 . . . . 62.34 110.399 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 221' ' ' ILE . . . . . 0.468 ' CD1' HG21 ' A' ' 217' ' ' THR . 14.0 mt -83.81 -17.66 10.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.453 1.096 . . . . 73.21 109.263 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 222' ' ' TRP . . . . . 0.749 ' CD1' ' CE1' ' A' ' 167' ' ' TYR . 7.9 t90 -89.09 -59.63 2.17 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.957 -1.127 . . . . 75.44 107.957 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.14 -20.45 6.7 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.496 1.123 . . . . 73.42 109.327 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 . . . . . 0 C--N 1.325 -0.49 0 O-C-N 124.48 1.113 . . . . 74.13 110.286 -179.928 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.554 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 5.9 p . . . . . 0 N--CA 1.455 -0.222 0 N-CA-C 109.272 -0.64 . . . . 74.42 109.272 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.404 ' O ' ' O ' ' A' ' 79' ' ' LEU . 1.5 t80 -87.36 20.92 2.62 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.486 1.116 . . . . 74.21 110.985 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.404 ' O ' ' O ' ' A' ' 78' ' ' PHE . 6.5 tp -41.2 160.9 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.445 1.091 . . . . 75.24 109.341 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.506 ' O ' ' CB ' ' A' ' 133' ' ' ALA . 6.5 ptmt -111.08 -49.58 3.01 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 124.499 1.125 . . . . 75.21 109.308 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.578 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.2 OUTLIER -165.62 136.69 3.82 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.571 1.169 . . . . 74.01 111.04 -179.955 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.458 HG11 ' CB ' ' A' ' 128' ' ' ALA . 8.0 p -91.09 169.25 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.509 1.131 . . . . 71.3 109.293 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.552 ' CD1' ' CZ ' ' A' ' 81' ' ' PHE . 4.7 mp -133.04 96.97 2.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.478 1.111 . . . . 74.24 109.319 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.44 HD21 ' CD1' ' A' ' 112' ' ' PHE . 8.0 mt -69.59 124.15 23.19 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.468 1.105 . . . . 73.21 109.348 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.549 ' CD2' ' HB ' ' A' ' 111' ' ' ILE . 2.8 p80 -146.06 174.72 11.04 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.447 1.092 . . . . 74.05 109.658 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.467 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -131.8 164.65 25.56 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.442 1.089 . . . . 73.32 109.336 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -55.62 -17.29 5.33 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.47 1.106 . . . . 72.34 110.268 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -76.47 -46.53 26.46 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.529 1.143 . . . . 73.04 109.313 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.442 ' OD2' ' ND2' ' A' ' 178' ' ' ASN . 21.8 m-20 -125.35 45.14 2.64 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.492 1.12 . . . . 60.02 109.318 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.516 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.9 OUTLIER -75.05 -37.59 61.65 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 73.23 110.378 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.82 -19.99 43.45 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.467 1.104 . . . . 54.44 109.295 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.42 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -75.46 -59.97 2.51 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.436 1.085 . . . . 74.1 110.24 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.491 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -60.56 -23.17 64.42 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.581 1.176 . . . . 64.21 109.287 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.451 HD23 ' CG ' ' A' ' 97' ' ' GLN . 0.2 OUTLIER -85.8 -41.42 15.07 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.498 1.123 . . . . 73.55 109.279 -179.992 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -53.19 -34.78 58.42 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.496 1.122 . . . . 74.42 110.347 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.472 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 9.5 p -83.19 -56.08 6.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.49 1.119 . . . . 74.24 109.308 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.472 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.1 OUTLIER -47.67 -23.27 0.65 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.466 1.104 . . . . 70.1 110.273 -179.955 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -77.24 -43.33 33.91 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.472 1.108 . . . . 65.25 109.308 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.457 HD22 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -75.53 -22.28 57.22 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.519 1.137 . . . . 72.51 109.321 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.457 ' N ' HD22 ' A' ' 99' ' ' LEU . 73.4 mt -65.02 -49.67 69.25 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.483 1.114 . . . . 74.34 109.326 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -78.7 53.24 1.31 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.527 1.142 . . . . 71.54 110.321 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -176.91 -66.56 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.526 1.141 . . . . 74.33 109.336 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -41.54 -48.53 3.96 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.579 1.175 . . . . 74.31 109.276 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -115.8 -29.96 6.25 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.512 1.132 . . . . 75.41 110.993 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 106.61 35.92 2.73 Favored Glycine 0 CA--C 1.53 0.972 0 O-C-N 124.474 1.109 . . . . 73.44 111.011 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.462 HG21 ' CE ' ' A' ' 80' ' ' LYS . 23.5 mm -75.84 87.77 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.539 0.788 . . . . 74.22 109.3 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.494 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -137.75 158.32 71.87 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.529 1.143 . . . . 75.41 109.292 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.494 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.4 Cg_endo -74.94 158.25 99.1 Favored 'Cis proline' 0 C--N 1.36 1.177 0 C-N-CA 121.023 -2.49 . . . . 70.22 111.038 -0.071 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -114.97 134.25 11.52 Favored Glycine 0 CA--C 1.53 1.005 0 O-C-N 124.524 1.14 . . . . 64.41 111.02 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -154.09 128.26 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.531 0.783 . . . . 71.31 109.277 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . 0.549 ' HB ' ' CD2' ' A' ' 85' ' ' HIS . 44.6 pt -89.68 -171.63 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 124.469 1.105 . . . . 72.43 109.26 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.44 ' CD1' HD21 ' A' ' 84' ' ' LEU . 2.3 t80 -81.33 -40.01 24.26 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.522 1.139 . . . . 74.11 111.037 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -73.97 -4.45 35.27 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.539 1.15 . . . . 72.01 109.261 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -106.69 -26.57 11.27 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.515 1.135 . . . . 74.14 110.298 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.429 ' CE ' HG23 ' A' ' 82' ' ' VAL . 31.9 tpp -44.48 110.88 1.1 Allowed Pre-proline 0 C--N 1.326 -0.443 0 O-C-N 124.386 1.054 . . . . 74.11 110.996 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 C--N 1.359 1.118 0 O-C-N 124.515 1.797 . . . . 64.11 111.043 179.941 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.411 ' CD2' ' ND2' ' A' ' 150' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.279 0 N-CA-C 109.336 -0.616 . . . . 74.25 109.336 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.444 ' HB3' ' CE2' ' A' ' 154' ' ' TYR . 7.7 p-10 -46.54 -25.96 0.79 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.55 1.156 . . . . 74.44 109.307 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.408 ' N ' ' C ' ' A' ' 125' ' ' LEU . 2.1 t70 -65.27 -55.46 18.27 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.506 1.129 . . . . 73.01 109.27 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.458 ' CB ' HG11 ' A' ' 82' ' ' VAL . . . -61.02 -15.24 29.74 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.479 1.112 . . . . 65.33 109.313 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 89.9 t -86.6 10.53 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.496 1.123 . . . . 72.54 109.258 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 14.5 t30 -127.61 158.97 36.08 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.494 1.121 . . . . 74.21 109.311 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 42.67 55.43 4.64 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 124.489 1.118 . . . . 65.23 111.028 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -162.53 165.54 25.94 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.532 0.784 . . . . 54.12 110.036 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . 0.598 ' O ' ' CD1' ' A' ' 134' ' ' TRP . . . -110.08 -25.49 10.19 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.493 1.121 . . . . 74.13 109.355 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.598 ' CD1' ' O ' ' A' ' 133' ' ' ALA . 4.0 m-90 -158.45 150.61 21.66 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.477 1.111 . . . . 72.23 108.062 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' THR . . . . . 0.411 ' OG1' ' HA ' ' A' ' 170' ' ' VAL . 7.0 p -125.94 154.8 42.32 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.529 1.143 . . . . 75.15 110.411 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.455 HG13 ' CG1' ' A' ' 83' ' ' ILE . 15.7 mm -105.42 91.65 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.461 1.1 . . . . 71.31 109.263 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.59 87.08 1.63 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.534 1.146 . . . . 73.41 109.3 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.499 ' O ' ' CD2' ' A' ' 143' ' ' PHE . 1.4 tp -62.1 96.2 0.07 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.495 1.122 . . . . 71.14 109.324 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.98 121.46 19.16 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.496 1.122 . . . . 74.43 109.303 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' THR . . . . . 0.483 ' CG2' ' OD1' ' A' ' 178' ' ' ASN . 7.0 m -137.9 -173.64 3.56 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.49 1.119 . . . . 70.32 110.394 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -84.93 -40.62 16.77 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 75.1 110.317 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . 0.409 ' ND2' ' N ' ' A' ' 143' ' ' PHE . 3.8 p-10 -89.67 -49.67 6.52 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.506 1.129 . . . . 73.5 109.32 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.499 ' CD2' ' O ' ' A' ' 138' ' ' LEU . 43.1 t80 -50.39 -28.04 7.42 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.473 1.108 . . . . 73.42 111.008 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -63.68 -67.85 0.39 Allowed 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.488 1.118 . . . . 65.55 109.263 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -48.59 -28.75 3.65 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.535 1.147 . . . . 75.24 110.389 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . 0.541 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 5.3 m-20 -71.48 -71.63 0.26 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.491 1.119 . . . . 71.52 109.35 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.476 HG23 ' CD2' ' A' ' 143' ' ' PHE . 65.7 p -49.08 -55.87 10.83 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.49 1.119 . . . . 72.43 110.404 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.561 ' CZ2' ' HB3' ' A' ' 186' ' ' PRO . 0.0 OUTLIER -46.39 -31.77 2.82 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.545 1.153 . . . . 74.12 108.009 -179.963 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' CYS . . . . . 0.541 ' CB ' ' O ' ' A' ' 146' ' ' ASP . 1.8 t -57.86 -46.21 85.17 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.546 1.154 . . . . 52.05 108.288 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' ASN . . . . . 0.475 ' ND2' ' O ' ' A' ' 147' ' ' THR . 0.8 OUTLIER -67.05 -41.6 86.22 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.525 1.14 . . . . 73.41 109.288 -179.996 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.559 ' CZ ' HD12 ' A' ' 157' ' ' LEU . 13.1 m-85 -55.34 -21.75 16.43 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.61 1.194 . . . . 75.43 111.064 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -85.49 -33.01 21.93 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.549 1.156 . . . . 72.52 110.366 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.525 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 2.5 t80 -110.25 21.19 17.02 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.513 1.133 . . . . 64.24 111.035 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.452 ' N ' ' O ' ' A' ' 150' ' ' ASN . 2.3 t80 -163.75 106.0 0.95 Allowed 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.52 1.137 . . . . 75.03 111.011 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 6.3 t -85.92 -10.75 54.72 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.478 1.111 . . . . 72.54 110.456 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 3.1 t -62.55 -23.11 66.82 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.536 1.148 . . . . 75.12 110.007 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.559 HD12 ' CZ ' ' A' ' 151' ' ' PHE . 0.2 OUTLIER -77.11 -37.86 53.33 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.526 1.141 . . . . 70.33 109.302 -179.993 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 158' ' ' MET . . . . . 0.461 ' HA ' ' CE ' ' A' ' 158' ' ' MET . 17.0 mmt -57.0 -35.83 69.67 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.439 1.087 . . . . 73.53 111.0 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' ASN . . . . . 0.448 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 33.9 m-80 -71.23 -38.01 72.0 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.527 1.142 . . . . 75.45 109.342 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 1.3 p -67.19 -35.34 79.43 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.496 1.122 . . . . 75.2 109.995 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . 0.486 ' O ' ' CD1' ' A' ' 192' ' ' ILE . 64.7 t -58.56 -22.92 21.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.474 1.108 . . . . 74.41 109.302 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 68.9 m-20 -83.18 -22.71 33.16 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.459 1.1 . . . . 75.13 109.306 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 54.47 35.16 22.63 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.571 1.169 . . . . 74.41 110.271 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . 0.448 ' NE2' ' O ' ' A' ' 159' ' ' ASN . 0.8 OUTLIER -52.56 -173.5 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.488 1.117 . . . . 74.31 110.316 179.944 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 12.2 p-80 -73.21 66.79 0.9 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.49 1.119 . . . . 73.24 109.622 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.32 160.39 26.8 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.485 1.116 . . . . 75.15 109.308 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 167' ' ' TYR . . . . . 0.516 ' CZ ' ' ND2' ' A' ' 168' ' ' ASN . 4.6 p90 -70.0 -6.12 31.13 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.456 1.098 . . . . 73.41 110.89 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . 0.516 ' ND2' ' CZ ' ' A' ' 167' ' ' TYR . 0.3 OUTLIER -122.81 137.44 54.93 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 124.493 1.12 . . . . 63.21 109.31 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 169' ' ' SER . . . . . 0.414 ' O ' ' HA ' ' A' ' 134' ' ' TRP . 0.7 OUTLIER -143.01 150.79 40.09 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.552 1.158 . . . . 65.01 110.024 179.997 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.411 ' HA ' ' OG1' ' A' ' 135' ' ' THR . 1.0 OUTLIER -126.18 150.5 31.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.474 1.109 . . . . 70.31 109.287 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 12.1 mm -139.65 112.51 7.71 Favored Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 124.532 1.145 . . . . 75.41 109.27 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . 0.466 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -75.0 106.9 2.37 Favored 'Trans proline' 0 C--N 1.36 1.183 0 O-C-N 124.548 1.815 . . . . 70.3 111.034 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 173' ' ' MET . . . . . 0.451 ' CB ' HG21 ' A' ' 136' ' ' ILE . 3.9 ttt -96.39 154.0 17.51 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.501 1.126 . . . . 70.13 110.974 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 57.8 mtm180 -110.66 121.53 40.86 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.476 1.11 . . . . 73.22 110.319 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.97 151.66 39.96 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.458 1.767 . . . . 73.0 111.037 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . 0.603 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -85.15 -43.54 13.75 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.458 1.099 . . . . 74.11 109.318 -179.996 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -71.82 -28.34 63.52 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.496 1.123 . . . . 64.52 109.28 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 178' ' ' ASN . . . . . 0.483 ' OD1' ' CG2' ' A' ' 140' ' ' THR . 2.6 m-80 -110.44 99.63 41.57 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.547 1.155 . . . . 73.35 109.242 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.98 115.09 4.18 Favored 'Trans proline' 0 C--N 1.359 1.122 0 O-C-N 124.512 1.796 . . . . 73.4 110.99 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . 0.47 HD22 ' CB ' ' A' ' 184' ' ' ARG . 0.6 OUTLIER -122.81 96.91 44.71 Favored Pre-proline 0 C--N 1.324 -0.518 0 O-C-N 124.528 1.143 . . . . 74.52 109.325 179.964 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.99 169.13 23.31 Favored 'Trans proline' 0 C--N 1.36 1.159 0 O-C-N 124.502 1.79 . . . . 63.45 111.013 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . 0.428 ' CG ' ' N ' ' A' ' 183' ' ' GLU . 23.1 ptt180 -53.1 -39.34 63.32 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.518 1.136 . . . . 74.0 110.3 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . 0.428 ' N ' ' CG ' ' A' ' 182' ' ' ARG . 5.4 pt-20 -52.01 -36.09 48.9 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.439 1.087 . . . . 73.44 110.375 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 184' ' ' ARG . . . . . 0.47 ' CB ' HD22 ' A' ' 180' ' ' LEU . 35.3 mmt180 -89.58 -18.43 26.58 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.427 1.079 . . . . 75.41 110.278 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 185' ' ' THR . . . . . . . . . . . . . 20.7 m -82.2 143.91 49.61 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.494 1.121 . . . . 73.41 110.361 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 186' ' ' PRO . . . . . 0.561 ' HB3' ' CZ2' ' A' ' 148' ' ' TRP . 18.4 Cg_endo -74.96 155.15 43.12 Favored 'Trans proline' 0 C--N 1.36 1.134 0 O-C-N 124.5 1.79 . . . . 74.01 111.022 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 187' ' ' PHE . . . . . 0.505 ' O ' ' CG2' ' A' ' 191' ' ' THR . 23.3 p90 -68.93 -7.09 31.76 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.582 1.176 . . . . 73.14 111.006 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.92 -53.11 4.12 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.592 1.182 . . . . 63.23 109.283 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.437 ' CD2' ' HG3' ' A' ' 172' ' ' PRO . 51.7 mt -68.54 -42.36 78.55 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.542 1.151 . . . . 74.45 109.326 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -63.62 -11.36 24.46 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.518 1.136 . . . . 72.34 110.316 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 191' ' ' THR . . . . . 0.505 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 29.1 p -111.81 19.55 17.87 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.48 1.113 . . . . 74.31 110.396 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.486 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 5.3 mt -138.21 139.33 42.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 O-C-N 124.5 1.125 . . . . 74.13 109.306 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 12.5 t30 -47.26 97.06 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.525 1.141 . . . . 73.1 109.315 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . 0.466 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -88.83 141.29 28.62 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.52 1.137 . . . . 63.45 109.31 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 195' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.47 136.09 57.91 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.51 1.131 . . . . 73.43 109.297 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -116.54 129.7 56.33 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.459 1.1 . . . . 71.32 110.349 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . 0.603 ' OE2' ' CD1' ' A' ' 202' ' ' PHE . 41.6 tp10 -113.16 -29.12 7.4 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.493 1.12 . . . . 73.22 110.335 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.1 21.24 6.01 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.521 1.138 . . . . 63.33 110.317 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 1.2 t -128.63 145.4 51.16 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.555 1.16 . . . . 65.03 109.997 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.17 -14.05 44.28 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.475 1.11 . . . . 74.4 110.258 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -92.82 16.22 60.82 Favored Glycine 0 CA--C 1.531 1.04 0 O-C-N 124.542 1.151 . . . . 73.22 111.004 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 202' ' ' PHE . . . . . 0.642 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 0.5 OUTLIER -61.15 -41.67 81.97 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.447 0.733 . . . . 74.02 110.997 -179.996 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 203' ' ' PRO . . . . . 0.642 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.05 -34.71 3.57 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.445 1.76 . . . . 52.1 111.013 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.09 -55.43 31.12 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.495 1.122 . . . . 62.3 110.407 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -65.51 -40.05 92.55 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.495 1.122 . . . . 73.31 110.34 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 206' ' ' VAL . . . . . 0.51 ' CG2' ' O ' ' A' ' 202' ' ' PHE . 72.9 t -64.45 -28.83 45.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.544 1.153 . . . . 74.31 109.239 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -83.07 -38.74 22.1 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.5 1.125 . . . . 72.43 110.305 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 79.3 mtt-85 -74.05 -65.49 0.83 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.545 1.153 . . . . 75.53 110.354 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 209' ' ' ILE . . . . . 0.493 HG21 ' CD1' ' A' ' 210' ' ' PHE . 90.8 mt -46.26 -50.03 5.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 124.447 1.092 . . . . 72.44 109.358 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 210' ' ' PHE . . . . . 0.5 ' HA ' ' CH2' ' A' ' 134' ' ' TRP . 0.9 OUTLIER -100.98 71.82 1.44 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.483 1.114 . . . . 72.43 111.006 179.943 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 211' ' ' GLN . . . . . 0.48 ' CG ' ' HB ' ' A' ' 214' ' ' VAL . 11.1 pt20 -110.9 138.64 47.05 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.49 1.119 . . . . 73.31 110.261 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . 0.422 ' C ' ' N ' ' A' ' 214' ' ' VAL . 6.8 tt0 -51.49 -50.97 58.87 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 63.05 110.339 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.4 t -47.26 -21.55 0.29 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.554 1.159 . . . . 74.0 110.009 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.48 ' HB ' ' CG ' ' A' ' 211' ' ' GLN . 2.0 t -96.95 -43.07 12.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.544 1.153 . . . . 75.22 109.269 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 215' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -46.0 -40.05 9.95 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.526 1.141 . . . . 64.11 111.026 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -54.13 -66.31 0.42 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.491 1.119 . . . . 72.31 109.249 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 2.0 m -46.1 -66.54 0.39 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.51 1.131 . . . . 75.13 110.367 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 218' ' ' GLN . . . . . 0.422 ' O ' ' N ' ' A' ' 221' ' ' ILE . 18.5 mm-40 -39.55 -64.47 0.47 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.561 1.163 . . . . 74.44 110.284 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 219' ' ' GLN . . . . . 0.415 ' O ' ' N ' ' A' ' 223' ' ' LYS . 25.6 tp60 -44.14 -52.42 7.3 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.501 1.126 . . . . 75.12 110.304 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.83 -33.03 47.47 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.549 1.156 . . . . 70.33 110.42 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 221' ' ' ILE . . . . . 0.422 ' N ' ' O ' ' A' ' 218' ' ' GLN . 12.5 mt -74.67 -48.32 34.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.519 1.137 . . . . 71.13 109.299 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 222' ' ' TRP . . . . . 0.554 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 78.3 t90 -67.32 -17.96 64.98 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.032 -1.099 . . . . 73.01 108.032 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 219' ' ' GLN . 0.0 OUTLIER -84.63 -49.42 8.56 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.453 1.096 . . . . 72.5 109.284 -179.994 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 . . . . . 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 75.53 110.372 179.983 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.595 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 2.7 p . . . . . 0 N--CA 1.453 -0.324 0 N-CA-C 109.291 -0.633 . . . . 75.31 109.291 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.408 ' CE2' ' HG3' ' A' ' 108' ' ' PRO . 51.3 p90 -89.61 31.33 0.94 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.481 1.113 . . . . 73.41 111.035 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 9.3 tp -40.23 139.1 0.77 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.506 1.129 . . . . 71.4 109.338 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.4 mtpt -76.54 -63.43 1.34 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.492 1.12 . . . . 74.15 109.29 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.601 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.8 OUTLIER -160.81 127.9 4.21 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.562 1.164 . . . . 73.13 110.918 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.456 ' CG1' HG23 ' A' ' 135' ' ' THR . 12.3 p -84.55 169.59 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.549 1.155 . . . . 64.15 109.281 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.563 HD13 ' CZ ' ' A' ' 81' ' ' PHE . 1.7 mp -129.65 94.41 2.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.514 1.134 . . . . 74.12 109.246 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.538 HD23 ' CE2' ' A' ' 112' ' ' PHE . 3.0 mt -71.71 93.64 1.29 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.473 1.108 . . . . 70.44 109.299 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.603 ' CE1' ' OG1' ' A' ' 90' ' ' THR . 0.0 OUTLIER -115.05 174.51 5.94 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.487 1.117 . . . . 74.41 109.602 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -100.68 164.09 12.03 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.564 1.165 . . . . 73.03 109.316 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.47 ' CG ' ' O ' ' A' ' 87' ' ' GLU . 13.4 tt0 -71.23 -5.6 33.28 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.496 1.123 . . . . 71.32 110.3 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -91.06 -45.46 8.68 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.466 1.103 . . . . 64.43 109.296 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.452 ' N ' ' OD1' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -114.7 44.23 1.79 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.48 1.113 . . . . 74.41 109.31 179.954 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.603 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -76.91 -34.69 57.7 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.515 1.134 . . . . 61.23 110.396 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.401 ' N ' HG23 ' A' ' 90' ' ' THR . 1.6 m-20 -75.52 -19.54 59.29 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.493 1.121 . . . . 72.34 109.33 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -78.53 -57.07 3.96 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.444 1.09 . . . . 71.12 110.336 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.477 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -63.13 -16.46 60.11 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 73.14 109.3 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.431 ' O ' ' HG3' ' A' ' 97' ' ' GLN . 0.1 OUTLIER -89.51 -53.75 4.39 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.486 1.116 . . . . 74.23 109.345 179.976 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.426 ' N ' HD11 ' A' ' 94' ' ' LEU . 20.3 tpp180 -44.1 -29.62 0.64 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.5 1.125 . . . . 73.41 110.306 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.47 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 10.6 p -86.13 -56.23 5.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 O-C-N 124.403 1.064 . . . . 74.31 109.286 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.47 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -47.44 -23.74 0.67 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.454 1.096 . . . . 71.54 110.309 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.75 -39.19 57.58 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.515 1.135 . . . . 74.23 109.318 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.542 ' O ' ' CB ' ' A' ' 103' ' ' ASP . 0.0 OUTLIER -83.73 -19.52 35.03 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.505 1.128 . . . . 75.01 109.344 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.403 ' O ' ' HB ' ' A' ' 106' ' ' ILE . 87.7 mt -79.33 -20.17 48.52 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.477 1.111 . . . . 62.45 109.234 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . 0.512 ' O ' ' CD ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -89.47 -11.98 41.45 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.475 1.109 . . . . 73.42 110.247 -179.96 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . 0.468 ' O ' ' C ' ' A' ' 103' ' ' ASP . 29.2 t70 -116.07 -57.21 2.24 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.434 1.084 . . . . 73.15 109.342 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.542 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 7.2 t0 -34.41 -65.68 0.19 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.516 1.135 . . . . 70.13 109.347 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.562 ' CE1' HG12 ' A' ' 206' ' ' VAL . 4.3 m-85 -102.63 -31.88 10.16 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.475 1.109 . . . . 73.14 111.02 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.473 ' O ' ' N ' ' A' ' 107' ' ' LYS . . . 108.57 28.47 4.55 Favored Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.488 1.118 . . . . 62.12 110.987 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.569 HG23 ' CE1' ' A' ' 81' ' ' PHE . 24.1 mm -65.29 73.89 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.479 0.752 . . . . 70.3 109.325 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.512 ' CD ' ' O ' ' A' ' 101' ' ' GLN . 0.8 OUTLIER -127.45 156.34 75.26 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.504 1.127 . . . . 74.03 109.295 -179.936 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.505 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.1 Cg_endo -75.05 132.14 26.57 Favored 'Cis proline' 0 C--N 1.361 1.192 0 C-N-CA 120.98 -2.508 . . . . 74.41 110.991 0.091 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . 0.413 ' N ' ' HA ' ' A' ' 107' ' ' LYS . . . -107.02 117.19 5.23 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.444 1.09 . . . . 74.23 110.959 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -131.38 150.3 34.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 O-C-N 124.484 0.756 . . . . 74.44 109.307 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 45.3 pt -99.2 -175.56 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.499 1.125 . . . . 74.44 109.322 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.538 ' CE2' HD23 ' A' ' 84' ' ' LEU . 0.4 OUTLIER -81.82 -18.7 43.08 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.542 1.151 . . . . 71.32 111.059 179.994 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.87 -3.61 51.51 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.481 1.113 . . . . 74.13 109.266 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -106.82 -24.85 11.93 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.532 1.145 . . . . 71.23 110.321 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.455 ' CE ' HG23 ' A' ' 82' ' ' VAL . 15.0 ttm -55.9 110.97 2.64 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.509 1.13 . . . . 71.44 110.993 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo . . . . . 0 C--N 1.361 1.188 0 O-C-N 124.497 1.788 . . . . 64.24 110.935 -179.927 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.434 ' C ' ' CD1' ' A' ' 125' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 109.26 -0.644 . . . . 72.24 109.26 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -78.85 -14.55 59.18 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.486 1.116 . . . . 73.23 109.322 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -58.15 -52.59 64.91 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.51 1.131 . . . . 54.0 109.309 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.44 ' CB ' ' HG ' ' A' ' 84' ' ' LEU . . . -67.4 -14.52 63.0 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.48 1.112 . . . . 61.41 109.304 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.5 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 52.0 t -87.46 11.67 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.539 1.149 . . . . 71.15 109.25 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -141.09 124.51 16.67 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.556 1.16 . . . . 63.3 109.288 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 90.84 41.57 5.29 Favored Glycine 0 CA--C 1.53 0.987 0 O-C-N 124.608 1.193 . . . . 74.01 111.003 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.77 166.23 24.5 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.491 0.759 . . . . 71.23 110.021 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . 0.572 ' HB1' ' CE3' ' A' ' 134' ' ' TRP . . . -87.58 -56.46 3.34 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.464 1.102 . . . . 73.21 109.296 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.572 ' CE3' ' HB1' ' A' ' 133' ' ' ALA . 1.8 m-90 -131.21 177.23 7.62 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.973 -1.121 . . . . 73.24 107.973 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' THR . . . . . 0.456 HG23 ' CG1' ' A' ' 82' ' ' VAL . 25.9 p -152.4 132.62 13.58 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.462 1.101 . . . . 74.34 110.454 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.403 ' HA ' ' O ' ' A' ' 171' ' ' ILE . 1.3 mp -84.32 140.78 15.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.464 1.102 . . . . 75.13 109.274 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.454 HD12 ' CE1' ' A' ' 143' ' ' PHE . 2.8 mm? -126.73 96.71 4.74 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.609 1.193 . . . . 74.11 109.283 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.456 HD22 ' CB ' ' A' ' 85' ' ' HIS . 0.1 OUTLIER -62.65 97.85 0.11 Allowed 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.47 1.106 . . . . 74.15 109.302 179.988 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.437 ' CD2' HG22 ' A' ' 185' ' ' THR . 3.2 tp -66.84 103.72 1.19 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.577 1.173 . . . . 75.51 109.321 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' THR . . . . . 0.487 ' CG2' ' OD1' ' A' ' 178' ' ' ASN . 2.7 m -121.39 177.85 5.03 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.482 1.114 . . . . 62.42 110.409 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . 0.431 ' HG3' ' CD2' ' A' ' 180' ' ' LEU . 2.2 mp0 -83.83 -35.9 23.88 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.431 1.082 . . . . 75.52 110.298 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . 0.44 ' OD1' ' N ' ' A' ' 143' ' ' PHE . 15.3 p30 -85.79 -41.92 14.64 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.47 1.106 . . . . 74.34 109.286 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.454 ' CE1' HD12 ' A' ' 137' ' ' LEU . 61.3 t80 -63.67 -21.39 66.36 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.462 1.102 . . . . 75.32 110.974 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.462 ' C ' ' CD1' ' A' ' 144' ' ' LEU . 2.0 tm? -63.88 -67.52 0.42 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.504 1.127 . . . . 72.12 109.337 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 52.6 mmm-85 -56.71 -17.41 8.84 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.558 1.161 . . . . 75.33 110.292 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.19 -66.5 0.72 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.482 1.113 . . . . 75.4 109.296 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.56 ' HB ' ' CZ ' ' A' ' 151' ' ' PHE . 2.5 p -68.29 -53.94 20.93 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.494 1.121 . . . . 73.1 110.376 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 3.6 t-105 -43.31 -41.99 4.28 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.482 1.114 . . . . 73.04 108.025 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' CYS . . . . . 0.453 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 41.7 t -71.94 -45.43 61.13 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.53 1.144 . . . . 72.33 108.244 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' ASN . . . . . 0.426 ' N ' ' O ' ' A' ' 147' ' ' THR . 27.9 m120 -52.42 -30.83 31.4 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.427 1.079 . . . . 73.33 109.299 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.694 ' CE1' ' CD1' ' A' ' 157' ' ' LEU . 7.7 m-30 -73.14 -36.11 66.62 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.546 1.153 . . . . 74.1 110.969 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -65.05 -29.95 70.88 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.519 1.137 . . . . 61.44 110.317 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -93.64 -32.05 14.23 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.452 1.095 . . . . 74.41 111.029 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.419 ' CD2' ' HB3' ' A' ' 156' ' ' SER . 1.6 t80 -132.76 97.92 4.18 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.537 1.148 . . . . 75.25 111.037 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 2.9 t -65.64 -10.99 40.86 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.468 1.105 . . . . 75.53 110.409 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' SER . . . . . 0.419 ' HB3' ' CD2' ' A' ' 154' ' ' TYR . 3.4 t -52.02 -36.01 48.67 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.46 1.1 . . . . 74.44 110.042 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.694 ' CD1' ' CE1' ' A' ' 151' ' ' PHE . 1.7 tm? -87.66 -28.92 21.54 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.467 1.105 . . . . 74.31 109.21 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 158' ' ' MET . . . . . 0.54 ' HE3' ' CD2' ' A' ' 151' ' ' PHE . 1.6 tpt -62.85 -16.52 58.93 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.498 1.124 . . . . 74.53 110.992 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -90.63 -10.8 41.96 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.546 1.154 . . . . 74.43 109.311 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 160' ' ' SER . . . . . 0.454 ' HB3' ' CG2' ' A' ' 170' ' ' VAL . 0.7 OUTLIER -81.46 -38.57 26.18 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.529 1.143 . . . . 74.13 110.008 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . 0.466 ' O ' ' CD1' ' A' ' 192' ' ' ILE . 4.1 m -59.85 -18.28 15.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.485 1.116 . . . . 71.02 109.317 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 162' ' ' ASN . . . . . 0.513 ' N ' HD21 ' A' ' 162' ' ' ASN . 1.0 OUTLIER -63.91 -13.16 43.28 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.521 1.138 . . . . 73.15 109.258 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.462 ' CG ' HG22 ' A' ' 192' ' ' ILE . 4.8 mmm180 63.02 39.79 9.81 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.467 1.104 . . . . 63.55 110.344 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -52.51 -174.1 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.553 1.158 . . . . 72.54 110.333 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -127.34 50.7 1.97 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.49 1.119 . . . . 74.33 109.618 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -98.43 -174.37 2.8 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.55 1.156 . . . . 70.02 109.344 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 167' ' ' TYR . . . . . 0.603 ' CD1' ' N ' ' A' ' 168' ' ' ASN . 26.4 p90 -54.81 -42.68 72.15 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.543 1.152 . . . . 72.24 111.024 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . 0.603 ' N ' ' CD1' ' A' ' 167' ' ' TYR . 1.2 p-10 -98.05 134.94 40.44 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.411 1.07 . . . . 73.45 109.272 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 169' ' ' SER . . . . . 0.445 ' N ' ' O ' ' A' ' 133' ' ' ALA . 16.1 m -123.55 146.76 47.87 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.459 1.099 . . . . 72.33 109.968 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.454 ' CG2' ' HB3' ' A' ' 160' ' ' SER . 43.5 t -103.33 137.94 29.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 O-C-N 124.44 1.088 . . . . 75.2 109.314 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . 0.403 ' O ' ' HA ' ' A' ' 136' ' ' ILE . 15.9 mm -141.86 104.99 5.76 Favored Pre-proline 0 C--N 1.325 -0.463 0 O-C-N 124.542 1.151 . . . . 73.21 109.283 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . 0.506 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.3 Cg_endo -74.96 106.2 2.23 Favored 'Trans proline' 0 C--N 1.36 1.167 0 O-C-N 124.478 1.778 . . . . 72.33 111.015 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 4.4 ttt -94.06 154.27 17.71 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.437 1.086 . . . . 73.22 111.034 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -113.66 116.46 45.68 Favored Pre-proline 0 C--N 1.325 -0.475 0 O-C-N 124.533 1.145 . . . . 73.42 110.265 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 153.65 42.0 Favored 'Trans proline' 0 C--N 1.359 1.129 0 O-C-N 124.476 1.777 . . . . 72.32 110.948 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . 0.562 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -91.25 -39.32 12.15 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.508 1.13 . . . . 72.43 109.293 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -72.61 -23.38 60.93 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.509 1.13 . . . . 65.14 109.258 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 178' ' ' ASN . . . . . 0.487 ' OD1' ' CG2' ' A' ' 140' ' ' THR . 1.1 m-80 -110.75 108.21 57.95 Favored Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.493 1.121 . . . . 73.32 109.339 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.96 125.23 9.21 Favored 'Trans proline' 0 C--N 1.36 1.134 0 O-C-N 124.511 1.795 . . . . 63.33 110.971 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . 0.431 ' CD2' ' HG3' ' A' ' 141' ' ' GLU . 1.2 tm? -140.68 97.02 7.41 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.455 1.097 . . . . 73.42 109.327 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.02 153.77 41.94 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.567 1.825 . . . . 70.41 111.004 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.44 -29.06 61.19 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.577 1.173 . . . . 74.23 110.323 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -58.71 -31.62 68.42 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.555 1.159 . . . . 74.2 110.306 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 -99.41 13.24 33.95 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.463 1.102 . . . . 73.01 110.298 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 185' ' ' THR . . . . . 0.437 HG22 ' CD2' ' A' ' 139' ' ' LEU . 46.5 m -106.53 144.13 28.39 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.537 1.148 . . . . 73.01 110.384 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.04 146.04 32.04 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.527 1.804 . . . . 74.23 111.012 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 187' ' ' PHE . . . . . . . . . . . . . 14.0 p90 -62.4 -11.94 18.64 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.475 1.109 . . . . 72.41 110.994 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -87.2 -53.79 4.66 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.586 1.179 . . . . 72.33 109.23 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.415 HD21 ' CG1' ' A' ' 161' ' ' VAL . 22.4 mt -74.19 -17.67 60.87 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.496 1.123 . . . . 74.11 109.267 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 190' ' ' GLN . . . . . 0.48 ' CG ' ' O ' ' A' ' 190' ' ' GLN . 6.8 tt0 -86.41 0.69 53.54 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.443 1.089 . . . . 62.51 110.331 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 191' ' ' THR . . . . . . . . . . . . . 34.1 p -127.87 16.18 6.86 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.488 1.117 . . . . 71.41 110.383 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.466 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 19.1 mt -117.08 152.12 18.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.481 1.113 . . . . 64.01 109.335 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 21.9 t30 -61.73 97.86 0.08 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.478 1.111 . . . . 73.31 109.343 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . 0.506 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -89.39 164.85 14.7 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.465 1.103 . . . . 74.25 109.28 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 195' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.09 126.4 50.25 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.429 1.081 . . . . 71.44 109.368 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -103.54 128.98 50.67 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.503 1.127 . . . . 73.24 110.289 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -106.75 -30.48 8.92 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.499 1.124 . . . . 63.51 110.256 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . 0.433 ' N ' HD11 ' A' ' 176' ' ' LEU . 4.0 pt-20 -92.51 25.24 3.1 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.511 1.132 . . . . 73.21 110.342 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.24 151.28 51.64 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.561 1.163 . . . . 63.41 109.987 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 9.9 tpt85 -67.62 -11.88 59.19 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.461 1.101 . . . . 72.22 110.312 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -93.62 15.37 63.2 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.503 1.127 . . . . 73.11 110.966 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 202' ' ' PHE . . . . . 0.683 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 8.5 t80 -66.29 -38.84 23.27 Favored Pre-proline 0 C--N 1.325 -0.463 0 O-C-N 124.443 0.731 . . . . 64.4 111.046 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 203' ' ' PRO . . . . . 0.683 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -74.95 -42.04 0.58 Allowed 'Trans proline' 0 C--N 1.36 1.162 0 O-C-N 124.556 1.819 . . . . 75.15 110.944 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -48.38 -63.13 1.16 Allowed 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.529 1.143 . . . . 74.4 110.406 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 205' ' ' GLN . . . . . 0.448 ' O ' ' N ' ' A' ' 209' ' ' ILE . 7.7 mt-30 -55.46 -55.48 31.22 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.468 1.105 . . . . 64.04 110.312 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 206' ' ' VAL . . . . . 0.562 HG12 ' CE1' ' A' ' 104' ' ' PHE . 75.4 t -47.24 -31.07 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.541 1.151 . . . . 74.54 109.256 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -81.15 -39.05 26.15 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.515 1.134 . . . . 71.41 110.266 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -77.03 -66.64 0.8 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.475 1.11 . . . . 73.33 110.34 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 209' ' ' ILE . . . . . 0.582 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 92.9 mt -44.53 -47.23 2.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.487 1.117 . . . . 74.44 109.301 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 210' ' ' PHE . . . . . 0.582 ' CE1' ' CG2' ' A' ' 209' ' ' ILE . 0.7 OUTLIER -107.66 66.87 0.67 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.466 1.104 . . . . 75.44 110.985 179.99 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -110.8 146.3 36.64 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.547 1.154 . . . . 73.22 110.318 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . 0.441 ' O ' ' N ' ' A' ' 215' ' ' TYR . 29.6 tt0 -48.85 -55.18 12.4 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.552 1.157 . . . . 73.42 110.351 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.04 -24.6 1.63 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.449 1.093 . . . . 63.34 109.995 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 40.3 t -96.22 -26.45 4.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.585 1.178 . . . . 75.31 109.29 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 215' ' ' TYR . . . . . 0.441 ' N ' ' O ' ' A' ' 212' ' ' GLU . 4.2 t80 -67.46 -34.18 76.66 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.549 1.155 . . . . 73.34 111.021 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . 0.419 ' O ' ' CB ' ' A' ' 220' ' ' THR . 41.3 mmtt -54.32 -59.45 4.66 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.493 1.121 . . . . 74.32 109.255 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 217' ' ' THR . . . . . 0.486 ' CG2' ' CD1' ' A' ' 221' ' ' ILE . 7.6 m -52.78 -66.51 0.37 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.444 1.09 . . . . 73.55 110.406 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -39.74 -65.33 0.4 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.508 1.13 . . . . 73.32 110.271 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -55.51 -30.44 60.69 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.491 1.12 . . . . 65.33 110.249 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 220' ' ' THR . . . . . 0.432 ' N ' ' O ' ' A' ' 217' ' ' THR . 2.1 m -76.63 -20.59 56.54 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.49 1.119 . . . . 71.53 110.393 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 221' ' ' ILE . . . . . 0.486 ' CD1' ' CG2' ' A' ' 217' ' ' THR . 15.2 mt -90.15 -28.46 5.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.523 1.14 . . . . 71.04 109.317 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 222' ' ' TRP . . . . . 0.595 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 23.9 t90 -69.62 -29.22 66.66 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.514 1.134 . . . . 75.43 107.972 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . 0.446 ' HG3' ' N ' ' A' ' 224' ' ' GLU . 0.5 OUTLIER -86.85 -27.91 23.2 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.473 1.108 . . . . 72.03 109.302 -179.976 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . 0.446 ' N ' ' HG3' ' A' ' 223' ' ' LYS . 1.6 mm-40 . . . . . 0 C--N 1.326 -0.443 0 O-C-N 124.5 1.125 . . . . 72.23 110.273 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.587 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.2 p . . . . . 0 N--CA 1.454 -0.234 0 N-CA-C 109.249 -0.648 . . . . 73.41 109.249 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.489 ' CE2' ' OH ' ' A' ' 215' ' ' TYR . 13.7 t80 -88.71 25.41 1.75 Allowed 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.47 1.106 . . . . 75.11 111.019 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.438 HD13 ' CG2' ' A' ' 110' ' ' ILE . 4.7 tp -39.79 158.33 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.474 1.109 . . . . 75.0 109.298 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.557 ' HG3' ' CE1' ' A' ' 215' ' ' TYR . 6.9 ttpt -104.97 -51.86 2.96 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.597 1.185 . . . . 70.35 109.261 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.589 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.4 OUTLIER -165.46 132.69 2.91 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.461 1.101 . . . . 75.11 111.039 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.461 HG12 ' CB ' ' A' ' 128' ' ' ALA . 2.7 p -86.25 166.8 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.489 1.118 . . . . 74.41 109.324 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.464 ' CG1' HG13 ' A' ' 136' ' ' ILE . 5.0 mp -129.64 93.18 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.51 1.132 . . . . 72.03 109.27 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.449 ' HG ' ' CB ' ' A' ' 128' ' ' ALA . 5.0 mt -70.16 116.19 10.23 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.513 1.133 . . . . 73.5 109.396 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.596 ' CE1' ' OG1' ' A' ' 90' ' ' THR . 0.0 OUTLIER -134.15 174.36 10.59 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.492 1.12 . . . . 74.45 109.578 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -113.22 164.4 13.58 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.609 1.193 . . . . 75.13 109.263 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.451 ' CG ' ' O ' ' A' ' 87' ' ' GLU . 16.7 tt0 -68.41 -7.64 33.38 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.584 1.177 . . . . 72.55 110.318 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -89.54 -26.74 20.7 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.522 1.139 . . . . 73.22 109.286 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.502 ' O ' ' CD2' ' A' ' 138' ' ' LEU . 1.3 m-20 -142.56 44.25 1.62 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.526 1.142 . . . . 74.03 109.314 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.596 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -76.82 -33.69 57.95 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.435 1.085 . . . . 73.04 110.385 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -73.89 -41.33 62.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.479 1.112 . . . . 61.4 109.31 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.405 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 4.8 tp10 -58.65 -52.36 66.03 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.566 1.167 . . . . 73.41 110.355 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.47 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -59.25 -25.79 64.35 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.527 1.142 . . . . 74.22 109.296 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.439 ' O ' ' CD2' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -82.26 -34.57 28.7 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.533 1.145 . . . . 75.24 109.321 179.919 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -55.58 -29.6 59.34 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.486 1.116 . . . . 70.5 110.294 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.449 ' C ' ' N ' ' A' ' 98' ' ' ASN . 1.7 t -83.1 -65.1 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.547 1.155 . . . . 75.14 109.33 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.441 ' N ' HG12 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -40.27 -27.69 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.47 1.106 . . . . 74.22 110.29 179.995 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.449 ' N ' ' C ' ' A' ' 96' ' ' VAL . 2.0 t-20 -70.53 -54.57 11.65 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.469 1.106 . . . . 72.24 109.253 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.47 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -67.74 -22.88 65.21 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.464 1.102 . . . . 71.04 109.334 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.471 ' CD2' HG23 ' A' ' 206' ' ' VAL . 28.5 mt -61.43 -57.96 10.09 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.539 1.149 . . . . 75.13 109.305 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -75.27 59.97 1.06 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.489 1.118 . . . . 74.11 110.341 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.4 t70 177.99 -65.46 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.528 1.143 . . . . 73.41 109.298 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.565 ' OD1' ' CE1' ' A' ' 104' ' ' PHE . 9.2 t70 -47.24 -50.26 21.56 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.484 1.115 . . . . 73.45 109.312 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.565 ' CE1' ' OD1' ' A' ' 103' ' ' ASP . 2.0 m-85 -114.55 -26.51 7.88 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.416 1.073 . . . . 64.24 111.069 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.47 45.92 2.65 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.523 1.139 . . . . 74.15 110.99 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.418 HD12 ' NZ ' ' A' ' 80' ' ' LYS . 4.9 mm -86.91 84.13 2.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.436 0.727 . . . . 73.12 109.379 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.501 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -132.71 156.7 79.79 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.444 1.09 . . . . 74.04 109.271 179.999 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.501 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.95 152.45 98.23 Favored 'Cis proline' 0 C--N 1.36 1.152 0 C-N-CA 120.948 -2.522 . . . . 70.33 111.006 -0.053 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.82 138.34 10.23 Favored Glycine 0 CA--C 1.529 0.921 0 O-C-N 124.531 1.145 . . . . 73.44 111.038 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.438 ' CG2' HD13 ' A' ' 79' ' ' LEU . 1.8 tt -156.01 150.54 10.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.415 0.715 . . . . 74.02 109.338 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . 0.422 ' HB ' ' NE2' ' A' ' 85' ' ' HIS . 9.8 pt -101.35 168.7 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.525 1.141 . . . . 65.54 109.293 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -67.18 -19.8 65.63 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.513 1.133 . . . . 74.44 111.073 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -87.2 -14.29 41.54 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.519 1.137 . . . . 64.13 109.292 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -102.85 -19.11 14.79 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.446 1.091 . . . . 72.14 110.287 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 6.5 ttm -46.56 144.05 3.67 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.512 1.132 . . . . 73.44 111.042 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 C--N 1.359 1.119 0 O-C-N 124.462 1.77 . . . . 71.01 111.0 -179.982 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.453 -0.305 0 N-CA-C 109.349 -0.612 . . . . 73.31 109.349 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.423 ' OD2' ' N ' ' A' ' 127' ' ' ASP . 6.9 p-10 -55.99 -21.57 21.92 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.46 1.1 . . . . 72.22 109.321 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.423 ' N ' ' OD2' ' A' ' 126' ' ' ASP . 1.0 OUTLIER -53.97 -52.89 59.28 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.455 1.097 . . . . 72.35 109.275 179.984 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.461 ' CB ' HG12 ' A' ' 82' ' ' VAL . . . -62.94 -26.77 68.98 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.438 1.086 . . . . 74.43 109.323 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.485 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 3.0 t -78.26 -0.56 3.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.51 1.131 . . . . 71.43 109.263 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -126.27 126.02 43.3 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.535 1.147 . . . . 70.03 109.282 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 87.29 49.65 3.89 Favored Glycine 0 CA--C 1.53 0.978 0 O-C-N 124.489 1.118 . . . . 70.04 111.002 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' SER . . . . . 0.403 ' O ' ' O ' ' A' ' 167' ' ' TYR . 0.3 OUTLIER -163.71 177.39 8.73 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.498 0.763 . . . . 72.25 109.988 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . 0.634 ' CB ' ' CZ3' ' A' ' 134' ' ' TRP . . . -104.42 -25.58 12.76 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.519 1.137 . . . . 71.21 109.268 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.634 ' CZ3' ' CB ' ' A' ' 133' ' ' ALA . 4.1 m-90 -160.68 153.67 21.39 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.548 1.155 . . . . 71.53 107.995 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' THR . . . . . 0.437 ' CG2' ' HA ' ' A' ' 129' ' ' VAL . 2.0 p -123.03 128.13 49.74 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.484 1.115 . . . . 73.34 110.338 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.464 HG13 ' CG1' ' A' ' 83' ' ' ILE . 23.9 mm -84.19 134.2 27.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.528 1.143 . . . . 74.41 109.296 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 20.0 mt -127.91 97.69 4.89 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.49 1.119 . . . . 75.44 109.307 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.502 ' CD2' ' O ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -62.33 99.3 0.13 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.465 1.103 . . . . 65.22 109.329 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.472 ' CD2' HG23 ' A' ' 185' ' ' THR . 0.2 OUTLIER -70.76 105.05 3.06 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.405 1.066 . . . . 74.22 109.311 -179.977 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' THR . . . . . 0.432 ' HB ' ' CB ' ' A' ' 143' ' ' PHE . 13.6 m -132.01 -177.58 4.51 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.498 1.124 . . . . 73.33 110.357 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -81.67 -44.44 17.15 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.511 1.132 . . . . 75.13 110.323 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -82.87 -16.8 46.19 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.536 1.147 . . . . 72.24 109.327 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.432 ' CB ' ' HB ' ' A' ' 140' ' ' THR . 16.2 t80 -90.06 -19.74 24.02 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.491 1.119 . . . . 75.04 110.978 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.473 ' C ' ' CD1' ' A' ' 144' ' ' LEU . 2.0 tm? -61.33 -67.87 0.37 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.537 1.148 . . . . 75.0 109.298 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.45 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 10.9 mmt85 -62.87 -13.29 32.25 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.5 1.125 . . . . 72.21 110.253 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -68.84 -53.98 18.36 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.497 1.123 . . . . 71.14 109.252 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.462 ' HB ' ' CE1' ' A' ' 151' ' ' PHE . 2.7 p -88.66 -50.57 6.17 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.508 1.13 . . . . 65.11 110.348 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.62 ' CH2' ' CB ' ' A' ' 186' ' ' PRO . 3.4 t-105 -44.02 -32.39 1.15 Allowed 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.496 1.122 . . . . 73.44 108.004 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' CYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 42.2 t -81.48 -45.48 15.93 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.535 1.147 . . . . 75.44 108.32 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' ASN . . . . . 0.601 ' O ' ' CD2' ' A' ' 154' ' ' TYR . 50.5 m-20 -62.99 -14.17 44.41 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.559 1.162 . . . . 73.24 109.304 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.561 ' CZ ' ' HG ' ' A' ' 157' ' ' LEU . 3.6 m-30 -80.16 -57.21 3.73 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.461 1.1 . . . . 74.45 110.934 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -47.8 -32.39 5.99 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.466 1.104 . . . . 70.53 110.253 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.446 ' HB3' ' CD1' ' A' ' 154' ' ' TYR . 0.4 OUTLIER -83.97 -37.08 22.71 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.456 1.097 . . . . 72.32 110.994 179.973 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.601 ' CD2' ' O ' ' A' ' 150' ' ' ASN . 1.0 OUTLIER -119.16 70.78 0.84 Allowed 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.44 1.088 . . . . 75.02 111.022 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 11.7 t -43.85 -26.5 0.27 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.544 1.152 . . . . 74.14 110.4 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' SER . . . . . 0.415 ' N ' ' C ' ' A' ' 154' ' ' TYR . 3.0 t -45.07 -44.42 10.27 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.507 1.129 . . . . 70.43 109.99 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.561 ' HG ' ' CZ ' ' A' ' 151' ' ' PHE . 2.2 tp -69.04 -38.62 79.26 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.55 1.156 . . . . 62.44 109.31 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 158' ' ' MET . . . . . 0.508 ' O ' ' CG2' ' A' ' 161' ' ' VAL . 0.0 OUTLIER -62.57 -16.6 57.03 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.455 1.097 . . . . 74.41 110.991 -179.978 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' ASN . . . . . 0.46 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 82.6 m-20 -93.54 -9.66 37.48 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.425 1.078 . . . . 62.1 109.357 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 160' ' ' SER . . . . . 0.464 ' OG ' ' CG2' ' A' ' 170' ' ' VAL . 1.2 p -82.49 -24.11 34.34 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.5 1.125 . . . . 71.43 109.965 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . 0.508 ' CG2' ' O ' ' A' ' 158' ' ' MET . 3.6 m -69.38 -15.7 19.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.497 1.123 . . . . 73.24 109.249 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 162' ' ' ASN . . . . . 0.45 ' CB ' ' OE1' ' A' ' 164' ' ' GLN . 4.6 m120 -65.87 -9.8 32.45 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 75.52 109.326 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.401 ' O ' ' O ' ' A' ' 164' ' ' GLN . 5.3 mmm180 67.87 53.88 0.65 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.471 1.107 . . . . 74.45 110.313 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . 0.679 ' H ' ' NE2' ' A' ' 164' ' ' GLN . 1.8 mp0 -51.26 -176.55 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.503 1.127 . . . . 72.11 110.371 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -134.76 19.69 3.54 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.424 1.078 . . . . 74.11 109.603 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.71 -155.94 0.09 Allowed 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.488 1.117 . . . . 64.4 109.274 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 167' ' ' TYR . . . . . 0.53 ' CD2' ' OD1' ' A' ' 168' ' ' ASN . 55.3 p90 -88.86 37.41 0.84 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.527 1.142 . . . . 75.3 110.944 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . 0.53 ' OD1' ' CD2' ' A' ' 167' ' ' TYR . 9.7 m120 -170.09 122.19 0.67 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.495 1.122 . . . . 73.31 109.333 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 169' ' ' SER . . . . . 0.412 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 2.9 m -114.84 173.84 6.27 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.508 1.13 . . . . 61.14 110.057 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.464 ' CG2' ' OG ' ' A' ' 160' ' ' SER . 51.1 t -128.53 119.94 51.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.516 1.135 . . . . 64.44 109.343 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 35.2 mm -134.18 93.44 19.62 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.485 1.116 . . . . 71.14 109.271 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . 0.492 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.07 107.93 2.6 Favored 'Trans proline' 0 C--N 1.361 1.209 0 O-C-N 124.468 1.773 . . . . 64.1 110.967 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 173' ' ' MET . . . . . 0.404 ' HA ' ' O ' ' A' ' 195' ' ' LEU . 5.0 ttt -80.66 160.09 25.13 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.534 1.146 . . . . 64.03 110.985 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 69.4 mtt180 -116.68 128.44 26.01 Favored Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.513 1.133 . . . . 73.23 110.292 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 152.25 40.63 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.566 1.824 . . . . 74.24 111.013 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . 0.555 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -93.93 -44.54 8.03 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.482 1.114 . . . . 74.41 109.34 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -72.78 -26.8 61.66 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.479 1.112 . . . . 74.22 109.361 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -107.12 103.45 48.06 Favored Pre-proline 0 C--N 1.325 -0.474 0 O-C-N 124.462 1.101 . . . . 74.23 109.311 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 121.33 6.52 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.468 1.772 . . . . 71.33 110.997 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . 0.451 HD13 ' CB ' ' A' ' 184' ' ' ARG . 0.8 OUTLIER -131.22 98.68 18.39 Favored Pre-proline 0 C--N 1.325 -0.481 0 O-C-N 124.532 1.145 . . . . 71.25 109.35 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.01 163.41 35.36 Favored 'Trans proline' 0 C--N 1.359 1.129 0 O-C-N 124.46 1.769 . . . . 63.24 110.983 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.47 -33.95 66.43 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.528 1.142 . . . . 74.14 110.278 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -50.0 -23.23 1.91 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.529 1.143 . . . . 73.5 110.306 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 184' ' ' ARG . . . . . 0.458 ' HD3' ' N ' ' A' ' 184' ' ' ARG . 1.9 mpt_? -105.22 -28.75 10.77 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.526 1.141 . . . . 74.24 110.309 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 185' ' ' THR . . . . . 0.472 HG23 ' CD2' ' A' ' 139' ' ' LEU . 17.7 m -71.2 143.84 88.92 Favored Pre-proline 0 C--N 1.325 -0.481 0 O-C-N 124.522 1.139 . . . . 73.15 110.44 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 186' ' ' PRO . . . . . 0.62 ' CB ' ' CH2' ' A' ' 148' ' ' TRP . 18.2 Cg_endo -75.03 155.88 42.83 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.446 1.761 . . . . 62.54 110.994 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 187' ' ' PHE . . . . . 0.512 ' O ' ' CG2' ' A' ' 191' ' ' THR . 36.3 p90 -69.79 -6.62 33.49 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.509 1.131 . . . . 71.53 111.038 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -94.61 -53.09 4.02 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.592 1.182 . . . . 72.25 109.263 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.436 ' CD2' ' HG3' ' A' ' 172' ' ' PRO . 40.3 mt -68.49 -42.29 78.84 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.496 1.123 . . . . 70.11 109.278 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -64.38 -10.12 22.56 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.498 1.124 . . . . 73.34 110.321 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 191' ' ' THR . . . . . 0.512 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 25.5 p -112.64 12.49 19.78 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.435 1.084 . . . . 73.34 110.44 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.441 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 3.1 mt -115.92 154.11 17.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.491 1.12 . . . . 71.12 109.309 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 193' ' ' ASN . . . . . 0.412 ' N ' HG22 ' A' ' 192' ' ' ILE . 2.4 m-20 -65.39 76.28 0.06 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.508 1.13 . . . . 72.44 109.303 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . 0.492 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -70.78 161.91 30.08 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.533 1.145 . . . . 72.15 109.336 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 195' ' ' LEU . . . . . 0.404 ' O ' ' HA ' ' A' ' 173' ' ' MET . 0.2 OUTLIER -96.57 128.91 43.95 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.561 1.163 . . . . 72.11 109.271 -179.981 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -118.28 136.71 53.53 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.449 1.093 . . . . 74.01 110.313 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . 0.507 ' HA ' ' CD1' ' A' ' 202' ' ' PHE . 0.7 OUTLIER -103.22 -37.34 7.73 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.434 1.084 . . . . 75.42 110.308 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . 0.471 ' HG3' ' CG ' ' A' ' 176' ' ' LEU . 3.4 mt-10 -80.19 -15.2 57.56 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 124.48 1.112 . . . . 73.35 110.313 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 7.5 t -68.21 159.57 30.9 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.527 1.142 . . . . 71.43 109.941 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -66.67 -48.37 69.55 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.477 1.11 . . . . 74.02 110.289 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -89.62 29.49 6.23 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.547 1.155 . . . . 75.04 110.994 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 202' ' ' PHE . . . . . 0.615 ' CD1' ' C ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -52.33 -47.36 93.01 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.487 0.757 . . . . 73.21 111.032 179.968 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 203' ' ' PRO . . . . . 0.585 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.2 Cg_endo -75.06 -27.48 9.88 Favored 'Trans proline' 0 C--N 1.36 1.143 0 O-C-N 124.432 1.754 . . . . 74.42 110.955 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -59.26 -53.9 52.99 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.49 1.118 . . . . 75.41 110.412 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 205' ' ' GLN . . . . . 0.407 ' O ' ' C ' ' A' ' 206' ' ' VAL . 13.3 mt-30 -56.02 -64.03 0.99 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.512 1.132 . . . . 70.5 110.274 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 206' ' ' VAL . . . . . 0.585 ' CG1' ' HA ' ' A' ' 203' ' ' PRO . 3.0 p -39.75 -40.43 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.442 1.089 . . . . 74.2 109.255 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.83 -63.96 0.96 Allowed 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.521 1.138 . . . . 74.14 110.227 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -54.68 -64.09 0.95 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.498 1.124 . . . . 73.33 110.305 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 209' ' ' ILE . . . . . 0.498 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 3.7 mt -42.44 -60.64 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.506 1.128 . . . . 71.34 109.336 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 210' ' ' PHE . . . . . 0.582 ' CE2' ' HA ' ' A' ' 206' ' ' VAL . 0.4 OUTLIER -101.05 70.09 1.33 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.524 1.14 . . . . 61.41 110.989 179.981 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.71 143.53 41.06 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.492 1.12 . . . . 74.24 110.331 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 215' ' ' TYR . 19.1 tt0 -49.03 -55.15 12.89 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.513 1.133 . . . . 74.24 110.322 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -46.38 -25.19 0.6 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.411 1.069 . . . . 71.41 109.966 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 8.6 t -94.81 -32.92 4.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.484 1.115 . . . . 74.02 109.341 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 215' ' ' TYR . . . . . 0.557 ' CE1' ' HG3' ' A' ' 80' ' ' LYS . 29.9 t80 -61.25 -19.65 61.94 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.552 1.158 . . . . 73.44 110.975 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 3.7 mmmt -62.5 -66.13 0.59 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.523 1.139 . . . . 64.01 109.33 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 217' ' ' THR . . . . . 0.413 HG22 ' CD1' ' A' ' 221' ' ' ILE . 1.9 m -48.93 -64.31 0.84 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.501 1.126 . . . . 70.24 110.379 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -43.02 -63.64 0.77 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.478 1.111 . . . . 74.14 110.279 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 219' ' ' GLN . . . . . 0.446 ' O ' ' NE2' ' A' ' 219' ' ' GLN . 25.2 tp60 -50.41 -29.92 11.27 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.467 1.104 . . . . 71.52 110.29 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -79.27 -29.77 42.71 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.531 1.144 . . . . 72.42 110.417 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 221' ' ' ILE . . . . . 0.413 ' CD1' HG22 ' A' ' 217' ' ' THR . 14.1 mt -76.83 -27.66 16.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.593 1.183 . . . . 75.23 109.301 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 222' ' ' TRP . . . . . 0.587 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 23.0 t90 -77.94 -55.3 5.42 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.564 1.165 . . . . 73.25 108.002 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -20.91 22.86 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.518 1.136 . . . . 71.4 109.34 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 81.5 mt-10 . . . . . 0 C--N 1.325 -0.463 0 O-C-N 124.559 1.162 . . . . 70.24 110.352 179.988 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 2.8 p . . . . . 0 N--CA 1.453 -0.287 0 N-CA-C 109.321 -0.622 . . . . 74.53 109.321 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -89.19 31.09 0.9 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.563 1.164 . . . . 73.2 111.032 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 24.6 tp -39.73 147.12 0.09 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.488 1.117 . . . . 64.15 109.28 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.44 ' CD ' ' O ' ' A' ' 107' ' ' LYS . 0.5 OUTLIER -89.82 -62.74 1.4 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.555 1.16 . . . . 75.11 109.321 179.945 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.575 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.9 OUTLIER -165.5 129.94 2.37 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.568 1.168 . . . . 64.41 110.992 179.953 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.469 ' CG1' HG23 ' A' ' 135' ' ' THR . 11.0 p -85.37 166.9 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.48 1.112 . . . . 75.05 109.298 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.531 ' CD1' ' CZ ' ' A' ' 81' ' ' PHE . 1.7 mp -128.26 92.76 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.482 1.114 . . . . 74.41 109.311 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.577 ' CD2' ' CZ ' ' A' ' 112' ' ' PHE . 3.3 mt -70.53 98.93 1.54 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.556 1.16 . . . . 72.34 109.216 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.557 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -120.32 174.4 6.54 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.448 1.093 . . . . 73.21 109.639 179.895 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -111.84 164.22 13.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.473 1.108 . . . . 73.22 109.263 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.442 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 14.4 tt0 -68.27 -8.78 42.36 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.488 1.118 . . . . 65.04 110.267 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -80.37 -38.45 30.39 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.516 1.135 . . . . 72.51 109.344 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.416 ' OD2' ' ND2' ' A' ' 178' ' ' ASN . 0.0 OUTLIER -137.7 44.23 2.22 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.482 1.114 . . . . 75.51 109.349 -179.961 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.557 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -77.62 -30.09 52.15 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.465 1.103 . . . . 75.22 110.403 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.78 -25.53 61.2 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.555 1.159 . . . . 64.32 109.291 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.484 ' CG ' ' ND2' ' A' ' 177' ' ' ASN . 0.2 OUTLIER -76.62 -58.4 3.31 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.476 1.11 . . . . 73.04 110.277 -179.976 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.479 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -54.88 -19.56 6.87 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.479 1.112 . . . . 74.13 109.353 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.437 ' CD2' ' C ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -89.8 -50.07 6.26 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.501 1.125 . . . . 74.13 109.234 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.419 ' N ' HD12 ' A' ' 94' ' ' LEU . 38.4 tpt85 -46.8 -31.48 3.05 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.53 1.144 . . . . 75.13 110.326 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.465 ' O ' ' N ' ' A' ' 99' ' ' LEU . 10.9 p -83.16 -55.85 6.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.525 1.141 . . . . 75.31 109.284 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.463 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -47.61 -24.08 0.81 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.497 1.123 . . . . 72.2 110.315 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.403 ' O ' ' HG3' ' A' ' 101' ' ' GLN . 0.9 OUTLIER -75.48 -38.56 59.47 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.464 1.102 . . . . 63.14 109.345 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.537 ' O ' ' CB ' ' A' ' 103' ' ' ASP . 0.0 OUTLIER -84.63 -19.3 33.16 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.418 1.074 . . . . 74.51 109.353 179.951 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.409 ' O ' ' HB ' ' A' ' 106' ' ' ILE . 90.3 mt -79.76 -20.22 46.84 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.465 1.103 . . . . 75.01 109.243 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . 0.536 ' O ' ' HD3' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -88.98 -11.93 42.92 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.523 1.14 . . . . 73.15 110.324 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . 0.467 ' O ' ' C ' ' A' ' 103' ' ' ASP . 30.6 t70 -116.2 -57.15 2.24 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.426 1.078 . . . . 74.14 109.304 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.537 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 51.5 t0 -34.78 -64.78 0.24 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.528 1.142 . . . . 72.23 109.321 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.581 ' CE1' HG13 ' A' ' 206' ' ' VAL . 4.4 m-85 -104.08 -32.31 9.25 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.508 1.13 . . . . 73.34 110.959 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.482 ' O ' ' N ' ' A' ' 107' ' ' LYS . . . 109.51 27.08 4.85 Favored Glycine 0 CA--C 1.529 0.939 0 O-C-N 124.581 1.175 . . . . 61.35 110.974 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.561 HG21 ' CE1' ' A' ' 81' ' ' PHE . 28.4 mm -63.98 75.63 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.408 0.711 . . . . 74.44 109.358 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.536 ' HD3' ' O ' ' A' ' 101' ' ' GLN . 0.3 OUTLIER -129.07 157.14 76.84 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.493 1.121 . . . . 74.32 109.317 -179.927 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.495 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.4 Cg_endo -75.04 132.0 26.11 Favored 'Cis proline' 0 C--N 1.36 1.166 0 C-N-CA 120.953 -2.52 . . . . 72.15 110.983 0.02 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . 0.422 ' N ' ' HA ' ' A' ' 107' ' ' LYS . . . -105.17 116.67 5.33 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.54 1.15 . . . . 75.32 111.009 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -129.69 148.26 33.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.503 0.766 . . . . 75.35 109.332 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . 0.405 HD11 ' NE2' ' A' ' 85' ' ' HIS . 41.8 pt -98.73 -175.76 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.515 1.134 . . . . 63.24 109.328 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.577 ' CZ ' ' CD2' ' A' ' 84' ' ' LEU . 0.6 OUTLIER -82.14 -18.55 42.49 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.526 1.141 . . . . 74.04 110.93 -179.986 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -94.49 -3.08 50.62 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.559 1.162 . . . . 73.05 109.352 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -104.65 -26.63 12.24 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.501 1.126 . . . . 74.32 110.317 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.454 ' CE ' HG23 ' A' ' 82' ' ' VAL . 4.8 ttm -48.28 141.14 9.09 Favored Pre-proline 0 C--N 1.326 -0.444 0 O-C-N 124.511 1.132 . . . . 74.01 110.984 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo . . . . . 0 C--N 1.361 1.191 0 O-C-N 124.562 1.822 . . . . 72.43 111.071 179.996 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.514 ' CD2' ' ND2' ' A' ' 150' ' ' ASN . 1.6 mm? . . . . . 0 N--CA 1.454 -0.257 0 N-CA-C 109.318 -0.623 . . . . 75.34 109.318 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.478 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 7.6 t70 -54.96 -19.74 7.43 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.537 1.148 . . . . 75.45 109.271 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -59.25 -70.32 0.16 Allowed 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.517 1.136 . . . . 75.15 109.308 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.454 ' HB3' ' CD1' ' A' ' 84' ' ' LEU . . . -74.66 -17.48 60.68 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.534 1.147 . . . . 75.44 109.304 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.482 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 86.9 t -93.07 30.8 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.456 1.098 . . . . 74.31 109.302 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.478 ' CB ' ' O ' ' A' ' 126' ' ' ASP . 23.5 t30 -147.47 133.37 19.1 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.445 1.091 . . . . 73.01 109.244 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 71.82 55.51 7.27 Favored Glycine 0 CA--C 1.53 1.005 0 O-C-N 124.474 1.109 . . . . 64.12 111.018 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.46 173.8 12.68 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.444 0.732 . . . . 70.44 109.992 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . 0.611 ' CB ' ' CZ3' ' A' ' 134' ' ' TRP . . . -101.73 -30.76 11.13 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.487 1.117 . . . . 75.44 109.287 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.611 ' CZ3' ' CB ' ' A' ' 133' ' ' ALA . 2.5 m-90 -158.86 177.15 11.47 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.953 -1.129 . . . . 75.15 107.953 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' THR . . . . . 0.469 HG23 ' CG1' ' A' ' 82' ' ' VAL . 25.3 p -151.45 124.02 8.43 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.479 1.112 . . . . 54.42 110.435 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.465 ' O ' ' CD2' ' A' ' 137' ' ' LEU . 1.1 mp -84.09 140.66 15.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 O-C-N 124.533 1.146 . . . . 64.41 109.304 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.465 ' CD2' ' O ' ' A' ' 136' ' ' ILE . 9.0 mt -131.17 100.66 5.28 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.577 1.173 . . . . 72.03 109.26 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.455 HD23 ' CB ' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -62.67 107.21 0.91 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.533 1.145 . . . . 74.23 109.31 179.985 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.432 HD21 ' CB ' ' A' ' 172' ' ' PRO . 0.5 OUTLIER -68.91 108.63 3.56 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.495 1.122 . . . . 73.33 109.241 -179.977 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' THR . . . . . 0.482 ' CG2' ' OD1' ' A' ' 178' ' ' ASN . 2.8 m -123.87 162.06 24.06 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.431 1.082 . . . . 74.42 110.395 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -62.37 -37.81 87.13 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.534 1.146 . . . . 75.14 110.248 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . 0.445 ' ND2' ' N ' ' A' ' 143' ' ' PHE . 2.3 p-10 -89.67 -52.9 4.77 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.519 1.137 . . . . 75.4 109.279 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.469 ' CB ' ' HB ' ' A' ' 140' ' ' THR . 49.7 t80 -49.13 -24.5 1.68 Allowed 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.534 1.147 . . . . 74.43 111.02 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.413 ' O ' ' N ' ' A' ' 148' ' ' TRP . 2.2 tm? -58.16 -68.37 0.26 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.514 1.134 . . . . 74.55 109.26 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.43 ' CD ' ' C ' ' A' ' 145' ' ' ARG . 0.6 OUTLIER -57.64 -16.67 11.24 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.46 1.1 . . . . 74.35 110.298 -179.984 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -75.17 -38.12 60.98 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.485 1.115 . . . . 74.12 109.324 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.541 ' O ' ' CG ' ' A' ' 151' ' ' PHE . 2.3 p -101.14 -7.61 23.0 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.437 1.086 . . . . 72.31 110.449 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.422 ' HA ' ' CE3' ' A' ' 148' ' ' TRP . 1.0 OUTLIER -94.68 -25.14 16.85 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.959 -1.126 . . . . 74.15 107.959 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 42.7 t -88.57 -45.46 9.87 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.502 1.126 . . . . 65.23 108.253 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' ASN . . . . . 0.514 ' ND2' ' CD2' ' A' ' 125' ' ' LEU . 0.1 OUTLIER -61.83 -54.2 45.46 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.441 1.088 . . . . 62.11 109.316 -179.954 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.541 ' CG ' ' O ' ' A' ' 147' ' ' THR . 4.9 m-30 -53.41 -52.88 57.95 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.507 1.129 . . . . 71.3 110.95 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -39.39 -48.69 1.95 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.518 1.137 . . . . 72.33 110.334 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -81.33 -28.23 34.62 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.372 1.045 . . . . 70.03 111.03 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.431 ' N ' ' O ' ' A' ' 151' ' ' PHE . 4.5 m-85 -113.6 86.57 2.42 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 124.464 1.103 . . . . 75.31 111.035 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' THR . . . . . 0.413 ' O ' ' N ' ' A' ' 158' ' ' MET . 1.1 t -61.25 -14.14 23.85 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.481 1.113 . . . . 72.05 110.36 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 12.5 t -46.64 -34.56 5.15 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.464 1.103 . . . . 72.04 109.993 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.44 -29.32 20.27 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.403 1.064 . . . . 73.43 109.267 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 158' ' ' MET . . . . . 0.46 ' HA ' ' CE ' ' A' ' 158' ' ' MET . 23.1 mmt -62.07 -24.25 66.99 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.491 1.12 . . . . 75.32 110.984 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' ASN . . . . . 0.45 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 24.8 p30 -92.92 -19.37 21.71 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.466 1.104 . . . . 64.23 109.289 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 160' ' ' SER . . . . . 0.43 ' N ' ' OD1' ' A' ' 159' ' ' ASN . 1.4 m -81.29 -34.31 32.07 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.522 1.139 . . . . 72.31 110.017 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . 0.504 ' O ' ' CD1' ' A' ' 192' ' ' ILE . 7.6 m -60.65 -17.98 16.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.584 1.177 . . . . 75.34 109.346 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 162' ' ' ASN . . . . . 0.429 ' CB ' ' HG3' ' A' ' 164' ' ' GLN . 49.3 m-20 -66.94 -10.37 48.39 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.53 1.144 . . . . 75.43 109.299 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 21.6 mtp180 65.06 18.67 11.58 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.442 1.089 . . . . 75.15 110.285 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 159' ' ' ASN . 28.4 mt-30 -45.94 171.82 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.511 1.132 . . . . 74.44 110.291 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 15.7 p80 -86.14 59.24 5.52 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.467 1.104 . . . . 73.53 109.579 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . 0.551 ' HG3' ' CD1' ' A' ' 167' ' ' TYR . 0.8 OUTLIER -107.96 144.06 35.77 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.493 1.121 . . . . 71.44 109.284 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 167' ' ' TYR . . . . . 0.593 ' CE2' ' OD1' ' A' ' 168' ' ' ASN . 16.2 p90 -38.42 -47.59 1.27 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.462 1.101 . . . . 70.52 110.932 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . 0.593 ' OD1' ' CE2' ' A' ' 167' ' ' TYR . 2.0 p-10 -92.67 132.09 37.2 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.533 1.146 . . . . 75.51 109.235 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 169' ' ' SER . . . . . 0.485 ' HB3' ' CD1' ' A' ' 134' ' ' TRP . 13.9 t -124.04 145.13 49.43 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.45 1.093 . . . . 71.24 110.003 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.431 ' CG1' HD11 ' A' ' 137' ' ' LEU . 4.8 t -106.21 123.72 61.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.518 1.136 . . . . 73.41 109.292 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.6 mp -131.37 109.61 14.95 Favored Pre-proline 0 C--N 1.325 -0.474 0 O-C-N 124.452 1.095 . . . . 72.13 109.309 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . 0.511 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.99 110.68 3.16 Favored 'Trans proline' 0 C--N 1.36 1.16 0 O-C-N 124.49 1.784 . . . . 75.41 111.035 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 4.0 ttt -94.83 156.66 16.27 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.455 1.097 . . . . 74.42 110.973 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 17.0 mmt85 -111.9 118.85 45.72 Favored Pre-proline 0 C--N 1.325 -0.458 0 O-C-N 124.528 1.142 . . . . 71.54 110.256 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.95 152.03 40.5 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.502 1.791 . . . . 73.32 110.997 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . 0.609 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.1 OUTLIER -85.26 -44.13 13.14 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.536 1.147 . . . . 71.15 109.353 179.946 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . 0.484 ' ND2' ' CG ' ' A' ' 92' ' ' GLU . 4.9 p30 -71.14 -28.05 64.0 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.524 1.14 . . . . 64.32 109.259 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 178' ' ' ASN . . . . . 0.482 ' OD1' ' CG2' ' A' ' 140' ' ' THR . 1.4 m-80 -110.79 98.58 38.51 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.48 1.113 . . . . 72.22 109.27 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.97 116.36 4.57 Favored 'Trans proline' 0 C--N 1.36 1.133 0 O-C-N 124.556 1.819 . . . . 74.21 111.012 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . 0.466 HD23 ' CB ' ' A' ' 184' ' ' ARG . 0.5 OUTLIER -127.57 96.45 32.92 Favored Pre-proline 0 C--N 1.325 -0.48 0 O-C-N 124.5 1.125 . . . . 75.2 109.312 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.97 171.67 17.87 Favored 'Trans proline' 0 C--N 1.36 1.162 0 O-C-N 124.509 1.794 . . . . 75.21 111.031 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 -60.04 -23.69 63.94 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.48 1.113 . . . . 71.23 110.346 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -68.85 -15.49 63.51 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.443 1.089 . . . . 75.05 110.31 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 184' ' ' ARG . . . . . 0.466 ' CB ' HD23 ' A' ' 180' ' ' LEU . 35.0 mmt180 -111.1 -28.45 8.29 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.462 1.101 . . . . 73.01 110.36 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 185' ' ' THR . . . . . . . . . . . . . 54.1 m -72.86 143.72 84.68 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.407 1.067 . . . . 74.31 110.413 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 186' ' ' PRO . . . . . 0.44 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -75.01 148.39 35.18 Favored 'Trans proline' 0 C--N 1.36 1.17 0 O-C-N 124.503 1.791 . . . . 72.33 110.977 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 187' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -60.85 -12.4 10.83 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.453 1.096 . . . . 74.3 111.05 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -88.56 -53.93 4.41 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.474 1.109 . . . . 73.33 109.391 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.478 ' HB3' ' CB ' ' A' ' 172' ' ' PRO . 37.1 mt -74.4 -14.91 60.92 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.51 1.131 . . . . 64.43 109.321 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -85.66 -11.4 53.91 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.56 1.163 . . . . 75.33 110.31 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 191' ' ' THR . . . . . . . . . . . . . 21.9 p -113.87 1.47 14.77 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.556 1.16 . . . . 64.11 110.385 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.504 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 3.1 mt -99.37 163.74 2.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.465 1.103 . . . . 73.33 109.299 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 193' ' ' ASN . . . . . 0.49 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 13.5 t-20 -66.65 73.41 0.09 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.539 1.149 . . . . 73.34 109.306 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . 0.511 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -66.69 143.66 56.83 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.592 1.182 . . . . 63.41 109.293 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 195' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.66 129.98 34.77 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.529 1.143 . . . . 72.24 109.266 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -104.88 117.4 33.95 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.531 1.145 . . . . 71.2 110.336 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -101.82 -33.23 9.89 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.533 1.146 . . . . 72.34 110.285 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . 0.469 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -90.0 23.04 2.93 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.527 1.142 . . . . 74.04 110.303 -179.979 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -128.57 147.34 50.7 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.492 1.12 . . . . 75.35 110.009 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.81 -19.5 65.88 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.459 1.099 . . . . 71.43 110.264 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -89.13 21.27 28.71 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 124.448 1.093 . . . . 64.5 110.988 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 202' ' ' PHE . . . . . 0.686 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 5.6 t80 -65.21 -39.32 34.75 Favored Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.509 0.77 . . . . 75.44 110.977 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 203' ' ' PRO . . . . . 0.686 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.05 -38.71 1.45 Allowed 'Trans proline' 0 C--N 1.359 1.116 0 O-C-N 124.505 1.792 . . . . 72.53 110.956 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -50.9 -59.9 3.65 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.483 1.114 . . . . 75.2 110.387 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -59.02 -47.55 84.8 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.484 1.115 . . . . 73.13 110.313 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 206' ' ' VAL . . . . . 0.581 HG13 ' CE1' ' A' ' 104' ' ' PHE . 82.6 t -57.27 -29.69 33.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.463 1.102 . . . . 71.41 109.257 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.08 -35.75 49.02 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.521 1.138 . . . . 74.42 110.365 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 64.8 mtt-85 -81.26 -68.23 0.71 Allowed 'General case' 0 C--N 1.327 -0.412 0 O-C-N 124.459 1.1 . . . . 73.51 110.299 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 209' ' ' ILE . . . . . 0.63 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 73.3 mt -41.47 -43.32 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.527 1.142 . . . . 64.44 109.313 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 210' ' ' PHE . . . . . 0.63 ' CE1' ' CG2' ' A' ' 209' ' ' ILE . 1.5 m-85 -112.02 66.89 0.64 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.538 1.148 . . . . 73.33 110.962 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -110.65 147.39 34.39 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.537 1.148 . . . . 75.22 110.286 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . 0.449 ' O ' ' N ' ' A' ' 215' ' ' TYR . 27.9 tt0 -49.14 -55.52 12.07 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.537 1.148 . . . . 72.42 110.274 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -48.38 -23.93 1.08 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.437 1.086 . . . . 65.41 109.976 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 13.4 t -95.9 -29.31 3.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.449 1.093 . . . . 74.52 109.28 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 215' ' ' TYR . . . . . 0.449 ' N ' ' O ' ' A' ' 212' ' ' GLU . 17.2 t80 -63.78 -33.89 76.67 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.619 1.199 . . . . 74.13 111.059 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 51.3 mmtt -57.33 -66.32 0.48 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.548 1.155 . . . . 72.43 109.253 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 217' ' ' THR . . . . . 0.517 ' CG2' ' CD1' ' A' ' 221' ' ' ILE . 17.3 m -45.3 -66.56 0.38 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.497 1.123 . . . . 64.01 110.378 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 218' ' ' GLN . . . . . 0.521 ' NE2' ' CD1' ' A' ' 221' ' ' ILE . 2.1 mp0 -42.01 -45.7 3.94 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.473 1.108 . . . . 74.33 110.32 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 219' ' ' GLN . . . . . 0.444 ' O ' ' NE2' ' A' ' 219' ' ' GLN . 18.9 tp60 -62.85 -39.41 94.31 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.504 1.127 . . . . 75.42 110.315 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 220' ' ' THR . . . . . 0.46 ' O ' ' CG ' ' A' ' 224' ' ' GLU . 1.0 OUTLIER -77.66 -17.71 57.44 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.57 1.169 . . . . 74.22 110.418 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 221' ' ' ILE . . . . . 0.521 ' CD1' ' NE2' ' A' ' 218' ' ' GLN . 35.2 mt -83.64 -40.28 15.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.477 1.111 . . . . 64.41 109.301 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 222' ' ' TRP . . . . . . . . . . . . . 27.7 t90 -64.11 -54.98 25.35 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.546 1.153 . . . . 75.12 108.042 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -20.23 52.64 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.485 1.116 . . . . 73.04 109.318 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . 0.46 ' CG ' ' O ' ' A' ' 220' ' ' THR . 79.6 mt-10 . . . . . 0 C--N 1.325 -0.474 0 O-C-N 124.543 1.152 . . . . 74.31 110.302 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.516 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 6.4 p . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.312 -0.625 . . . . 73.55 109.312 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.413 ' O ' ' C ' ' A' ' 79' ' ' LEU . 26.8 m-85 -87.95 23.5 2.04 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.531 1.144 . . . . 74.25 111.034 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.413 ' C ' ' O ' ' A' ' 78' ' ' PHE . 12.5 tp -39.63 155.26 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.52 1.137 . . . . 73.23 109.278 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.739 ' NZ ' ' H ' ' A' ' 107' ' ' LYS . 27.4 ttpt -100.49 -60.61 1.49 Allowed 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.497 1.123 . . . . 75.12 109.312 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.706 ' CZ ' ' CD1' ' A' ' 83' ' ' ILE . 0.2 OUTLIER -156.99 132.83 9.48 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.487 1.117 . . . . 71.13 111.038 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.471 HG23 ' CE ' ' A' ' 115' ' ' MET . 7.2 p -96.8 168.47 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.528 1.142 . . . . 74.04 109.368 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.706 ' CD1' ' CZ ' ' A' ' 81' ' ' PHE . 4.2 mp -130.67 101.32 5.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.529 1.143 . . . . 64.14 109.326 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.456 ' CD1' ' HB2' ' A' ' 128' ' ' ALA . 3.7 mp -75.73 124.28 27.01 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.504 1.127 . . . . 75.25 109.317 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.562 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -146.27 174.4 11.37 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.455 1.097 . . . . 72.3 109.614 -179.99 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.44 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -115.82 164.3 14.59 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.508 1.13 . . . . 71.43 109.338 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -57.45 -17.28 12.41 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.532 1.145 . . . . 72.13 110.255 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -78.56 -45.56 21.51 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.536 1.148 . . . . 74.41 109.31 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.449 ' OD2' ' N ' ' A' ' 89' ' ' ASP . 0.9 OUTLIER -121.63 44.14 2.64 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.452 1.095 . . . . 73.42 109.269 -179.973 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.562 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -77.63 -48.24 17.32 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.493 1.12 . . . . 73.42 110.371 -179.958 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -67.84 -19.45 65.05 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.471 1.107 . . . . 63.41 109.332 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.03 -56.93 5.67 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.458 1.099 . . . . 72.43 110.298 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.487 ' CB ' ' CG2' ' A' ' 83' ' ' ILE . . . -68.4 -22.77 64.61 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.527 1.142 . . . . 72.14 109.268 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.5 ' O ' ' CD2' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -82.68 -34.06 27.51 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.552 1.157 . . . . 71.44 109.378 179.927 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -67.3 -34.56 77.63 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.466 1.104 . . . . 73.24 110.274 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.472 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 8.5 p -81.44 -55.29 8.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.554 1.159 . . . . 75.43 109.267 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.472 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -49.5 -20.95 0.82 Allowed 'General case' 0 C--N 1.326 -0.419 0 O-C-N 124.476 1.11 . . . . 74.14 110.35 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.493 ' O ' ' CG ' ' A' ' 101' ' ' GLN . 0.8 OUTLIER -78.94 -36.08 42.24 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.481 1.113 . . . . 74.3 109.287 -179.93 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.551 ' O ' ' CB ' ' A' ' 103' ' ' ASP . 0.0 OUTLIER -85.82 -20.0 29.82 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.52 1.137 . . . . 75.12 109.326 179.965 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.424 ' O ' ' N ' ' A' ' 106' ' ' ILE . 56.7 mt -78.98 -21.99 46.26 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.509 1.131 . . . . 72.24 109.323 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . 0.493 ' CG ' ' O ' ' A' ' 98' ' ' ASN . 0.2 OUTLIER -82.58 -15.15 53.3 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.497 1.123 . . . . 75.32 110.302 -179.99 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . 0.494 ' O ' ' C ' ' A' ' 103' ' ' ASP . 13.3 t70 -116.09 -58.01 2.15 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.548 1.155 . . . . 62.35 109.284 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.551 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 28.1 t0 -32.31 -66.81 0.12 Allowed 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.478 1.111 . . . . 63.41 109.265 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.555 ' CE1' HG11 ' A' ' 206' ' ' VAL . 5.2 m-85 -102.12 -29.66 11.61 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.448 1.093 . . . . 72.03 110.98 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 107' ' ' LYS . . . 109.59 16.67 10.64 Favored Glycine 0 CA--C 1.531 1.054 0 O-C-N 124.526 1.141 . . . . 74.43 110.982 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.573 HG22 ' CE1' ' A' ' 81' ' ' PHE . 36.8 mm -54.45 85.78 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.488 0.757 . . . . 64.44 109.259 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.739 ' H ' ' NZ ' ' A' ' 80' ' ' LYS . 4.5 mtmp? -138.57 154.91 73.72 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.48 1.113 . . . . 71.1 109.292 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.514 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.5 Cg_endo -74.99 128.87 17.23 Favored 'Cis proline' 0 C--N 1.36 1.155 0 C-N-CA 121.041 -2.483 . . . . 73.12 111.034 -0.053 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . 0.486 ' N ' ' HA ' ' A' ' 107' ' ' LYS . . . -105.93 122.91 7.29 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.597 1.186 . . . . 63.12 111.023 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 8.0 tt -144.74 157.38 14.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 O-C-N 124.469 0.746 . . . . 75.03 109.282 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . 0.446 ' CD1' ' NE2' ' A' ' 85' ' ' HIS . 28.7 pt -93.66 -178.54 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.533 1.145 . . . . 73.25 109.373 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.691 ' CE1' ' CB ' ' A' ' 128' ' ' ALA . 0.9 OUTLIER -82.03 -22.76 36.28 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.458 1.099 . . . . 71.4 110.993 179.988 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -88.07 -3.36 58.9 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.499 1.124 . . . . 55.14 109.311 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -107.45 -26.03 11.14 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.53 1.144 . . . . 73.14 110.335 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.471 ' CE ' HG23 ' A' ' 82' ' ' VAL . 3.8 ttm -45.64 138.54 5.22 Favored Pre-proline 0 C--N 1.325 -0.457 0 O-C-N 124.496 1.123 . . . . 73.32 111.046 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo . . . . . 0 C--N 1.359 1.116 0 O-C-N 124.515 1.797 . . . . 74.11 111.046 -179.981 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.454 -0.271 0 N-CA-C 109.298 -0.631 . . . . 74.33 109.298 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -42.67 -61.47 1.23 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.515 1.135 . . . . 73.23 109.32 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.443 ' O ' ' N ' ' A' ' 130' ' ' ASN . 6.5 m-20 -45.89 -63.23 1.02 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.5 1.125 . . . . 75.04 109.246 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.691 ' CB ' ' CE1' ' A' ' 112' ' ' PHE . . . -50.86 -26.79 6.24 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.498 1.124 . . . . 63.11 109.299 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.457 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 99.1 t -94.08 30.87 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.525 1.141 . . . . 74.53 109.253 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.443 ' N ' ' O ' ' A' ' 127' ' ' ASP . 11.2 t-20 -152.55 145.28 24.3 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.547 1.154 . . . . 73.21 109.306 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 64.99 38.51 95.56 Favored Glycine 0 CA--C 1.53 0.997 0 O-C-N 124.423 1.077 . . . . 64.5 111.05 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 50.7 m -151.36 178.79 8.92 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.549 0.793 . . . . 75.4 110.02 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . 0.565 ' HB1' ' CE3' ' A' ' 134' ' ' TRP . . . -112.45 -42.09 3.74 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.573 1.171 . . . . 72.01 109.291 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.575 ' CZ2' ' HA ' ' A' ' 210' ' ' PHE . 14.6 m-90 -141.14 160.76 39.4 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.543 1.152 . . . . 65.22 107.933 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' THR . . . . . 0.448 HG21 ' CG1' ' A' ' 82' ' ' VAL . 1.7 p -145.28 125.54 13.84 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.456 1.098 . . . . 74.24 110.317 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.468 ' CG2' HG21 ' A' ' 83' ' ' ILE . 0.8 OUTLIER -84.42 134.89 25.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.488 1.117 . . . . 74.5 109.28 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -117.92 96.81 5.52 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.502 1.127 . . . . 73.44 109.334 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.6 ' O ' ' CD1' ' A' ' 143' ' ' PHE . 0.2 OUTLIER -62.64 104.84 0.57 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.498 1.124 . . . . 74.13 109.274 179.999 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 18.9 mt -78.22 111.56 14.29 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.54 1.15 . . . . 72.33 109.33 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' THR . . . . . 0.484 ' O ' ' CB ' ' A' ' 144' ' ' LEU . 9.6 m -139.67 159.46 42.11 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.505 1.128 . . . . 73.04 110.444 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -56.08 -36.51 68.19 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.47 1.106 . . . . 65.1 110.264 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -88.4 -52.04 5.41 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.501 1.126 . . . . 71.55 109.294 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.6 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 10.9 t80 -57.46 -19.8 26.42 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.521 1.138 . . . . 75.14 110.983 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.582 ' CD1' ' CZ ' ' A' ' 145' ' ' ARG . 3.0 tm? -84.93 -52.64 5.86 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.582 1.176 . . . . 72.14 109.333 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.582 ' CZ ' ' CD1' ' A' ' 144' ' ' LEU . 0.0 OUTLIER -55.85 -27.09 49.96 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.436 1.085 . . . . 75.03 110.32 179.967 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -79.13 -63.0 1.52 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.494 1.121 . . . . 74.14 109.279 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.512 HG23 ' CE1' ' A' ' 143' ' ' PHE . 25.5 p -56.9 -61.59 2.34 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.531 1.144 . . . . 72.22 110.33 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 1.4 t-105 -44.52 -41.95 6.82 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.009 -1.108 . . . . 73.23 108.009 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' CYS . . . . . 0.423 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 7.1 t -63.48 -45.55 90.23 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.484 1.115 . . . . 73.45 108.278 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' A' ' 147' ' ' THR . 0.8 OUTLIER -57.32 -61.68 2.31 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.539 1.149 . . . . 62.44 109.274 -179.915 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.659 ' CE1' ' CD1' ' A' ' 157' ' ' LEU . 8.5 m-30 -39.65 -39.24 0.72 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.524 1.14 . . . . 74.5 110.935 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -56.75 -46.77 81.21 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.511 1.132 . . . . 63.42 110.278 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.491 ' O ' ' CG ' ' A' ' 153' ' ' PHE . 66.8 t80 -99.9 7.55 44.8 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.459 1.1 . . . . 65.33 111.015 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.449 ' N ' ' O ' ' A' ' 150' ' ' ASN . 0.3 OUTLIER -145.92 81.63 1.6 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.509 1.13 . . . . 73.33 111.023 179.953 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 3.9 t -72.1 -5.31 34.45 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.407 1.067 . . . . 72.53 110.409 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' SER . . . . . 0.438 ' HB3' ' CE1' ' A' ' 154' ' ' TYR . 1.1 t -67.42 -31.56 71.85 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.53 1.143 . . . . 64.44 110.022 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.659 ' CD1' ' CE1' ' A' ' 151' ' ' PHE . 3.4 tm? -79.31 -41.82 27.14 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.539 1.149 . . . . 74.3 109.333 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 158' ' ' MET . . . . . . . . . . . . . 13.8 tpp -51.63 -21.98 3.02 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.526 1.141 . . . . 75.23 111.05 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' ASN . . . . . 0.444 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 1.9 m-80 -67.18 -37.39 83.63 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.467 1.105 . . . . 74.03 109.293 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 160' ' ' SER . . . . . 0.418 ' CB ' HG23 ' A' ' 170' ' ' VAL . 0.8 OUTLIER -77.28 -27.56 53.14 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.523 1.139 . . . . 72.43 109.986 179.975 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . 0.401 ' O ' ' NE ' ' A' ' 163' ' ' ARG . 3.5 t -62.44 -18.1 19.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.56 1.163 . . . . 74.31 109.364 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -74.42 -4.39 36.29 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 124.552 1.158 . . . . 63.44 109.296 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.515 ' NH2' ' CD2' ' A' ' 189' ' ' LEU . 5.2 mmt180 58.51 30.97 20.48 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.494 1.121 . . . . 73.32 110.208 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 164' ' ' GLN . . . . . 0.444 ' NE2' ' O ' ' A' ' 159' ' ' ASN . 22.6 mt-30 -52.45 -174.64 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.483 1.114 . . . . 73.34 110.264 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -110.53 73.13 0.81 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.536 1.147 . . . . 72.4 109.58 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . 0.409 ' C ' ' N ' ' A' ' 168' ' ' ASN . 0.0 OUTLIER -111.8 163.75 13.83 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.496 1.123 . . . . 72.03 109.329 -179.993 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 167' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -42.62 -25.91 0.1 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.467 1.105 . . . . 74.41 111.033 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 168' ' ' ASN . . . . . 0.409 ' N ' ' C ' ' A' ' 166' ' ' LYS . 1.5 p-10 -119.3 156.17 30.49 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.54 1.15 . . . . 74.12 109.318 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 169' ' ' SER . . . . . 0.401 ' N ' ' O ' ' A' ' 133' ' ' ALA . 1.2 m -131.54 143.5 50.42 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.577 1.173 . . . . 73.05 109.97 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.464 ' O ' ' CD1' ' A' ' 171' ' ' ILE . 5.1 t -102.91 131.63 50.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.467 1.104 . . . . 73.52 109.333 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . 0.464 ' CD1' ' O ' ' A' ' 170' ' ' VAL . 1.2 mp -140.03 111.09 7.25 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.561 1.163 . . . . 73.0 109.287 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 172' ' ' PRO . . . . . 0.509 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.08 106.74 2.33 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.45 1.763 . . . . 73.52 110.983 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 3.1 ttt -90.47 151.83 21.21 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.467 1.105 . . . . 64.32 111.048 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 4.7 tpp85 -110.18 122.04 39.92 Favored Pre-proline 0 C--N 1.324 -0.512 0 O-C-N 124.509 1.131 . . . . 73.04 110.279 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.04 160.91 39.47 Favored 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.477 1.777 . . . . 73.34 110.992 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 176' ' ' LEU . . . . . 0.554 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -100.62 -40.55 7.34 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.579 1.175 . . . . 74.11 109.316 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -73.0 -23.6 60.66 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.466 1.104 . . . . 70.44 109.275 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 178' ' ' ASN . . . . . 0.447 ' ND2' ' OD2' ' A' ' 89' ' ' ASP . 2.1 m-80 -110.41 106.7 58.13 Favored Pre-proline 0 C--N 1.325 -0.467 0 O-C-N 124.534 1.146 . . . . 74.32 109.273 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.97 115.12 4.19 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.497 1.788 . . . . 74.41 111.013 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . 0.49 ' CD1' ' OG1' ' A' ' 185' ' ' THR . 1.1 tm? -126.94 96.97 33.45 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 124.454 1.096 . . . . 75.2 109.306 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 165.37 31.42 Favored 'Trans proline' 0 C--N 1.36 1.14 0 O-C-N 124.548 1.815 . . . . 61.41 110.969 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 3.7 ptt180 -55.8 -39.35 71.18 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.474 1.109 . . . . 72.34 110.308 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -55.72 -18.22 7.68 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.481 1.113 . . . . 75.15 110.277 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 184' ' ' ARG . . . . . 0.416 ' CB ' HD23 ' A' ' 180' ' ' LEU . 14.2 mmt180 -104.14 -18.06 14.66 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.488 1.118 . . . . 74.44 110.218 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 185' ' ' THR . . . . . 0.49 ' OG1' ' CD1' ' A' ' 180' ' ' LEU . 42.1 m -91.38 143.99 29.04 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.426 1.079 . . . . 75.51 110.381 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 186' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 185' ' ' THR . 18.4 Cg_endo -75.06 149.0 35.81 Favored 'Trans proline' 0 C--N 1.362 1.239 0 O-C-N 124.453 1.765 . . . . 64.41 110.993 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 187' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -62.82 -11.51 18.48 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.492 1.12 . . . . 61.52 110.994 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -88.57 -53.98 4.39 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.5 1.125 . . . . 74.31 109.36 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.515 ' CD2' ' NH2' ' A' ' 163' ' ' ARG . 40.4 mt -73.04 -18.17 61.36 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.538 1.149 . . . . 74.14 109.299 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 190' ' ' GLN . . . . . 0.473 ' CG ' ' O ' ' A' ' 190' ' ' GLN . 6.9 tt0 -86.0 -1.07 56.99 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.504 1.127 . . . . 62.12 110.289 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 191' ' ' THR . . . . . . . . . . . . . 41.2 p -128.12 22.66 6.13 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.492 1.12 . . . . 75.42 110.411 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.433 ' O ' ' N ' ' A' ' 194' ' ' ALA . 4.2 mt -124.58 157.63 32.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.483 1.115 . . . . 74.42 109.296 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -61.79 82.8 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.513 1.133 . . . . 64.34 109.288 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 194' ' ' ALA . . . . . 0.509 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -82.5 152.05 26.22 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.59 1.181 . . . . 71.54 109.29 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 195' ' ' LEU . . . . . 0.457 ' CD2' ' CD1' ' A' ' 209' ' ' ILE . 0.2 OUTLIER -83.86 137.66 33.57 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.475 1.109 . . . . 74.34 109.3 179.979 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -121.47 123.2 41.48 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.514 1.134 . . . . 72.55 110.274 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . 0.498 ' CG ' ' CD2' ' A' ' 176' ' ' LEU . 9.5 tp10 -97.27 -29.61 13.45 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.476 1.11 . . . . 74.52 110.33 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 198' ' ' GLU . . . . . 0.429 ' N ' HD11 ' A' ' 176' ' ' LEU . 4.4 pt-20 -95.19 23.08 6.04 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.436 1.085 . . . . 73.22 110.305 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 2.0 t -122.91 134.37 54.36 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.581 1.176 . . . . 75.52 110.017 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 20.4 ttt180 -54.88 -18.56 5.06 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.497 1.123 . . . . 74.23 110.355 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -91.42 18.77 50.92 Favored Glycine 0 CA--C 1.529 0.964 0 O-C-N 124.504 1.128 . . . . 72.22 111.01 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 202' ' ' PHE . . . . . 0.685 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 7.3 t80 -65.67 -39.43 32.13 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.429 0.723 . . . . 71.31 110.989 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 203' ' ' PRO . . . . . 0.685 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -74.98 -38.67 1.5 Allowed 'Trans proline' 0 C--N 1.361 1.209 0 O-C-N 124.509 1.794 . . . . 74.12 111.012 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -51.61 -62.66 1.49 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.511 1.132 . . . . 74.24 110.415 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 205' ' ' GLN . . . . . 0.454 ' O ' ' N ' ' A' ' 208' ' ' ARG . 7.2 mt-30 -55.63 -58.02 9.54 Favored 'General case' 0 C--N 1.323 -0.549 0 O-C-N 124.476 1.11 . . . . 63.21 110.298 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 206' ' ' VAL . . . . . 0.555 HG11 ' CE1' ' A' ' 104' ' ' PHE . 72.2 t -42.69 -31.2 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.44 1.088 . . . . 71.05 109.318 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -83.03 -41.32 18.8 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.491 1.119 . . . . 71.22 110.323 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 208' ' ' ARG . . . . . 0.454 ' N ' ' O ' ' A' ' 205' ' ' GLN . 51.1 mtt180 -71.43 -63.23 1.16 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.45 1.094 . . . . 73.11 110.269 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 209' ' ' ILE . . . . . 0.552 ' O ' ' CE2' ' A' ' 134' ' ' TRP . 39.6 mt -48.33 -50.14 12.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.456 1.098 . . . . 75.05 109.287 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 210' ' ' PHE . . . . . 0.575 ' HA ' ' CZ2' ' A' ' 134' ' ' TRP . 0.5 OUTLIER -102.77 65.06 0.89 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.515 1.134 . . . . 75.12 111.004 -179.977 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -110.9 144.8 39.39 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 124.519 1.137 . . . . 61.34 110.286 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 212' ' ' GLU . . . . . 0.448 ' O ' ' N ' ' A' ' 215' ' ' TYR . 21.6 tt0 -48.84 -54.98 12.98 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.542 1.151 . . . . 74.45 110.286 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 3.4 t -48.34 -25.12 1.44 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.522 1.139 . . . . 72.24 109.983 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 43.2 t -96.28 -27.07 4.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.52 1.137 . . . . 72.04 109.298 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 215' ' ' TYR . . . . . 0.448 ' N ' ' O ' ' A' ' 212' ' ' GLU . 13.5 t80 -67.42 -36.62 81.61 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.484 1.115 . . . . 72.5 110.94 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 14.9 mmtt -52.03 -50.71 60.9 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.498 1.124 . . . . 73.4 109.321 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 18.8 m -58.17 -65.24 0.68 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.484 1.115 . . . . 73.21 110.407 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.12 -22.17 10.4 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.5 1.125 . . . . 73.12 110.316 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 219' ' ' GLN . . . . . 0.42 ' N ' ' O ' ' A' ' 215' ' ' TYR . 47.6 tp60 -84.35 -30.17 25.68 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.482 1.114 . . . . 74.32 110.236 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 220' ' ' THR . . . . . 0.491 ' O ' ' CG ' ' A' ' 224' ' ' GLU . 1.0 OUTLIER -86.64 -22.64 26.05 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.536 1.147 . . . . 73.45 110.379 -179.981 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 221' ' ' ILE . . . . . . . . . . . . . 42.6 mt -74.22 -53.97 15.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 O-C-N 124.424 1.077 . . . . 75.45 109.303 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 222' ' ' TRP . . . . . 0.516 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 14.4 t90 -63.26 -52.03 63.73 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.937 -1.134 . . . . 73.33 107.937 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.98 -20.93 10.23 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.553 1.158 . . . . 74.34 109.335 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 224' ' ' GLU . . . . . 0.491 ' CG ' ' O ' ' A' ' 220' ' ' THR . 8.2 mm-40 . . . . . 0 C--N 1.325 -0.463 0 O-C-N 124.49 1.119 . . . . 73.01 110.267 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.999 0 N-CA-C 110.993 -0.843 . . . . 50.45 110.993 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.96 -168.19 0.49 Allowed 'Trans proline' 0 C--N 1.359 1.125 0 O-C-N 124.495 1.787 . . . . 73.23 111.005 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.93 -56.16 2.22 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.527 1.142 . . . . 74.1 109.331 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -161.33 58.07 0.3 Allowed Glycine 0 CA--C 1.53 0.984 0 O-C-N 124.512 1.132 . . . . 74.42 111.026 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.414 ' OG ' ' N ' ' A' ' 75' ' ' GLU . 0.5 OUTLIER -75.37 173.34 11.04 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.47 0.747 . . . . 71.11 110.02 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.414 ' N ' ' OG ' ' A' ' 74' ' ' SER . 27.7 tt0 -42.43 121.35 1.91 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.516 1.135 . . . . 74.13 110.354 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -116.48 134.07 55.29 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.471 1.107 . . . . 73.14 110.265 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.3 p -138.68 150.18 23.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.551 1.157 . . . . 73.32 109.239 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.41 ' O ' ' CD2' ' A' ' 78' ' ' PHE . 52.1 p90 -89.23 34.63 0.8 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.547 1.154 . . . . 72.24 110.981 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.442 HD21 ' N ' ' A' ' 81' ' ' PHE . 4.4 tt -39.99 150.9 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.54 1.15 . . . . 74.33 109.322 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.446 ' CD ' ' O ' ' A' ' 107' ' ' LYS . 5.0 mtpt -72.2 -60.68 2.11 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.544 1.153 . . . . 74.31 109.257 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.597 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.1 OUTLIER -167.22 152.15 7.23 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.491 1.12 . . . . 73.23 111.011 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.466 HG12 ' CB ' ' A' ' 128' ' ' ALA . 4.5 p -100.86 163.39 3.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.487 1.117 . . . . 74.54 109.307 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.464 ' CG2' ' HB ' ' A' ' 136' ' ' ILE . 5.3 mp -125.63 98.6 5.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.515 1.134 . . . . 72.11 109.316 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.402 ' O ' ' O ' ' A' ' 136' ' ' ILE . 4.8 mt -73.11 115.59 12.61 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.52 1.137 . . . . 74.23 109.304 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.574 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -138.87 174.48 10.48 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.535 1.147 . . . . 75.23 109.596 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -109.52 164.04 12.88 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.461 1.101 . . . . 61.42 109.248 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 87' ' ' GLU . 15.9 tt0 -67.53 -9.57 43.7 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.555 1.159 . . . . 74.11 110.343 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -84.02 -44.96 13.61 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.431 1.082 . . . . 65.3 109.254 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -120.85 43.67 2.71 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.473 1.108 . . . . 71.43 109.299 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.574 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -77.08 -22.6 52.58 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.478 1.111 . . . . 70.2 110.383 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -82.06 -28.08 32.61 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.568 1.168 . . . . 74.34 109.357 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -71.14 -56.32 6.34 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.494 1.121 . . . . 72.24 110.303 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.477 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -56.04 -33.83 65.33 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.499 1.124 . . . . 73.34 109.306 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.406 HD12 ' N ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -74.05 -45.63 48.32 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.491 1.12 . . . . 74.4 109.364 179.945 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.406 ' N ' HD12 ' A' ' 94' ' ' LEU . 10.3 tpt180 -48.29 -29.76 4.17 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.52 1.137 . . . . 74.1 110.308 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.452 ' O ' ' N ' ' A' ' 98' ' ' ASN . 2.2 t -81.87 -65.41 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.477 1.111 . . . . 60.4 109.339 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.441 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -40.11 -27.23 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.547 1.154 . . . . 72.44 110.379 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.452 ' N ' ' O ' ' A' ' 96' ' ' VAL . 1.3 t-20 -71.35 -53.06 15.45 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.483 1.114 . . . . 75.31 109.362 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.514 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -70.72 -21.73 62.51 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.539 1.149 . . . . 74.24 109.279 179.947 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.462 ' CD2' HG12 ' A' ' 206' ' ' VAL . 22.8 mt -63.72 -51.32 65.51 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.483 1.114 . . . . 74.51 109.261 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -81.24 51.74 1.67 Allowed 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.494 1.122 . . . . 72.14 110.254 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -171.06 -66.28 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.492 1.12 . . . . 73.13 109.314 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -47.93 -47.88 32.16 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.417 1.073 . . . . 71.32 109.249 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.638 ' CE2' ' CG1' ' A' ' 206' ' ' VAL . 1.1 m-85 -115.94 -30.17 6.13 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.445 1.09 . . . . 65.15 110.982 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.67 45.18 2.75 Favored Glycine 0 CA--C 1.53 1.024 0 O-C-N 124.442 1.089 . . . . 72.25 111.029 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 9.8 mm -85.47 78.69 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.578 0.81 . . . . 73.14 109.311 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.505 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -124.16 156.02 67.03 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.519 1.137 . . . . 75.41 109.259 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.505 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.98 156.64 99.9 Favored 'Cis proline' 0 C--N 1.36 1.167 0 C-N-CA 120.945 -2.523 . . . . 74.21 111.023 -0.123 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -133.27 124.21 3.65 Favored Glycine 0 CA--C 1.531 1.047 0 O-C-N 124.452 1.095 . . . . 74.01 110.992 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 1.7 tt -142.32 149.57 19.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.492 0.76 . . . . 74.34 109.314 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.42 ' HB ' ' NE2' ' A' ' 85' ' ' HIS . 33.6 pt -99.61 163.49 2.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.472 1.107 . . . . 74.23 109.299 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -63.31 -19.09 64.29 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.508 1.13 . . . . 71.4 110.981 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -89.53 -8.13 53.44 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.519 1.137 . . . . 74.2 109.284 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -107.04 -20.09 13.42 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.571 1.169 . . . . 73.14 110.256 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.444 ' CE ' HG23 ' A' ' 82' ' ' VAL . 20.9 ttm -60.21 110.83 3.18 Favored Pre-proline 0 C--N 1.325 -0.5 0 O-C-N 124.441 1.088 . . . . 74.24 110.973 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 174.04 13.47 Favored 'Trans proline' 0 C--N 1.36 1.167 0 O-C-N 124.471 1.774 . . . . 64.35 111.03 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 10.1 p80 -174.65 168.84 3.69 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.514 1.134 . . . . 72.41 109.55 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -123.11 -94.92 1.18 Allowed Glycine 0 CA--C 1.529 0.923 0 O-C-N 124.478 1.111 . . . . 63.21 111.035 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 33.6 mtm180 -82.44 -26.65 32.51 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.439 0.729 . . . . 73.23 110.331 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -75.39 153.82 37.51 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.553 1.158 . . . . 72.42 110.341 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 6.6 m170 -83.67 173.14 11.61 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.508 1.13 . . . . 74.0 109.651 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.499 ' C ' ' CD2' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -108.71 -18.15 13.78 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.455 1.097 . . . . 74.22 109.337 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.404 ' N ' HD12 ' A' ' 122' ' ' LEU . 14.5 mt-30 -76.65 61.32 1.8 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.546 1.153 . . . . 74.13 110.214 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -129.46 86.01 2.37 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.551 1.157 . . . . 73.53 109.328 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.2 pp -58.02 -17.84 20.23 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.478 1.111 . . . . 74.5 109.268 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.403 ' O ' ' N ' ' A' ' 129' ' ' VAL . 6.1 p-10 -74.5 -41.2 61.1 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.521 1.138 . . . . 72.55 109.267 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -47.05 -48.41 22.36 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.439 1.087 . . . . 73.11 109.265 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.466 ' CB ' HG12 ' A' ' 82' ' ' VAL . . . -59.56 -34.48 72.74 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.484 1.115 . . . . 74.01 109.332 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.499 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 68.8 t -92.84 30.8 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 O-C-N 124.507 1.129 . . . . 72.43 109.279 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -133.0 139.27 47.16 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.473 1.108 . . . . 74.34 109.286 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . 0.501 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 37.87 76.7 0.07 OUTLIER Glycine 0 CA--C 1.53 1.03 0 O-C-N 124.537 1.148 . . . . 71.51 110.982 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' SER . . . . . 0.4 ' O ' ' O ' ' A' ' 167' ' ' TYR . 0.6 OUTLIER -163.64 -175.46 4.17 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.499 0.764 . . . . 64.1 109.98 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.55 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -110.46 -41.36 4.37 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.566 1.166 . . . . 73.22 109.292 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.575 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 0.4 OUTLIER -154.54 165.86 35.12 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 107.969 -1.123 . . . . 74.41 107.969 -179.967 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.405 ' CG2' ' O ' ' A' ' 128' ' ' ALA . 3.2 p -133.35 129.21 37.16 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.542 1.151 . . . . 74.32 110.399 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.464 ' HB ' ' CG2' ' A' ' 83' ' ' ILE . 11.4 mm -84.56 121.87 37.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.506 1.129 . . . . 75.55 109.288 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 6.7 mt -108.29 87.81 2.58 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.479 1.112 . . . . 75.33 109.311 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.554 ' O ' ' CD1' ' A' ' 143' ' ' PHE . 3.5 tp -62.27 88.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.5 1.125 . . . . 74.23 109.268 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.459 ' CD1' HG22 ' A' ' 185' ' ' THR . 19.3 mt -61.48 113.7 2.82 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.441 1.088 . . . . 73.35 109.343 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.456 ' HB ' ' CB ' ' A' ' 143' ' ' PHE . 5.7 m -140.32 154.4 46.77 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.525 1.14 . . . . 63.3 110.412 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 11.2 mp0 -47.34 -39.95 16.11 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.478 1.111 . . . . 73.14 110.332 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . 0.412 ' ND2' ' N ' ' A' ' 143' ' ' PHE . 2.4 p-10 -89.89 -53.6 4.42 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.53 1.144 . . . . 74.21 109.294 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.554 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 37.3 t80 -48.95 -21.49 0.67 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.486 1.116 . . . . 74.11 111.038 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.511 ' O ' ' CB ' ' A' ' 148' ' ' TRP . 3.0 tm? -78.49 -67.64 0.72 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.547 1.154 . . . . 74.23 109.303 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.461 ' N ' ' CD ' ' A' ' 145' ' ' ARG . 0.1 OUTLIER -55.52 -17.48 5.44 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.457 1.098 . . . . 73.52 110.362 179.934 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -70.19 -73.15 0.17 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.5 1.125 . . . . 72.4 109.297 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.468 ' O ' ' N ' ' A' ' 150' ' ' ASN . 0.9 OUTLIER -72.61 -48.11 42.38 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.503 1.127 . . . . 61.22 110.443 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.541 ' CE3' ' CD2' ' A' ' 151' ' ' PHE . 15.5 t-105 -44.39 -40.26 5.28 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.49 1.118 . . . . 74.54 108.001 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . 0.451 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 15.9 t -66.28 -45.74 79.41 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.483 1.114 . . . . 73.33 108.274 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.468 ' N ' ' O ' ' A' ' 147' ' ' THR . 0.6 OUTLIER -54.07 -53.92 46.54 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.47 1.106 . . . . 65.34 109.291 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.625 ' CE1' ' CD1' ' A' ' 157' ' ' LEU . 9.8 m-30 -38.2 -60.26 0.79 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.502 1.126 . . . . 71.21 111.029 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -45.75 -38.54 7.13 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.474 1.109 . . . . 72.51 110.291 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.45 ' N ' ' O ' ' A' ' 150' ' ' ASN . 51.8 t80 -82.26 -23.91 35.05 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.435 1.084 . . . . 71.43 110.989 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.546 ' CZ ' ' OG ' ' A' ' 156' ' ' SER . 1.2 t80 -144.57 107.45 4.48 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.472 1.107 . . . . 74.21 110.949 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.1 t -73.18 -6.26 44.68 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.444 1.09 . . . . 64.11 110.431 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' SER . . . . . 0.546 ' OG ' ' CZ ' ' A' ' 154' ' ' TYR . 22.0 m -51.29 -52.55 44.15 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.434 1.083 . . . . 72.04 110.01 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.625 ' CD1' ' CE1' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -66.96 -40.26 87.45 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.49 1.119 . . . . 74.24 109.244 -179.96 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' MET . . . . . 0.562 ' HE1' ' CD2' ' A' ' 151' ' ' PHE . 2.1 mmt -53.24 -19.55 3.27 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.418 1.074 . . . . 72.2 110.994 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' ASN . . . . . 0.47 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 87.5 m-20 -75.18 -42.23 56.32 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.474 1.108 . . . . 74.23 109.326 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.506 ' O ' ' CG2' ' A' ' 170' ' ' VAL . 0.3 OUTLIER -64.54 -13.47 52.76 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.51 1.131 . . . . 75.32 110.023 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . 0.423 HG21 ' CE ' ' A' ' 158' ' ' MET . 89.0 t -74.85 -15.96 16.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.508 1.13 . . . . 74.34 109.311 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.14 2.83 19.5 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.506 1.129 . . . . 74.13 109.286 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.452 ' HD3' ' CG2' ' A' ' 192' ' ' ILE . 14.8 mmm-85 60.37 64.97 1.13 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.42 1.075 . . . . 73.31 110.29 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . 0.505 ' NE2' ' N ' ' A' ' 164' ' ' GLN . 0.9 OUTLIER -65.68 129.15 38.75 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.478 1.112 . . . . 73.24 110.271 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.417 ' O ' ' O ' ' A' ' 166' ' ' LYS . 13.3 m-70 -74.03 -3.91 32.17 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.507 1.129 . . . . 74.21 109.624 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . 0.417 ' O ' ' O ' ' A' ' 165' ' ' HIS . 5.6 mptt -49.64 178.79 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.501 1.125 . . . . 72.42 109.334 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' TYR . . . . . 0.593 ' CE2' ' OD1' ' A' ' 168' ' ' ASN . 29.6 p90 -48.22 -47.66 35.52 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.452 1.095 . . . . 72.33 111.014 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.593 ' OD1' ' CE2' ' A' ' 167' ' ' TYR . 3.2 p-10 -89.5 146.23 24.76 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.468 1.105 . . . . 70.41 109.345 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 8.3 t -128.11 169.02 14.56 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.505 1.128 . . . . 72.53 109.991 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.506 ' CG2' ' O ' ' A' ' 160' ' ' SER . 12.7 t -123.0 111.59 30.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 O-C-N 124.463 1.102 . . . . 53.44 109.336 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.7 mp -126.32 97.24 34.72 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.538 1.149 . . . . 75.32 109.269 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . 0.503 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.3 Cg_endo -75.0 106.92 2.37 Favored 'Trans proline' 0 C--N 1.36 1.141 0 O-C-N 124.507 1.793 . . . . 65.42 110.986 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 5.9 ttt -78.54 156.36 29.26 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.485 1.116 . . . . 73.32 110.997 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . 0.479 ' NH2' ' NH2' ' A' ' 182' ' ' ARG . 59.5 mtt85 -110.13 124.32 33.75 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.545 1.153 . . . . 73.51 110.327 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.95 156.11 43.21 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.505 1.792 . . . . 73.31 111.008 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . 0.468 ' CD1' ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -104.17 -47.0 4.28 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.478 1.111 . . . . 75.32 109.248 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -72.77 -21.46 61.0 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.496 1.123 . . . . 72.23 109.314 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' ASN . . . . . 0.428 ' ND2' ' CG2' ' A' ' 140' ' ' THR . 5.5 t-20 -107.0 109.11 62.93 Favored Pre-proline 0 C--N 1.324 -0.528 0 O-C-N 124.576 1.173 . . . . 74.55 109.265 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.06 115.34 4.25 Favored 'Trans proline' 0 C--N 1.359 1.11 0 O-C-N 124.518 1.799 . . . . 71.03 111.007 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . 0.42 HD21 ' CB ' ' A' ' 184' ' ' ARG . 0.6 OUTLIER -138.02 96.9 10.08 Favored Pre-proline 0 C--N 1.326 -0.453 0 O-C-N 124.491 1.119 . . . . 74.31 109.237 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.97 166.97 28.09 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.461 1.769 . . . . 74.23 110.969 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . 0.479 ' NH2' ' NH2' ' A' ' 174' ' ' ARG . 0.1 OUTLIER -56.98 -31.41 65.01 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.579 1.174 . . . . 74.12 110.34 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -57.15 -17.0 9.09 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.473 1.108 . . . . 70.53 110.317 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' ARG . . . . . 0.42 ' CB ' HD21 ' A' ' 180' ' ' LEU . 23.3 mmt85 -109.24 -14.18 14.52 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.49 1.119 . . . . 74.43 110.299 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' THR . . . . . 0.459 HG22 ' CD1' ' A' ' 139' ' ' LEU . 86.3 m -89.94 143.19 29.64 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.487 1.117 . . . . 73.21 110.395 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 185' ' ' THR . 18.5 Cg_endo -74.95 144.54 30.57 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.52 1.8 . . . . 74.45 110.989 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 187' ' ' PHE . . . . . 0.468 ' O ' ' CG2' ' A' ' 191' ' ' THR . 22.5 p90 -60.84 -13.0 12.69 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.411 1.069 . . . . 74.11 110.981 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . 0.407 ' O ' ' CD1' ' A' ' 192' ' ' ILE . . . -86.25 -54.6 4.35 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.553 1.158 . . . . 74.13 109.26 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 20.2 mt -74.14 -15.46 61.03 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.448 1.092 . . . . 74.21 109.299 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -84.75 -23.56 29.2 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.468 1.105 . . . . 72.12 110.248 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 191' ' ' THR . . . . . 0.468 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 39.8 p -101.9 21.19 15.06 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 124.571 1.169 . . . . 73.34 110.403 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.452 ' CG2' ' HD3' ' A' ' 163' ' ' ARG . 19.9 mt -124.64 154.69 32.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.492 1.12 . . . . 74.31 109.248 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -63.76 98.04 0.18 Allowed 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.517 1.136 . . . . 73.53 109.375 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . 0.503 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -92.39 151.77 20.08 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.585 1.178 . . . . 71.41 109.323 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 195' ' ' LEU . . . . . 0.467 HD21 ' CD1' ' A' ' 209' ' ' ILE . 0.3 OUTLIER -86.8 147.56 25.77 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.495 1.122 . . . . 72.44 109.316 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -143.77 141.02 30.22 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.478 1.111 . . . . 71.44 110.321 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . 0.514 ' HA ' ' CG ' ' A' ' 202' ' ' PHE . 2.1 pt-20 -113.19 -17.47 12.35 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.494 1.121 . . . . 71.41 110.296 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . 0.45 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -92.32 2.58 56.55 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 124.472 1.107 . . . . 73.53 110.363 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 36.3 t -99.16 165.32 11.77 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.499 1.124 . . . . 74.21 109.959 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 14.8 mtm180 -75.85 -27.48 57.85 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.525 1.141 . . . . 74.44 110.35 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -95.86 20.28 50.6 Favored Glycine 0 CA--C 1.528 0.892 0 O-C-N 124.537 1.148 . . . . 74.35 111.029 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 202' ' ' PHE . . . . . 0.627 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 0.1 OUTLIER -58.21 -43.22 98.1 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.45 0.736 . . . . 72.22 110.932 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 203' ' ' PRO . . . . . 0.627 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.5 Cg_endo -74.98 -30.32 7.32 Favored 'Trans proline' 0 C--N 1.359 1.108 0 O-C-N 124.529 1.805 . . . . 75.14 110.984 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.04 -65.56 0.67 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.53 1.144 . . . . 71.34 110.352 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -52.05 -39.4 59.58 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.481 1.113 . . . . 74.14 110.28 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 206' ' ' VAL . . . . . 0.638 ' CG1' ' CE2' ' A' ' 104' ' ' PHE . 47.3 t -60.84 -28.3 42.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.557 1.161 . . . . 62.22 109.308 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -83.06 -50.32 8.63 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.474 1.109 . . . . 70.31 110.241 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -61.18 -64.07 1.08 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.466 1.104 . . . . 70.44 110.261 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 209' ' ' ILE . . . . . 0.578 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 44.9 mt -47.07 -56.44 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 124.501 1.126 . . . . 72.34 109.263 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 210' ' ' PHE . . . . . 0.578 ' CE1' ' CG2' ' A' ' 209' ' ' ILE . 2.4 m-85 -101.2 67.58 1.18 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.598 1.186 . . . . 74.33 110.962 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.7 145.33 38.19 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.485 1.115 . . . . 72.22 110.311 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' A' ' 215' ' ' TYR . 34.0 tt0 -49.45 -55.07 14.45 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.511 1.132 . . . . 75.42 110.326 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.94 -23.83 0.88 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.463 1.102 . . . . 65.32 109.918 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 20.0 t -95.66 -30.56 4.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 O-C-N 124.527 1.142 . . . . 74.44 109.322 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 215' ' ' TYR . . . . . 0.455 ' N ' ' O ' ' A' ' 212' ' ' GLU . 6.6 t80 -62.12 -25.11 67.55 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.467 1.104 . . . . 75.33 110.965 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . 0.413 ' O ' ' N ' ' A' ' 219' ' ' GLN . 3.9 mmtp -73.73 -61.65 1.77 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.504 1.128 . . . . 74.31 109.303 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 71.4 m -46.93 -48.54 21.39 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.487 1.117 . . . . 72.51 110.383 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -64.54 -25.08 67.83 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.469 1.106 . . . . 75.32 110.284 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 219' ' ' GLN . . . . . 0.446 ' O ' ' NE2' ' A' ' 219' ' ' GLN . 31.6 tp60 -83.64 -28.85 28.14 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.494 1.121 . . . . 74.13 110.256 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 220' ' ' THR . . . . . 0.457 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 3.0 m -85.11 -28.35 25.64 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.568 1.167 . . . . 75.34 110.426 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 221' ' ' ILE . . . . . 0.419 HG21 ' N ' ' A' ' 167' ' ' TYR . 46.2 mt -76.54 -32.76 21.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.473 1.108 . . . . 74.51 109.28 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 222' ' ' TRP . . . . . 0.501 ' CD1' ' HA2' ' A' ' 131' ' ' GLY . 18.2 t90 -74.29 -58.33 3.37 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.523 1.139 . . . . 61.55 107.989 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . 0.457 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -51.26 -22.63 2.84 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.551 1.157 . . . . 75.41 109.325 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -89.32 -35.22 16.24 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.528 1.142 . . . . 72.11 110.3 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 225' ' ' THR . . . . . 0.524 ' O ' ' CG1' ' A' ' 229' ' ' VAL . 1.9 t -63.08 -15.74 57.63 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.49 1.118 . . . . 71.24 110.35 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.28 -9.41 59.73 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.386 1.054 . . . . 74.32 110.284 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 227' ' ' ASN . . . . . 0.44 ' O ' ' N ' ' A' ' 231' ' ' ARG . 0.9 OUTLIER -92.22 -71.05 0.66 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.451 1.094 . . . . 74.31 109.3 179.945 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 228' ' ' MET . . . . . 0.5 ' CE ' ' HA ' ' A' ' 225' ' ' THR . 0.0 OUTLIER -43.32 -36.11 1.74 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.473 1.108 . . . . 74.43 110.97 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 229' ' ' VAL . . . . . 0.524 ' CG1' ' O ' ' A' ' 225' ' ' THR . 30.7 m -71.43 -53.95 19.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.548 1.155 . . . . 72.54 109.35 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 230' ' ' GLN . . . . . 0.416 ' N ' ' CG2' ' A' ' 229' ' ' VAL . 3.6 tp60 -68.29 -8.41 39.34 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.412 1.07 . . . . 74.42 110.258 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 231' ' ' ARG . . . . . 0.44 ' N ' ' O ' ' A' ' 227' ' ' ASN . 20.1 tpt180 -87.62 -83.27 0.21 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.493 1.121 . . . . 73.05 110.324 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -141.36 36.74 1.69 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.516 1.135 . . . . 72.3 110.287 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.86 33.88 0.68 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.503 1.127 . . . . 73.23 111.054 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 8.2 tt -57.06 152.41 2.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.551 1.157 . . . . 74.34 109.27 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.457 0 O-C-N 124.483 1.115 . . . . 73.21 109.313 -179.994 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.008 0 N-CA-C 110.998 -0.841 . . . . 73.42 110.998 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.01 144.05 29.76 Favored 'Trans proline' 0 C--N 1.36 1.166 0 O-C-N 124.56 1.821 . . . . 72.12 111.007 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -76.82 -47.77 20.49 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.479 1.112 . . . . 71.22 109.257 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -119.48 117.41 3.6 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.451 1.095 . . . . 74.41 111.011 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 60.0 p -131.04 164.99 24.19 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.491 0.76 . . . . 53.52 109.959 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.9 tt0 -44.35 140.32 2.31 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.596 1.185 . . . . 74.42 110.331 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -133.01 144.13 49.88 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.518 1.137 . . . . 74.12 110.317 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.412 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.4 p -178.38 159.49 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.442 1.089 . . . . 73.42 109.285 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.532 ' O ' ' CD2' ' A' ' 78' ' ' PHE . 10.1 p90 -89.61 28.27 1.34 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.55 1.157 . . . . 74.24 110.977 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.415 ' C ' ' O ' ' A' ' 78' ' ' PHE . 4.3 tp -39.52 140.59 0.46 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.537 1.148 . . . . 74.05 109.268 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.488 ' CD ' ' O ' ' A' ' 107' ' ' LYS . 3.2 mtpt -75.99 -64.25 1.13 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.495 1.122 . . . . 72.11 109.26 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.603 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.1 OUTLIER -161.54 149.33 15.03 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.457 1.098 . . . . 74.33 111.001 -179.959 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.534 ' CG1' ' CG2' ' A' ' 135' ' ' THR . 7.7 p -97.81 169.62 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 O-C-N 124.441 1.088 . . . . 75.32 109.292 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.454 HD13 ' CE1' ' A' ' 81' ' ' PHE . 5.0 mp -132.63 92.2 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.49 1.119 . . . . 74.42 109.267 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.518 HD22 ' CG ' ' A' ' 112' ' ' PHE . 8.2 mt -70.17 117.81 12.2 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.49 1.119 . . . . 74.01 109.28 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.593 ' CE1' ' OG1' ' A' ' 90' ' ' THR . 0.0 OUTLIER -140.35 174.6 10.35 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.513 1.133 . . . . 70.12 109.583 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -102.78 164.36 11.68 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.52 1.138 . . . . 64.13 109.235 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.453 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 21.9 tt0 -69.78 -6.78 34.48 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.586 1.179 . . . . 74.25 110.262 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -89.9 -46.07 8.8 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.435 1.085 . . . . 73.34 109.252 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -114.57 44.12 1.79 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.409 1.068 . . . . 72.21 109.28 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.593 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -78.85 -22.99 45.26 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.512 1.132 . . . . 73.04 110.432 179.948 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -82.51 -30.2 29.97 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.459 1.099 . . . . 72.53 109.356 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.411 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -70.22 -57.54 4.78 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.478 1.111 . . . . 75.21 110.226 -179.958 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.534 ' CB ' ' CD2' ' A' ' 138' ' ' LEU . . . -55.19 -35.24 64.62 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.508 1.13 . . . . 73.22 109.298 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.4 -44.32 62.65 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.526 1.141 . . . . 71.21 109.335 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 15.2 tpp180 -48.3 -29.49 3.93 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.479 1.112 . . . . 73.41 110.303 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.458 ' C ' ' N ' ' A' ' 98' ' ' ASN . 2.1 t -81.02 -64.62 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.497 1.123 . . . . 73.41 109.282 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.429 ' HG3' ' N ' ' A' ' 98' ' ' ASN . 0.0 OUTLIER -41.04 -26.21 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.512 1.132 . . . . 72.52 110.309 -179.968 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.458 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.1 t-20 -72.4 -58.09 3.67 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.449 1.093 . . . . 74.43 109.333 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.518 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -64.92 -22.28 66.97 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.503 1.127 . . . . 73.21 109.265 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.425 ' N ' HD21 ' A' ' 99' ' ' LEU . 22.2 mt -62.99 -57.3 11.18 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.481 1.113 . . . . 72.35 109.301 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.46 58.44 1.01 Allowed 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.47 1.106 . . . . 62.25 110.318 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -178.66 -62.99 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.496 1.123 . . . . 74.1 109.36 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.416 ' HB3' ' CD2' ' A' ' 104' ' ' PHE . 19.9 t0 -51.86 -49.77 62.26 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 62.13 109.303 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.568 ' CE2' HG12 ' A' ' 206' ' ' VAL . 0.9 OUTLIER -114.47 -26.54 7.9 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.565 1.165 . . . . 74.02 111.018 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.436 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 93.54 45.63 3.41 Favored Glycine 0 CA--C 1.529 0.957 0 O-C-N 124.476 1.11 . . . . 63.33 111.017 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 12.1 mm -84.42 69.34 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.442 0.731 . . . . 63.12 109.252 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.506 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -115.58 156.35 46.21 Favored Pre-proline 0 C--N 1.325 -0.499 0 O-C-N 124.483 1.114 . . . . 73.53 109.296 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.521 ' HD3' ' CE2' ' A' ' 78' ' ' PHE . 18.5 Cg_endo -74.92 157.96 99.27 Favored 'Cis proline' 0 C--N 1.36 1.181 0 C-N-CA 121.077 -2.468 . . . . 74.45 110.957 0.073 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -122.86 133.01 8.9 Favored Glycine 0 CA--C 1.532 1.096 0 O-C-N 124.535 1.147 . . . . 70.23 110.986 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -154.64 135.02 4.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.534 0.785 . . . . 72.52 109.354 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.403 HD12 ' NE2' ' A' ' 85' ' ' HIS . 38.2 pt -91.07 176.46 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.449 1.093 . . . . 73.21 109.292 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.518 ' CG ' HD22 ' A' ' 84' ' ' LEU . 2.2 t80 -78.71 -19.2 52.96 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.503 1.127 . . . . 74.51 110.995 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -90.08 -3.59 57.85 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.521 1.138 . . . . 73.15 109.279 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -110.49 -26.41 9.52 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.515 1.134 . . . . 64.12 110.239 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.444 ' CE ' HG22 ' A' ' 82' ' ' VAL . 6.1 ttm -38.55 111.1 0.6 Allowed Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.525 1.141 . . . . 73.53 110.991 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 76.45 3.39 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.533 1.807 . . . . 73.21 111.004 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -125.15 174.11 8.29 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.534 1.146 . . . . 73.41 109.618 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.69 -179.82 4.61 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.594 1.184 . . . . 75.34 110.987 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 30.0 mtp85 -117.55 42.15 2.66 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.395 0.703 . . . . 71.22 110.348 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -78.84 -61.38 2.03 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.483 1.114 . . . . 72.31 110.326 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -167.72 132.66 1.88 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.517 1.135 . . . . 74.05 109.641 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.94 22.58 14.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.5 1.125 . . . . 74.24 109.291 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -70.79 -52.5 20.2 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.516 1.135 . . . . 75.44 110.326 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -58.34 101.79 0.09 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.576 1.172 . . . . 74.34 109.276 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.503 ' O ' ' CB ' ' A' ' 128' ' ' ALA . 0.2 OUTLIER -85.52 -17.14 37.25 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.403 1.064 . . . . 64.22 109.299 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -45.31 -59.23 2.77 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.509 1.13 . . . . 74.52 109.321 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -44.65 -39.25 4.9 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.536 1.147 . . . . 74.42 109.285 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.503 ' CB ' ' O ' ' A' ' 125' ' ' LEU . . . -50.38 -50.49 51.31 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.504 1.128 . . . . 70.54 109.297 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.507 ' O ' ' CB ' ' A' ' 168' ' ' ASN . 34.6 m -92.48 31.16 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.438 1.086 . . . . 73.04 109.218 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -114.08 149.18 35.9 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.492 1.12 . . . . 75.23 109.254 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 39.66 70.03 0.38 Allowed Glycine 0 CA--C 1.531 1.063 0 O-C-N 124.54 1.15 . . . . 73.21 110.983 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -163.6 179.77 6.98 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.545 0.791 . . . . 65.43 110.063 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.589 ' CB ' ' CE3' ' A' ' 134' ' ' TRP . . . -102.49 -43.06 5.75 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.526 1.141 . . . . 73.52 109.279 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.589 ' CE3' ' CB ' ' A' ' 133' ' ' ALA . 0.7 OUTLIER -154.99 169.89 23.03 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.534 1.146 . . . . 73.32 108.05 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.534 ' CG2' ' CG1' ' A' ' 82' ' ' VAL . 1.2 p -137.99 158.32 44.57 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 65.05 110.374 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.426 ' CG1' HG13 ' A' ' 83' ' ' ILE . 10.5 mm -110.98 142.26 23.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.53 1.144 . . . . 72.53 109.257 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.48 ' CD2' ' N ' ' A' ' 137' ' ' LEU . 0.5 OUTLIER -134.69 96.46 3.56 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.462 1.101 . . . . 74.32 109.31 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.534 ' CD2' ' CB ' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.43 96.72 0.08 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.547 1.154 . . . . 75.31 109.278 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.23 102.81 0.24 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.468 1.105 . . . . 71.31 109.291 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.443 ' O ' ' N ' ' A' ' 144' ' ' LEU . 2.6 m -130.47 155.59 46.19 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.446 1.091 . . . . 63.21 110.397 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -64.42 -36.39 84.0 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.546 1.154 . . . . 63.55 110.313 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -84.1 -25.93 29.35 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.469 1.106 . . . . 74.44 109.366 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.441 ' CB ' ' HB ' ' A' ' 140' ' ' THR . 52.9 t80 -85.67 -19.93 30.17 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.479 1.112 . . . . 63.34 111.06 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.463 ' C ' ' CD1' ' A' ' 144' ' ' LEU . 2.0 tm? -66.23 -67.23 0.46 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.495 1.122 . . . . 70.41 109.299 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.45 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 22.4 mmt180 -55.17 -19.69 8.49 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.481 1.113 . . . . 74.31 110.355 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -71.96 -67.2 0.55 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.475 1.11 . . . . 74.03 109.318 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.453 ' O ' ' N ' ' A' ' 150' ' ' ASN . 3.1 p -66.84 -54.62 20.54 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.542 1.151 . . . . 75.12 110.4 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.511 ' CZ3' ' HE1' ' A' ' 158' ' ' MET . 3.3 t-105 -43.08 -36.54 1.67 Allowed 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.518 1.136 . . . . 75.11 108.029 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 43.7 t -78.64 -45.33 21.77 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.61 1.194 . . . . 74.12 108.354 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.453 ' N ' ' O ' ' A' ' 147' ' ' THR . 6.3 t-20 -56.51 -21.83 28.7 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.432 1.082 . . . . 75.15 109.319 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.436 ' O ' ' N ' ' A' ' 154' ' ' TYR . 10.7 m-30 -77.06 -51.78 10.46 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.558 1.161 . . . . 75.14 111.027 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 38.6 tt0 -42.46 -40.9 2.74 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.475 1.109 . . . . 75.15 110.3 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -88.81 -23.63 22.8 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.465 1.103 . . . . 74.45 110.924 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.436 ' N ' ' O ' ' A' ' 151' ' ' PHE . 6.8 t80 -135.17 87.91 2.37 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.481 1.113 . . . . 71.4 111.116 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.84 -4.65 29.19 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.525 1.141 . . . . 75.42 110.416 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.68 -34.39 62.23 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.521 1.138 . . . . 73.13 109.994 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.466 HD11 ' CD2' ' A' ' 125' ' ' LEU . 0.9 OUTLIER -83.06 -31.43 27.37 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.49 1.119 . . . . 74.04 109.242 -179.967 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' MET . . . . . 0.511 ' HE1' ' CZ3' ' A' ' 148' ' ' TRP . 3.5 mmt -58.94 -37.42 76.68 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.493 1.121 . . . . 73.44 110.956 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -84.11 -9.62 58.44 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.453 1.095 . . . . 75.41 109.359 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.48 ' CB ' HG23 ' A' ' 170' ' ' VAL . 0.3 OUTLIER -82.8 -31.37 28.21 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.43 1.082 . . . . 73.41 110.037 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . 0.48 ' O ' ' CD1' ' A' ' 192' ' ' ILE . 29.8 m -62.18 -18.04 19.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 124.45 1.094 . . . . 73.34 109.248 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 42.0 m-20 -78.8 0.59 26.37 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.558 1.161 . . . . 62.35 109.234 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.417 ' NE ' HG22 ' A' ' 192' ' ' ILE . 0.0 OUTLIER 50.55 49.96 19.8 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.478 1.111 . . . . 53.12 110.281 179.974 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -50.63 -177.98 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.497 1.123 . . . . 75.43 110.312 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 22.1 p80 -93.26 39.58 1.05 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.548 1.155 . . . . 73.41 109.572 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.7 tptt -94.71 179.33 5.29 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.536 1.147 . . . . 74.0 109.317 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' TYR . . . . . . . . . . . . . 24.4 p90 -84.95 44.27 1.06 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.489 1.118 . . . . 72.02 110.979 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.507 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 19.5 p30 -170.51 142.31 2.06 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 64.42 109.352 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' SER . . . . . 0.481 ' O ' ' N ' ' A' ' 135' ' ' THR . 1.4 t -128.14 128.4 44.77 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.555 1.159 . . . . 72.34 109.982 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.48 HG23 ' CB ' ' A' ' 160' ' ' SER . 8.9 t -95.59 107.18 19.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.507 1.129 . . . . 72.03 109.319 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.7 mp -121.48 106.31 37.92 Favored Pre-proline 0 C--N 1.324 -0.512 0 O-C-N 124.511 1.132 . . . . 72.43 109.338 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . 0.503 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -74.98 116.24 4.53 Favored 'Trans proline' 0 C--N 1.359 1.118 0 O-C-N 124.52 1.8 . . . . 61.24 111.016 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 3.6 ttt -92.46 152.46 19.67 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.492 1.12 . . . . 74.11 110.997 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 3.6 tpp180 -104.78 116.81 60.27 Favored Pre-proline 0 C--N 1.325 -0.47 0 O-C-N 124.52 1.138 . . . . 71.11 110.301 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.05 153.85 41.84 Favored 'Trans proline' 0 C--N 1.36 1.183 0 O-C-N 124.47 1.774 . . . . 72.2 110.999 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . 0.6 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -87.31 -43.79 11.9 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.463 1.102 . . . . 74.2 109.307 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -71.81 -27.21 62.77 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.51 1.131 . . . . 74.24 109.284 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -110.85 97.86 35.63 Favored Pre-proline 0 C--N 1.326 -0.445 0 O-C-N 124.435 1.085 . . . . 72.43 109.307 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.95 121.38 6.56 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.562 1.822 . . . . 74.4 111.081 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . 0.467 HD22 ' CB ' ' A' ' 184' ' ' ARG . 0.4 OUTLIER -128.9 96.49 29.15 Favored Pre-proline 0 C--N 1.324 -0.527 0 O-C-N 124.575 1.172 . . . . 72.53 109.327 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.04 171.54 18.12 Favored 'Trans proline' 0 C--N 1.359 1.124 0 O-C-N 124.554 1.818 . . . . 73.05 110.971 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 7.6 ptp85 -59.66 -23.41 63.03 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.531 1.145 . . . . 73.22 110.278 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -70.05 -29.23 66.2 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.459 1.099 . . . . 64.31 110.337 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 184' ' ' ARG . . . . . 0.467 ' CB ' HD22 ' A' ' 180' ' ' LEU . 27.7 mmt180 -95.41 -18.74 20.47 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.542 1.151 . . . . 74.43 110.31 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 185' ' ' THR . . . . . . . . . . . . . 19.9 m -80.9 143.95 54.5 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.516 1.135 . . . . 75.33 110.381 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.08 155.61 42.55 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.475 1.776 . . . . 72.21 110.927 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 187' ' ' PHE . . . . . 0.503 ' O ' ' CG2' ' A' ' 191' ' ' THR . 9.2 p90 -69.4 -7.1 34.62 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.513 1.133 . . . . 72.3 111.04 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.97 -53.14 4.11 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.523 1.139 . . . . 74.03 109.3 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.468 ' CD2' ' HG3' ' A' ' 172' ' ' PRO . 53.2 mt -68.3 -42.4 79.52 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.424 1.078 . . . . 75.24 109.281 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -63.82 -10.96 23.12 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.512 1.132 . . . . 74.22 110.327 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 191' ' ' THR . . . . . 0.503 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 36.2 p -113.6 18.31 17.66 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.429 1.08 . . . . 75.03 110.393 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.48 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 4.9 mt -136.37 142.46 38.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.462 1.101 . . . . 73.0 109.265 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 193' ' ' ASN . . . . . 0.405 ' N ' HG22 ' A' ' 192' ' ' ILE . 34.2 t30 -48.23 124.31 7.64 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.515 1.135 . . . . 70.54 109.319 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . 0.503 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -121.09 155.05 35.28 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.463 1.102 . . . . 70.23 109.311 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 195' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -82.27 134.22 35.27 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.538 1.149 . . . . 75.34 109.278 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -112.72 131.47 55.65 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.455 1.097 . . . . 72.41 110.259 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . 0.469 ' HG3' ' CD2' ' A' ' 176' ' ' LEU . 3.8 tp10 -113.42 -25.37 8.83 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.491 1.119 . . . . 61.44 110.369 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -96.98 3.95 51.77 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.515 1.135 . . . . 65.11 110.299 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 19.5 t -97.26 174.27 6.8 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.545 1.153 . . . . 75.12 109.966 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -83.47 -32.89 25.77 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.54 1.15 . . . . 75.12 110.253 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -87.71 19.34 33.67 Favored Glycine 0 CA--C 1.529 0.941 0 O-C-N 124.568 1.167 . . . . 71.42 111.034 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 202' ' ' PHE . . . . . 0.615 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 0.1 OUTLIER -56.8 -43.42 99.36 Favored Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.454 0.738 . . . . 72.42 110.98 -179.971 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 203' ' ' PRO . . . . . 0.615 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.0 Cg_endo -75.02 -28.91 8.73 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.486 1.782 . . . . 63.21 110.964 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -64.69 -65.1 0.72 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.449 1.093 . . . . 60.34 110.405 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -50.38 -44.31 54.78 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.458 1.099 . . . . 71.42 110.318 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 206' ' ' VAL . . . . . 0.568 HG12 ' CE2' ' A' ' 104' ' ' PHE . 72.5 t -56.2 -29.44 27.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.453 1.096 . . . . 70.52 109.363 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -82.8 -51.54 7.57 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.517 1.136 . . . . 52.02 110.297 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 11.6 mpt_? -58.21 -62.52 1.77 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.543 1.152 . . . . 74.33 110.377 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 209' ' ' ILE . . . . . 0.531 ' O ' ' CE2' ' A' ' 134' ' ' TRP . 84.6 mt -49.85 -51.29 16.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.516 1.135 . . . . 72.42 109.306 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 210' ' ' PHE . . . . . 0.568 ' HA ' ' CH2' ' A' ' 134' ' ' TRP . 1.2 m-85 -101.49 61.71 0.92 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.494 1.121 . . . . 74.54 111.016 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.94 145.85 37.62 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.507 1.13 . . . . 73.02 110.334 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.452 ' O ' ' N ' ' A' ' 215' ' ' TYR . 32.4 tt0 -49.43 -55.02 14.55 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.506 1.129 . . . . 73.42 110.306 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.04 -23.59 1.24 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.495 1.122 . . . . 74.45 110.083 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 38.9 t -96.22 -27.49 4.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.538 1.149 . . . . 70.52 109.321 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 215' ' ' TYR . . . . . 0.452 ' N ' ' O ' ' A' ' 212' ' ' GLU . 3.4 t80 -63.87 -28.72 70.04 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.495 1.122 . . . . 75.23 111.01 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . 0.439 ' O ' ' N ' ' A' ' 220' ' ' THR . 64.2 mmtt -60.0 -65.28 0.71 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.547 1.154 . . . . 73.51 109.352 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 217' ' ' THR . . . . . 0.422 HG22 ' CD1' ' A' ' 221' ' ' ILE . 34.7 m -40.58 -62.94 0.7 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.546 1.154 . . . . 73.43 110.398 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 93.4 mm-40 -50.15 -63.31 1.15 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.52 1.137 . . . . 70.24 110.342 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 219' ' ' GLN . . . . . 0.409 ' NE2' ' HB3' ' A' ' 223' ' ' LYS . 34.1 tp60 -52.99 -20.2 3.24 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.561 1.163 . . . . 74.12 110.274 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 220' ' ' THR . . . . . 0.439 ' N ' ' O ' ' A' ' 216' ' ' LYS . 0.9 OUTLIER -87.49 -29.69 21.18 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.476 1.11 . . . . 74.44 110.435 -179.939 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 221' ' ' ILE . . . . . 0.422 ' CD1' HG22 ' A' ' 217' ' ' THR . 10.0 mt -78.86 -35.24 17.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.485 1.116 . . . . 72.15 109.305 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 222' ' ' TRP . . . . . 0.412 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 25.1 t90 -69.91 -55.0 10.86 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.492 1.12 . . . . 74.45 108.047 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . 0.409 ' HB3' ' NE2' ' A' ' 219' ' ' GLN . 0.0 OUTLIER -58.67 -22.03 55.9 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.467 1.104 . . . . 75.24 109.356 179.927 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 220' ' ' THR . 67.9 mt-10 -86.57 -36.73 18.73 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.539 1.149 . . . . 74.24 110.354 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 3.0 t -61.55 -20.57 63.41 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.52 1.138 . . . . 75.24 110.414 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 5.2 mtm180 -75.82 -24.73 55.87 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.514 1.134 . . . . 74.5 110.315 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 227' ' ' ASN . . . . . 0.447 ' O ' ' CG ' ' A' ' 231' ' ' ARG . 0.9 OUTLIER -78.41 -43.47 27.33 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.547 1.154 . . . . 74.0 109.286 179.992 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 43.9 mtm -58.28 -34.33 70.41 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.522 1.139 . . . . 75.45 110.999 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 229' ' ' VAL . . . . . 0.412 HG21 ' N ' ' A' ' 235' ' ' ALA . 25.0 t -75.81 -57.26 6.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.487 1.117 . . . . 75.51 109.362 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 230' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -60.32 -15.25 23.76 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.46 1.1 . . . . 70.32 110.272 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 231' ' ' ARG . . . . . 0.447 ' CG ' ' O ' ' A' ' 227' ' ' ASN . 34.1 mmm-85 -89.86 -89.61 0.15 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.492 1.12 . . . . 74.31 110.248 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 9.5 tm0? -134.85 62.03 1.66 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.462 1.102 . . . . 74.04 110.343 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 233' ' ' PHE . . . . . 0.436 ' C ' ' CD1' ' A' ' 234' ' ' ILE . 1.5 t80 -176.63 -176.36 0.72 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.561 1.163 . . . . 64.14 111.0 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . 0.473 ' CG2' ' N ' ' A' ' 235' ' ' ALA . 2.4 mp -134.71 162.79 38.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.504 1.127 . . . . 74.01 109.318 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 235' ' ' ALA . . . . . 0.473 ' N ' ' CG2' ' A' ' 234' ' ' ILE . . . . . . . . 0 C--N 1.325 -0.468 0 O-C-N 124.517 1.136 . . . . 73.52 109.292 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.036 0 N-CA-C 110.951 -0.86 . . . . 65.14 110.951 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.95 170.88 19.42 Favored 'Trans proline' 0 C--N 1.359 1.13 0 O-C-N 124.491 1.785 . . . . 75.14 110.993 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.68 -45.4 68.42 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 124.51 1.132 . . . . 75.31 109.31 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -164.97 61.05 0.24 Allowed Glycine 0 CA--C 1.531 1.033 0 O-C-N 124.468 1.105 . . . . 54.42 111.018 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -128.61 171.96 11.66 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.584 0.814 . . . . 72.52 109.985 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -92.64 145.95 24.03 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.478 1.111 . . . . 74.41 110.314 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -128.36 129.21 45.9 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.495 1.122 . . . . 71.12 110.285 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.502 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.3 p -127.15 165.69 25.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.42 1.075 . . . . 71.31 109.334 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.461 ' CD2' ' OH ' ' A' ' 215' ' ' TYR . 2.3 t80 -88.87 24.29 2.1 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.535 1.147 . . . . 74.2 111.046 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.453 HD11 ' CG2' ' A' ' 110' ' ' ILE . 3.6 tp -40.35 159.33 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.464 1.102 . . . . 75.33 109.302 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.457 ' NZ ' ' O ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -106.24 -49.42 3.36 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.47 1.106 . . . . 73.24 109.292 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.597 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -167.07 132.26 2.07 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.513 1.133 . . . . 74.54 110.968 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.52 ' CG2' ' CE ' ' A' ' 115' ' ' MET . 3.1 p -90.14 158.17 2.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.487 1.117 . . . . 50.12 109.293 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.439 HG13 ' CG1' ' A' ' 136' ' ' ILE . 5.0 mp -113.56 94.58 3.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 O-C-N 124.46 1.1 . . . . 62.02 109.276 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.474 HD21 ' CG ' ' A' ' 112' ' ' PHE . 5.0 mt -70.25 118.03 12.56 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.523 1.14 . . . . 73.44 109.362 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.469 ' HB3' ' CB ' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -136.62 173.74 11.38 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.532 1.145 . . . . 71.31 109.566 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -111.19 163.66 13.68 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.458 1.099 . . . . 72.21 109.291 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.415 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 10.3 tt0 -65.46 -10.7 36.45 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.562 1.164 . . . . 72.01 110.36 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -85.38 -44.89 12.39 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.501 1.126 . . . . 75.54 109.311 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -119.31 43.3 2.64 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.525 1.14 . . . . 73.35 109.364 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.421 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -71.84 -42.92 66.36 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.51 1.131 . . . . 71.34 110.358 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -64.49 -40.23 95.28 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.46 1.1 . . . . 62.53 109.277 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.408 ' CD ' ' C ' ' A' ' 92' ' ' GLU . 0.5 OUTLIER -53.28 -69.72 0.11 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.527 1.142 . . . . 75.24 110.298 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.469 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -43.03 -32.14 0.63 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.565 1.166 . . . . 74.3 109.329 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.5 -57.25 6.84 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.468 1.105 . . . . 74.21 109.27 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.11 -35.25 0.54 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.594 1.183 . . . . 73.02 110.355 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.46 HG22 ' CE ' ' A' ' 173' ' ' MET . 0.9 OUTLIER -79.31 -65.82 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 O-C-N 124.466 1.104 . . . . 72.21 109.307 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.442 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -42.21 -24.78 0.06 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.515 1.135 . . . . 74.34 110.329 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.448 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -74.32 -59.06 2.9 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.561 1.163 . . . . 74.02 109.306 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.509 ' O ' ' CB ' ' A' ' 103' ' ' ASP . 0.0 OUTLIER -62.47 -22.58 66.34 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.421 1.076 . . . . 73.43 109.271 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.443 ' CD2' HG13 ' A' ' 206' ' ' VAL . 39.0 mt -73.65 -39.21 64.64 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.533 1.146 . . . . 73.12 109.311 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.84 46.77 1.42 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.579 1.174 . . . . 71.22 110.318 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -175.8 -60.39 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.543 1.152 . . . . 72.32 109.253 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.509 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 49.0 t0 -40.45 -63.17 0.67 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.541 1.15 . . . . 73.23 109.324 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.568 ' CE2' HG11 ' A' ' 206' ' ' VAL . 4.9 m-85 -103.02 -14.62 16.38 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.465 1.103 . . . . 73.43 111.017 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.82 39.23 7.14 Favored Glycine 0 CA--C 1.53 1.009 0 O-C-N 124.514 1.134 . . . . 64.53 110.952 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.407 ' CG2' ' HD3' ' A' ' 80' ' ' LYS . 11.0 mm -75.57 72.21 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 O-C-N 124.516 0.774 . . . . 72.55 109.349 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.525 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -118.38 151.79 49.99 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.476 1.11 . . . . 74.04 109.363 179.996 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.525 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.0 147.46 89.33 Favored 'Cis proline' 0 C--N 1.36 1.169 0 C-N-CA 121.01 -2.496 . . . . 73.42 110.977 0.023 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -124.34 135.04 9.4 Favored Glycine 0 CA--C 1.531 1.068 0 O-C-N 124.431 1.082 . . . . 72.11 110.942 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.453 ' CG2' HD11 ' A' ' 79' ' ' LEU . 9.9 tt -156.94 153.94 6.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.499 0.764 . . . . 75.34 109.332 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 8.7 pt -95.98 -177.06 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.549 1.156 . . . . 65.43 109.319 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.474 ' CG ' HD21 ' A' ' 84' ' ' LEU . 5.4 t80 -80.92 -19.08 45.06 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.54 1.15 . . . . 63.15 110.959 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.434 ' HB2' ' CE1' ' A' ' 85' ' ' HIS . . . -91.6 -12.87 33.05 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.496 1.122 . . . . 62.43 109.294 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -97.62 -24.53 15.49 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.475 1.109 . . . . 72.22 110.324 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.52 ' CE ' ' CG2' ' A' ' 82' ' ' VAL . 7.4 ttm -46.03 143.93 3.2 Favored Pre-proline 0 C--N 1.324 -0.511 0 O-C-N 124.421 1.076 . . . . 73.34 111.007 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.01 71.46 5.0 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.527 1.804 . . . . 70.03 110.95 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -97.53 -43.38 7.26 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.484 1.115 . . . . 75.21 109.597 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 78.47 -68.24 2.98 Favored Glycine 0 CA--C 1.53 1.002 0 O-C-N 124.507 1.13 . . . . 72.32 111.044 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 64.3 mtp180 -47.28 171.02 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.533 0.784 . . . . 63.44 110.231 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -101.08 -68.24 0.82 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.523 1.14 . . . . 73.42 110.264 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -46.63 144.16 2.39 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.505 1.128 . . . . 75.41 109.577 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -104.46 138.37 40.94 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.476 1.11 . . . . 75.14 109.319 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -76.77 -65.12 0.98 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.536 1.148 . . . . 65.11 110.3 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -159.67 172.55 17.55 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.484 1.115 . . . . 74.42 109.315 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.36 -17.26 37.27 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.462 1.101 . . . . 74.35 109.323 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -67.86 -15.36 63.58 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.462 1.101 . . . . 75.22 109.284 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.407 ' O ' ' ND2' ' A' ' 130' ' ' ASN . 66.7 m-20 -62.3 -27.6 69.15 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.536 1.148 . . . . 74.15 109.402 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.465 ' CB ' ' HG ' ' A' ' 84' ' ' LEU . . . -93.14 -13.12 28.85 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.495 1.122 . . . . 75.24 109.352 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.5 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 71.1 t -92.86 30.44 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 124.593 1.183 . . . . 74.42 109.247 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.407 ' ND2' ' O ' ' A' ' 127' ' ' ASP . 28.3 p30 -135.81 151.18 49.81 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.553 1.158 . . . . 74.53 109.306 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 42.87 64.53 1.64 Allowed Glycine 0 CA--C 1.53 0.972 0 O-C-N 124.582 1.176 . . . . 64.13 111.005 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -163.61 -174.29 3.64 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.48 0.753 . . . . 63.32 109.96 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.568 ' HB2' ' CE3' ' A' ' 134' ' ' TRP . . . -113.71 -35.91 5.04 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.539 1.149 . . . . 73.23 109.302 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.575 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 0.6 OUTLIER -159.07 163.58 36.15 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.556 1.16 . . . . 73.5 108.039 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 28.4 p -131.42 135.47 47.19 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.532 1.145 . . . . 75.52 110.383 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.439 ' CG1' HG13 ' A' ' 83' ' ' ILE . 36.4 mm -84.31 136.99 21.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.485 1.116 . . . . 73.55 109.314 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 21.2 mt -129.7 99.08 5.01 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.582 1.176 . . . . 65.13 109.338 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.444 HD23 ' CB ' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.26 88.19 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.573 1.171 . . . . 72.45 109.295 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 18.6 mt -56.93 99.19 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.495 1.122 . . . . 71.44 109.322 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.46 ' O ' ' CB ' ' A' ' 144' ' ' LEU . 10.1 m -124.03 177.31 5.86 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.531 1.144 . . . . 72.44 110.458 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -80.32 -33.7 37.31 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.435 1.085 . . . . 74.25 110.23 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -89.58 -20.84 23.26 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.492 1.12 . . . . 65.05 109.334 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -89.8 -46.34 8.65 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.554 1.159 . . . . 71.4 111.078 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.495 ' C ' ' CD1' ' A' ' 144' ' ' LEU . 1.5 tm? -46.88 -61.08 2.02 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.469 1.106 . . . . 73.31 109.242 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 9.9 mmt85 -60.59 -20.69 61.28 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.488 1.117 . . . . 72.41 110.27 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -71.89 -66.43 0.64 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.568 1.167 . . . . 73.04 109.26 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.439 ' O ' ' N ' ' A' ' 150' ' ' ASN . 16.5 p -69.37 -54.52 14.03 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.457 1.098 . . . . 72.44 110.38 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.471 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 24.1 t-105 -42.17 -38.05 1.62 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.962 -1.125 . . . . 72.44 107.962 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . 0.446 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 53.3 t -79.02 -45.33 20.42 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.524 1.14 . . . . 71.12 108.295 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.439 ' N ' ' O ' ' A' ' 147' ' ' THR . 3.0 t30 -57.91 -17.78 18.88 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.484 1.115 . . . . 74.31 109.306 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.464 ' CD2' ' HE2' ' A' ' 158' ' ' MET . 9.7 m-30 -83.06 -46.35 12.93 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 75.41 111.004 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -49.21 -33.51 12.67 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.48 1.113 . . . . 73.21 110.287 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -97.29 -19.83 18.28 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.45 1.094 . . . . 75.12 111.023 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.47 ' CE1' ' CB ' ' A' ' 156' ' ' SER . 0.4 OUTLIER -128.59 94.94 3.99 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.535 1.147 . . . . 74.4 111.006 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' THR . . . . . 0.401 ' O ' ' N ' ' A' ' 158' ' ' MET . 3.5 t -64.53 -21.23 66.63 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.526 1.141 . . . . 75.15 110.355 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' SER . . . . . 0.47 ' CB ' ' CE1' ' A' ' 154' ' ' TYR . 18.8 t -40.13 -48.16 2.46 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.503 1.127 . . . . 64.4 109.997 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.29 -42.95 71.38 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.519 1.137 . . . . 73.45 109.323 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' MET . . . . . 0.464 ' HE2' ' CD2' ' A' ' 151' ' ' PHE . 24.9 mmt -55.2 -20.71 11.32 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.55 1.156 . . . . 72.41 110.982 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 20.1 m-80 -86.3 -30.78 22.0 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.623 1.202 . . . . 74.24 109.275 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -82.22 -17.48 45.93 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.518 1.136 . . . . 75.43 110.026 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . 0.497 ' O ' ' CD1' ' A' ' 192' ' ' ILE . 6.6 t -61.85 -30.6 48.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.48 1.113 . . . . 73.25 109.297 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . 0.482 ' O ' ' C ' ' A' ' 163' ' ' ARG . 15.5 t-20 -82.41 4.53 23.73 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.59 1.181 . . . . 75.41 109.263 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.482 ' C ' ' O ' ' A' ' 162' ' ' ASN . 0.0 OUTLIER 32.42 49.77 0.16 Allowed 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.498 1.124 . . . . 75.24 110.289 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -52.37 -173.74 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.508 1.13 . . . . 72.41 110.292 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -84.18 60.74 6.11 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.504 1.127 . . . . 72.14 109.528 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . 0.491 ' HG3' ' CD1' ' A' ' 167' ' ' TYR . 0.1 OUTLIER -121.51 157.66 30.17 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.544 1.152 . . . . 74.31 109.28 179.976 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' TYR . . . . . 0.592 ' CE1' ' OG1' ' A' ' 225' ' ' THR . 52.1 p90 -54.65 -47.17 73.87 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.54 1.15 . . . . 74.33 110.999 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.565 ' N ' ' CD2' ' A' ' 167' ' ' TYR . 12.7 p30 -87.07 126.18 34.6 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.439 1.087 . . . . 74.14 109.279 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' SER . . . . . 0.416 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 3.1 t -121.86 176.91 5.51 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.494 1.121 . . . . 55.12 110.011 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 3.2 t -134.16 117.26 24.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.464 1.103 . . . . 74.12 109.291 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.6 mp -128.13 97.45 29.04 Favored Pre-proline 0 C--N 1.325 -0.481 0 O-C-N 124.518 1.136 . . . . 74.51 109.252 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . 0.426 ' HG3' ' CD2' ' A' ' 189' ' ' LEU . 18.6 Cg_endo -74.95 107.1 2.4 Favored 'Trans proline' 0 C--N 1.359 1.126 0 O-C-N 124.51 1.795 . . . . 71.44 111.003 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' MET . . . . . 0.46 ' CE ' HG22 ' A' ' 96' ' ' VAL . 5.8 ttt -82.52 157.66 23.46 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.427 1.079 . . . . 72.05 110.982 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 29.4 mmm-85 -108.98 113.67 59.08 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.498 1.124 . . . . 74.11 110.314 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.99 146.39 32.61 Favored 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.451 1.764 . . . . 72.15 111.013 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . 0.561 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -82.32 -40.77 20.97 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.534 1.146 . . . . 73.54 109.251 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -72.18 -28.63 63.34 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 124.535 1.147 . . . . 72.24 109.293 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' ASN . . . . . 0.457 ' OD1' ' CG2' ' A' ' 140' ' ' THR . 4.7 m-80 -110.77 99.2 41.06 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.53 1.144 . . . . 73.41 109.255 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 135.49 19.15 Favored 'Trans proline' 0 C--N 1.359 1.111 0 O-C-N 124.449 1.763 . . . . 54.25 111.019 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . 0.475 ' CD1' ' OG1' ' A' ' 185' ' ' THR . 0.4 OUTLIER -141.2 96.99 7.0 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.463 1.102 . . . . 73.12 109.364 179.973 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.01 171.35 18.51 Favored 'Trans proline' 0 C--N 1.359 1.121 0 O-C-N 124.529 1.804 . . . . 62.5 110.978 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . 0.5 ' CG ' ' OE1' ' A' ' 190' ' ' GLN . 50.0 mtm-85 -62.74 -23.57 67.25 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.55 1.156 . . . . 75.55 110.305 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -72.02 -5.17 33.13 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.499 1.125 . . . . 60.51 110.279 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 -128.94 4.95 5.38 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.478 1.111 . . . . 65.33 110.274 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 185' ' ' THR . . . . . 0.475 ' OG1' ' CD1' ' A' ' 180' ' ' LEU . 51.5 m -110.97 143.8 29.05 Favored Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.49 1.119 . . . . 74.0 110.36 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . 0.446 ' HB3' ' CZ2' ' A' ' 148' ' ' TRP . 18.3 Cg_endo -75.05 146.91 33.03 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.556 1.819 . . . . 73.21 111.018 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 187' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -63.05 -11.49 19.79 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.447 1.092 . . . . 73.44 111.031 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -87.78 -54.03 4.46 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.51 1.131 . . . . 71.02 109.313 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.426 ' CD2' ' HG3' ' A' ' 172' ' ' PRO . 23.0 mt -73.31 -19.0 61.14 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.504 1.127 . . . . 74.15 109.311 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 190' ' ' GLN . . . . . 0.5 ' OE1' ' CG ' ' A' ' 182' ' ' ARG . 6.7 tt0 -84.84 -2.2 57.45 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.485 1.115 . . . . 64.11 110.297 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 191' ' ' THR . . . . . . . . . . . . . 41.2 p -126.38 1.83 7.0 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.509 1.13 . . . . 73.51 110.399 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.497 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 12.9 mt -94.25 163.94 2.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.547 1.154 . . . . 74.24 109.309 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 193' ' ' ASN . . . . . 0.491 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 58.8 t30 -78.07 57.53 1.81 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.52 1.138 . . . . 71.34 109.319 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.11 177.16 0.36 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.485 1.116 . . . . 73.32 109.324 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 195' ' ' LEU . . . . . 0.445 ' CD1' ' HE1' ' A' ' 173' ' ' MET . 0.2 OUTLIER -108.29 152.89 24.01 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.523 1.139 . . . . 64.52 109.26 -179.932 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . 0.418 ' N ' HD12 ' A' ' 195' ' ' LEU . 99.1 mt-10 -144.47 137.09 26.69 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.535 1.147 . . . . 72.12 110.341 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . 0.474 ' HG3' ' CD1' ' A' ' 176' ' ' LEU . 0.8 OUTLIER -111.06 -12.0 14.23 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.431 1.082 . . . . 74.3 110.29 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . 0.457 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 1.4 pt-20 -95.22 13.24 26.14 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.482 1.114 . . . . 64.31 110.318 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 1.7 t -118.18 164.96 14.39 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.541 1.151 . . . . 73.25 110.005 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -78.59 -26.5 45.49 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.51 1.131 . . . . 74.12 110.298 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -87.08 13.08 60.42 Favored Glycine 0 CA--C 1.53 1.009 0 O-C-N 124.45 1.094 . . . . 74.31 111.026 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 202' ' ' PHE . . . . . 0.592 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 0.0 OUTLIER -52.61 -45.74 96.04 Favored Pre-proline 0 C--N 1.325 -0.458 0 O-C-N 124.423 0.72 . . . . 75.24 110.986 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 203' ' ' PRO . . . . . 0.592 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.2 Cg_endo -74.97 -34.8 3.58 Favored 'Trans proline' 0 C--N 1.359 1.116 0 O-C-N 124.562 1.822 . . . . 62.33 111.014 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -57.45 -56.0 27.47 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.448 1.092 . . . . 64.43 110.358 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -63.61 -36.65 84.51 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.467 1.104 . . . . 74.51 110.33 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 206' ' ' VAL . . . . . 0.568 HG11 ' CE2' ' A' ' 104' ' ' PHE . 37.7 t -63.86 -37.09 78.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 O-C-N 124.491 1.119 . . . . 74.4 109.329 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 207' ' ' GLU . . . . . 0.435 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 4.3 mt-10 -69.68 -49.49 53.01 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.545 1.153 . . . . 72.33 110.305 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 80.0 mtt-85 -67.21 -66.25 0.58 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.476 1.11 . . . . 70.24 110.271 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 209' ' ' ILE . . . . . 0.58 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 45.4 mt -43.46 -57.78 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.53 1.144 . . . . 71.15 109.309 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 210' ' ' PHE . . . . . 0.58 ' CE1' ' CG2' ' A' ' 209' ' ' ILE . 3.2 m-85 -102.53 69.45 1.1 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.54 1.15 . . . . 72.03 110.967 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 211' ' ' GLN . . . . . 0.435 ' CB ' ' O ' ' A' ' 207' ' ' GLU . 0.0 OUTLIER -110.83 143.26 41.69 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.457 1.098 . . . . 71.23 110.3 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.454 ' O ' ' N ' ' A' ' 215' ' ' TYR . 29.2 tt0 -50.09 -53.74 25.21 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.541 1.15 . . . . 71.22 110.246 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -48.56 -23.53 1.02 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.482 1.114 . . . . 74.22 109.983 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 20.4 t -95.14 -29.56 4.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 O-C-N 124.499 1.124 . . . . 72.14 109.26 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 215' ' ' TYR . . . . . 0.461 ' OH ' ' CD2' ' A' ' 78' ' ' PHE . 9.4 t80 -61.92 -19.01 62.25 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.476 1.11 . . . . 74.41 111.039 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 16.5 mmmt -76.13 -44.52 38.06 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.539 1.149 . . . . 75.12 109.245 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 74.7 m -59.63 -66.43 0.51 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.5 1.125 . . . . 44.01 110.445 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 218' ' ' GLN . . . . . 0.425 ' NE2' ' N ' ' A' ' 218' ' ' GLN . 0.0 OUTLIER -51.34 -28.31 12.01 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.486 1.117 . . . . 73.2 110.32 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 33.3 tp60 -67.96 -55.57 12.25 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.54 1.15 . . . . 74.5 110.263 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.6 m -62.31 -36.4 82.05 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.534 1.146 . . . . 63.31 110.392 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 221' ' ' ILE . . . . . 0.414 HG22 ' N ' ' A' ' 167' ' ' TYR . 20.3 mt -66.87 -18.91 24.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.519 1.137 . . . . 74.23 109.302 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 222' ' ' TRP . . . . . 0.502 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 11.8 t90 -69.89 -64.68 0.84 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.517 1.135 . . . . 71.22 107.958 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . 0.451 ' NZ ' ' CB ' ' A' ' 223' ' ' LYS . 0.0 OUTLIER -54.14 -31.21 51.81 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.509 1.13 . . . . 73.21 109.247 -179.942 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.81 -42.64 70.01 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.498 1.124 . . . . 75.41 110.301 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 225' ' ' THR . . . . . 0.592 ' OG1' ' CE1' ' A' ' 167' ' ' TYR . 5.4 t -57.3 -23.77 50.66 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.523 1.139 . . . . 74.25 110.405 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 226' ' ' ARG . . . . . 0.416 ' N ' HG22 ' A' ' 225' ' ' THR . 16.8 mtm180 -77.62 -22.48 50.71 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.485 1.116 . . . . 72.51 110.342 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 227' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -85.12 -35.56 21.7 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.471 1.107 . . . . 74.31 109.294 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 228' ' ' MET . . . . . 0.427 ' CE ' ' HA ' ' A' ' 225' ' ' THR . 55.1 mtm -60.68 -45.2 95.08 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.51 1.131 . . . . 63.22 110.993 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 229' ' ' VAL . . . . . . . . . . . . . 31.0 m -63.77 -49.4 82.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.529 1.143 . . . . 75.15 109.323 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 230' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -71.39 -6.67 41.94 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.497 1.123 . . . . 73.53 110.3 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 17.9 ttt85 -90.98 -85.72 0.22 Allowed 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.558 1.161 . . . . 73.13 110.239 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 6.0 tm0? -138.98 39.12 2.14 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.597 1.186 . . . . 74.25 110.269 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -151.52 37.68 0.6 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.474 1.109 . . . . 73.41 111.012 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 5.8 mm -47.87 140.67 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.492 1.12 . . . . 71.13 109.358 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.481 0 O-C-N 124.559 1.162 . . . . 73.43 109.349 179.975 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.001 0 N-CA-C 110.988 -0.845 . . . . 61.0 110.988 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.9 141.86 27.47 Favored 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.494 1.787 . . . . 55.22 111.04 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.1 128.78 46.12 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.501 1.126 . . . . 74.25 109.327 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 42.09 73.77 0.2 Allowed Glycine 0 CA--C 1.53 0.983 0 O-C-N 124.548 1.155 . . . . 74.44 111.02 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.7 p -123.34 131.63 53.72 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.485 0.756 . . . . 71.24 110.042 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.401 ' HG3' ' N ' ' A' ' 76' ' ' GLU . 50.1 tp10 -81.88 152.64 26.75 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.514 1.134 . . . . 72.24 110.313 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.476 ' OE2' ' CH2' ' A' ' 222' ' ' TRP . 0.1 OUTLIER -124.27 157.06 35.79 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.476 1.11 . . . . 74.25 110.296 -179.986 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.444 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 2.4 p -179.83 151.05 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.418 1.074 . . . . 73.44 109.295 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.552 ' CE2' ' HD3' ' A' ' 108' ' ' PRO . 48.2 p90 -96.22 40.33 1.13 Allowed 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.556 1.16 . . . . 74.01 111.003 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 78' ' ' PHE . 3.0 tp -39.97 133.82 1.59 Allowed 'General case' 0 C--N 1.323 -0.553 0 O-C-N 124.52 1.138 . . . . 65.33 109.258 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.495 ' NZ ' ' CG2' ' A' ' 106' ' ' ILE . 9.2 mmmm -57.04 -66.35 0.47 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.483 1.114 . . . . 75.35 109.317 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.422 ' CE2' HG13 ' A' ' 83' ' ' ILE . 2.2 p90 -166.32 179.81 5.43 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.585 1.178 . . . . 72.13 111.001 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.474 ' CG2' ' HE1' ' A' ' 115' ' ' MET . 0.8 OUTLIER -111.73 149.91 14.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.433 1.083 . . . . 73.14 109.318 179.999 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.447 HG13 ' CG1' ' A' ' 136' ' ' ILE . 4.9 mp -121.2 89.51 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.533 1.145 . . . . 72.42 109.252 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.572 HD22 ' CD1' ' A' ' 112' ' ' PHE . 6.2 mt -70.24 121.79 18.27 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.568 1.168 . . . . 75.22 109.35 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.576 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -144.14 174.64 10.7 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.541 1.151 . . . . 75.21 109.552 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -111.99 164.35 13.23 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.474 1.109 . . . . 70.15 109.279 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -63.04 -12.27 25.19 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.502 1.126 . . . . 73.52 110.244 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -82.33 -46.12 14.02 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.481 1.113 . . . . 64.44 109.273 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -120.71 44.33 2.52 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.452 1.095 . . . . 71.43 109.293 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.576 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -76.85 -25.66 53.41 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.457 1.098 . . . . 74.51 110.347 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -85.79 -21.75 28.01 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.453 1.096 . . . . 72.35 109.314 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -73.18 -45.67 55.11 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.56 1.163 . . . . 75.51 110.338 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.471 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -70.14 -31.43 68.93 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.464 1.103 . . . . 74.21 109.352 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.485 ' CD2' ' C ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -73.1 -52.82 12.84 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.51 1.131 . . . . 74.52 109.311 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.23 -37.25 2.07 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.46 1.1 . . . . 73.21 110.328 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.454 ' C ' ' N ' ' A' ' 98' ' ' ASN . 2.3 t -73.42 -64.76 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.512 1.133 . . . . 72.24 109.315 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.435 ' N ' HG11 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -40.6 -26.86 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.53 1.144 . . . . 64.43 110.319 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.454 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.0 OUTLIER -73.21 -60.18 2.36 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.521 1.138 . . . . 71.23 109.287 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.519 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -62.61 -22.11 66.16 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.504 1.127 . . . . 74.02 109.282 179.995 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.459 ' CD2' HG13 ' A' ' 206' ' ' VAL . 28.5 mt -67.75 -43.23 80.35 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.415 1.072 . . . . 72.51 109.272 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -86.41 46.73 1.38 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.567 1.167 . . . . 64.41 110.272 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -166.68 -63.74 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.574 1.171 . . . . 72.0 109.247 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.551 ' OD1' ' CE2' ' A' ' 104' ' ' PHE . 22.4 t70 -46.55 -46.46 19.38 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.55 1.156 . . . . 74.3 109.297 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.576 ' CZ ' HG11 ' A' ' 206' ' ' VAL . 0.4 OUTLIER -116.26 -31.87 5.5 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.514 1.134 . . . . 75.44 110.96 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.444 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 100.73 44.63 2.07 Favored Glycine 0 CA--C 1.531 1.049 0 O-C-N 124.519 1.137 . . . . 74.13 110.986 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.495 ' CG2' ' NZ ' ' A' ' 80' ' ' LYS . 6.1 mm -84.95 70.11 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.556 0.798 . . . . 74.22 109.308 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.508 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -120.92 155.48 57.52 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.468 1.105 . . . . 74.43 109.272 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.552 ' HD3' ' CE2' ' A' ' 78' ' ' PHE . 18.1 Cg_endo -74.97 160.76 96.07 Favored 'Cis proline' 0 C--N 1.36 1.176 0 C-N-CA 120.927 -2.53 . . . . 74.14 111.022 -0.052 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -136.56 137.11 8.81 Favored Glycine 0 CA--C 1.53 0.985 0 O-C-N 124.498 1.124 . . . . 65.41 111.028 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 2.5 tt -148.2 152.09 12.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.529 0.782 . . . . 73.55 109.263 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 40.9 pt -101.22 167.33 2.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.426 1.079 . . . . 72.33 109.31 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.572 ' CD1' HD22 ' A' ' 84' ' ' LEU . 2.7 t80 -66.88 -19.24 65.7 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.481 1.113 . . . . 63.24 111.0 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -90.69 -6.64 54.23 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.552 1.157 . . . . 73.11 109.324 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -110.64 -5.91 14.95 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.495 1.122 . . . . 72.3 110.3 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.474 ' HE1' ' CG2' ' A' ' 82' ' ' VAL . 10.8 ttm -61.4 110.94 3.54 Favored Pre-proline 0 C--N 1.325 -0.457 0 O-C-N 124.456 1.097 . . . . 74.43 110.958 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.95 70.52 5.23 Favored 'Trans proline' 0 C--N 1.359 1.128 0 O-C-N 124.497 1.788 . . . . 52.24 111.0 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 17.7 p-80 -79.82 -44.54 20.37 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.403 1.064 . . . . 75.33 109.546 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 109.42 -110.3 2.93 Favored Glycine 0 CA--C 1.531 1.033 0 O-C-N 124.424 1.078 . . . . 72.21 110.957 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -106.37 -9.72 16.63 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.496 0.762 . . . . 72.01 110.307 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -61.54 165.48 4.86 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.409 1.068 . . . . 60.24 110.283 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -84.46 126.18 33.04 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.544 1.153 . . . . 71.52 109.583 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.497 HD13 ' CD2' ' A' ' 112' ' ' PHE . 0.3 OUTLIER -79.79 -23.41 42.16 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.479 1.112 . . . . 71.23 109.262 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 21.1 mp0 -38.93 -33.75 0.13 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.455 1.097 . . . . 74.0 110.274 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 18.6 m-20 -56.31 98.16 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.551 1.157 . . . . 74.51 109.336 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.453 ' CD1' HD23 ' A' ' 157' ' ' LEU . 4.2 pp -83.55 -17.36 42.06 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.401 1.063 . . . . 74.42 109.303 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.44 ' O ' ' N ' ' A' ' 129' ' ' VAL . 11.9 p-10 -63.85 -42.34 97.61 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.494 1.121 . . . . 70.03 109.313 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -48.98 -32.92 9.98 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.509 1.131 . . . . 74.04 109.307 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.459 ' CB ' HG11 ' A' ' 82' ' ' VAL . . . -68.44 -36.2 78.7 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.522 1.138 . . . . 72.32 109.311 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.494 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 53.9 t -89.12 14.2 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.478 1.111 . . . . 75.04 109.29 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -129.27 120.84 26.39 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.544 1.153 . . . . 71.15 109.265 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 88.2 -20.12 31.41 Favored Glycine 0 CA--C 1.53 0.973 0 O-C-N 124.506 1.129 . . . . 74.25 110.994 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 39.2 m -87.95 151.67 22.63 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.522 0.777 . . . . 62.43 110.027 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.536 ' O ' ' CG ' ' A' ' 134' ' ' TRP . . . -94.44 -9.69 34.76 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.454 1.096 . . . . 73.21 109.308 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.578 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 9.7 m-90 -161.91 173.7 14.14 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.524 1.14 . . . . 74.24 107.981 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 82' ' ' VAL . 11.8 p -153.29 131.26 11.76 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 124.528 1.143 . . . . 75.55 110.436 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.447 ' CG1' HG13 ' A' ' 83' ' ' ILE . 21.5 mm -93.21 134.62 30.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 124.552 1.158 . . . . 64.01 109.292 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 5.2 mt -113.64 85.49 2.21 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.499 1.124 . . . . 72.04 109.263 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.593 ' O ' ' CD1' ' A' ' 143' ' ' PHE . 1.8 tp -62.65 90.14 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.575 1.172 . . . . 74.32 109.33 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.409 HD11 ' CD1' ' A' ' 189' ' ' LEU . 0.7 OUTLIER -70.44 116.69 11.06 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.541 1.15 . . . . 55.24 109.272 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.456 ' HB ' ' CB ' ' A' ' 143' ' ' PHE . 6.8 m -139.22 157.87 45.17 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.43 1.082 . . . . 75.44 110.352 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -50.24 -40.96 49.23 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.477 1.111 . . . . 71.3 110.271 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -89.27 -52.18 5.19 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.509 1.13 . . . . 73.15 109.337 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.608 ' CE1' ' CG2' ' A' ' 147' ' ' THR . 29.0 t80 -52.18 -20.16 2.42 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.483 1.114 . . . . 75.31 111.018 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.467 ' C ' ' CD1' ' A' ' 144' ' ' LEU . 1.9 tm? -72.14 -67.54 0.53 Allowed 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.518 1.136 . . . . 75.24 109.282 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.445 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 25.4 mmm180 -52.75 -23.1 6.11 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.59 1.181 . . . . 74.42 110.302 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -75.69 -73.11 0.28 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.521 1.138 . . . . 65.53 109.265 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.608 ' CG2' ' CE1' ' A' ' 143' ' ' PHE . 47.2 p -57.42 -56.18 25.24 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.428 1.08 . . . . 64.14 110.403 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.493 ' CH2' ' HB3' ' A' ' 186' ' ' PRO . 4.6 t-105 -43.9 -42.2 5.67 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.558 1.161 . . . . 73.41 108.01 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . 0.445 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 12.6 t -67.88 -45.4 74.58 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.486 1.116 . . . . 51.4 108.279 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.454 ' N ' ' O ' ' A' ' 147' ' ' THR . 34.2 m-20 -52.23 -61.96 1.94 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.5 1.125 . . . . 75.3 109.309 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.686 ' CE1' ' CD1' ' A' ' 157' ' ' LEU . 9.8 m-30 -38.46 -45.88 1.09 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.437 1.086 . . . . 74.13 110.971 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.27 -48.84 45.66 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.544 1.153 . . . . 65.42 110.31 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -88.06 -11.72 46.34 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.538 1.148 . . . . 73.53 111.041 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.4 ' N ' ' O ' ' A' ' 150' ' ' ASN . 3.2 m-30 -116.67 77.36 1.1 Allowed 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.437 1.086 . . . . 74.44 110.995 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' THR . . . . . 0.444 ' O ' ' ND2' ' A' ' 159' ' ' ASN . 1.1 t -61.82 -13.41 23.71 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.538 1.149 . . . . 73.32 110.448 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 13.1 m -71.53 -32.26 67.96 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.461 1.1 . . . . 74.34 110.017 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.686 ' CD1' ' CE1' ' A' ' 151' ' ' PHE . 0.4 OUTLIER -74.1 -47.21 37.86 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.566 1.166 . . . . 75.4 109.322 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' MET . . . . . 0.426 ' CE ' HG23 ' A' ' 161' ' ' VAL . 1.9 tpt -48.76 -23.01 0.91 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.485 1.115 . . . . 74.42 111.083 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' ASN . . . . . 0.513 ' N ' HD21 ' A' ' 159' ' ' ASN . 1.5 m-80 -77.84 -42.79 32.41 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.528 1.143 . . . . 71.25 109.271 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.16 -22.79 67.1 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.484 1.115 . . . . 74.03 110.011 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . 0.426 HG23 ' CE ' ' A' ' 158' ' ' MET . 41.9 t -57.41 -17.87 7.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.489 1.118 . . . . 74.23 109.315 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -90.96 21.5 4.16 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.621 1.201 . . . . 74.42 109.288 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.483 ' CD ' ' O ' ' A' ' 170' ' ' VAL . 0.0 OUTLIER 46.6 37.12 4.16 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.5 1.125 . . . . 75.03 110.327 -179.94 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' A' ' 163' ' ' ARG . 5.0 mt-30 -38.3 131.31 1.19 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.483 1.114 . . . . 73.23 110.295 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 12.6 m170 -90.1 57.4 3.76 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.518 1.136 . . . . 75.51 109.587 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . 0.603 ' O ' ' CD1' ' A' ' 167' ' ' TYR . 0.0 OUTLIER -118.25 89.7 3.18 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.534 1.146 . . . . 73.31 109.24 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' TYR . . . . . 0.603 ' CD1' ' O ' ' A' ' 166' ' ' LYS . 12.7 p90 36.61 32.98 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.571 1.17 . . . . 75.2 111.047 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.439 ' ND2' ' O ' ' A' ' 129' ' ' VAL . 27.0 p30 178.48 156.97 0.45 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.548 1.155 . . . . 75.02 109.277 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' SER . . . . . 0.402 ' O ' ' OG1' ' A' ' 135' ' ' THR . 0.4 OUTLIER -140.05 176.99 8.29 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.494 1.121 . . . . 71.14 109.969 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.483 ' O ' ' CD ' ' A' ' 163' ' ' ARG . 65.3 t -131.34 120.57 46.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.563 1.164 . . . . 72.55 109.272 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.3 mp -136.37 105.42 9.31 Favored Pre-proline 0 C--N 1.325 -0.468 0 O-C-N 124.497 1.123 . . . . 70.42 109.359 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . 0.509 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.5 Cg_endo -74.95 112.96 3.68 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.507 1.793 . . . . 72.33 111.041 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 5.7 ttt -89.16 160.67 16.87 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.576 1.173 . . . . 74.4 110.96 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.48 119.05 27.35 Favored Pre-proline 0 C--N 1.325 -0.48 0 O-C-N 124.531 1.144 . . . . 74.33 110.296 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.05 155.05 42.68 Favored 'Trans proline' 0 C--N 1.36 1.142 0 O-C-N 124.5 1.79 . . . . 71.11 110.983 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . 0.508 ' CD2' ' CG ' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -98.18 -36.87 9.91 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.584 1.177 . . . . 75.12 109.319 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . 0.533 HD21 ' N ' ' A' ' 177' ' ' ASN . 1.1 m-80 -72.68 -23.02 60.83 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.504 1.127 . . . . 53.2 109.278 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -110.35 113.09 56.61 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.409 1.068 . . . . 71.1 109.292 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.05 115.02 4.16 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.536 1.808 . . . . 63.14 110.958 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . 0.461 HD23 ' CB ' ' A' ' 184' ' ' ARG . 0.8 OUTLIER -132.86 96.62 17.88 Favored Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.537 1.148 . . . . 71.22 109.342 179.939 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.98 164.21 33.83 Favored 'Trans proline' 0 C--N 1.361 1.203 0 O-C-N 124.455 1.766 . . . . 52.22 111.025 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . 0.425 ' HG3' ' N ' ' A' ' 183' ' ' GLU . 0.7 OUTLIER -51.88 -35.16 44.16 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.446 1.091 . . . . 74.42 110.329 -179.985 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . 0.425 ' N ' ' HG3' ' A' ' 182' ' ' ARG . 4.7 pt-20 -56.8 -32.01 65.25 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.54 1.15 . . . . 55.14 110.324 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 184' ' ' ARG . . . . . 0.461 ' CB ' HD23 ' A' ' 180' ' ' LEU . 5.7 mmp_? -87.96 -28.6 21.37 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.476 1.11 . . . . 75.54 110.236 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 185' ' ' THR . . . . . 0.412 ' HA ' ' HD3' ' A' ' 186' ' ' PRO . 21.2 m -77.27 144.03 70.3 Favored Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.477 1.111 . . . . 75.23 110.454 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . 0.493 ' HB3' ' CH2' ' A' ' 148' ' ' TRP . 18.3 Cg_endo -74.93 152.33 41.0 Favored 'Trans proline' 0 C--N 1.36 1.167 0 O-C-N 124.508 1.793 . . . . 64.2 111.02 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 187' ' ' PHE . . . . . 0.483 ' O ' ' CG2' ' A' ' 191' ' ' THR . 13.2 p90 -68.22 -6.79 25.48 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.517 1.135 . . . . 72.41 111.0 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.75 -53.84 3.86 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.528 1.143 . . . . 72.04 109.267 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.477 ' CD2' ' HG3' ' A' ' 172' ' ' PRO . 49.3 mt -68.5 -42.21 78.91 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.455 1.097 . . . . 74.01 109.306 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -63.31 -11.5 22.52 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.5 1.125 . . . . 74.24 110.293 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 191' ' ' THR . . . . . 0.483 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 32.5 p -112.67 2.4 16.1 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.49 1.118 . . . . 74.12 110.353 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.49 ' CG2' ' N ' ' A' ' 193' ' ' ASN . 30.9 mt -105.31 163.36 4.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.461 1.101 . . . . 74.32 109.36 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 193' ' ' ASN . . . . . 0.49 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 22.7 p30 -66.8 74.78 0.11 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.507 1.129 . . . . 74.01 109.301 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . 0.509 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -70.04 156.36 39.27 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.557 1.16 . . . . 74.04 109.342 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 195' ' ' LEU . . . . . 0.463 HD23 ' CD1' ' A' ' 209' ' ' ILE . 0.3 OUTLIER -95.83 127.58 41.98 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.474 1.109 . . . . 75.51 109.256 -179.967 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . 0.402 ' HB3' ' CB ' ' A' ' 199' ' ' SER . 45.3 mt-10 -108.42 130.42 55.24 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.543 1.152 . . . . 73.41 110.292 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . 0.508 ' CG ' ' CD2' ' A' ' 176' ' ' LEU . 25.2 tp10 -100.53 -23.14 14.77 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.509 1.131 . . . . 72.52 110.305 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . 0.424 ' N ' HD12 ' A' ' 176' ' ' LEU . 0.4 OUTLIER -104.95 15.33 27.91 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.527 1.142 . . . . 74.41 110.292 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 199' ' ' SER . . . . . 0.402 ' CB ' ' HB3' ' A' ' 196' ' ' GLU . 40.2 t -104.54 139.78 38.94 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.437 1.086 . . . . 73.22 110.023 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 21.5 ttp180 -59.47 -15.34 16.86 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.538 1.149 . . . . 75.32 110.315 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -102.89 17.61 52.15 Favored Glycine 0 CA--C 1.531 1.047 0 O-C-N 124.543 1.152 . . . . 72.2 110.928 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 202' ' ' PHE . . . . . 0.601 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 0.1 OUTLIER -54.16 -44.49 98.58 Favored Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.535 0.785 . . . . 65.21 111.019 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 203' ' ' PRO . . . . . 0.601 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.2 Cg_endo -74.99 -34.98 3.42 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.542 1.811 . . . . 75.21 110.994 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.98 -51.03 70.86 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.538 1.149 . . . . 61.35 110.411 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 205' ' ' GLN . . . . . 0.401 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 6.2 mt-30 -69.53 -33.04 72.23 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.495 1.122 . . . . 71.51 110.3 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 206' ' ' VAL . . . . . 0.576 HG11 ' CZ ' ' A' ' 104' ' ' PHE . 50.5 t -70.28 -29.68 40.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.564 1.165 . . . . 61.12 109.287 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 207' ' ' GLU . . . . . 0.504 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 3.9 mt-10 -77.92 -36.67 49.16 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.544 1.152 . . . . 74.11 110.335 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -78.79 -62.93 1.54 Allowed 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.459 1.099 . . . . 72.24 110.279 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 209' ' ' ILE . . . . . 0.559 HG22 ' CD1' ' A' ' 210' ' ' PHE . 81.3 mt -47.83 -61.13 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.443 1.09 . . . . 73.44 109.325 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 210' ' ' PHE . . . . . 0.578 ' HA ' ' CH2' ' A' ' 134' ' ' TRP . 3.9 m-85 -97.42 67.36 2.09 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.519 1.137 . . . . 75.34 111.012 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 211' ' ' GLN . . . . . 0.504 ' CB ' ' O ' ' A' ' 207' ' ' GLU . 0.0 OUTLIER -110.98 141.09 44.92 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.502 1.126 . . . . 75.34 110.372 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.454 ' O ' ' N ' ' A' ' 215' ' ' TYR . 25.6 tt0 -51.97 -51.52 56.63 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.528 1.142 . . . . 74.45 110.255 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.42 -23.16 0.85 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.443 1.09 . . . . 75.53 109.943 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.413 ' O ' ' NE2' ' A' ' 218' ' ' GLN . 17.4 t -95.47 -30.19 4.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 O-C-N 124.603 1.189 . . . . 73.03 109.301 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 215' ' ' TYR . . . . . 0.454 ' N ' ' O ' ' A' ' 212' ' ' GLU . 13.7 t80 -64.64 -20.37 66.25 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.586 1.178 . . . . 74.32 111.025 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 4.8 mmpt? -69.37 -54.88 12.27 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.468 1.105 . . . . 72.3 109.305 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 217' ' ' THR . . . . . 0.434 ' CG2' HD11 ' A' ' 221' ' ' ILE . 2.2 m -49.13 -67.52 0.26 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.506 1.129 . . . . 74.24 110.409 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 218' ' ' GLN . . . . . 0.488 ' HA ' ' CD1' ' A' ' 221' ' ' ILE . 0.0 OUTLIER -50.32 -43.64 53.86 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.493 1.12 . . . . 75.34 110.252 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 219' ' ' GLN . . . . . 0.402 ' CB ' ' O ' ' A' ' 215' ' ' TYR . 38.2 tp60 -52.3 -37.87 56.92 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.505 1.128 . . . . 73.41 110.284 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 22.7 m -79.6 -35.17 40.0 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.429 1.081 . . . . 73.04 110.381 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 221' ' ' ILE . . . . . 0.488 ' CD1' ' HA ' ' A' ' 218' ' ' GLN . 10.9 mt -66.03 -27.24 40.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 O-C-N 124.443 1.09 . . . . 74.12 109.32 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 222' ' ' TRP . . . . . 0.476 ' CH2' ' OE2' ' A' ' 76' ' ' GLU . 24.1 t90 -89.11 -49.18 6.9 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.498 1.124 . . . . 75.44 107.991 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . 0.462 ' C ' ' CD ' ' A' ' 223' ' ' LYS . 0.0 OUTLIER -60.47 -16.77 39.91 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.532 1.145 . . . . 74.51 109.283 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -93.13 -35.4 13.2 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.554 1.159 . . . . 61.13 110.309 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 3.3 t -65.96 -16.09 63.58 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.483 1.114 . . . . 74.25 110.412 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 10.7 mtm180 -72.85 -14.72 61.56 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.503 1.127 . . . . 71.04 110.269 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 227' ' ' ASN . . . . . 0.44 ' O ' ' N ' ' A' ' 231' ' ' ARG . 1.1 m-80 -85.4 -64.41 1.16 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.498 1.124 . . . . 73.32 109.301 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 17.4 ptp -38.41 -42.79 0.76 Allowed 'General case' 0 C--N 1.323 -0.549 0 O-C-N 124.553 1.158 . . . . 75.23 110.988 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 229' ' ' VAL . . . . . 0.403 ' CG2' ' N ' ' A' ' 230' ' ' GLN . 19.6 m -67.15 -50.33 64.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.545 1.153 . . . . 74.51 109.296 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 230' ' ' GLN . . . . . 0.408 ' N ' ' O ' ' A' ' 227' ' ' ASN . 2.2 tp-100 -70.32 -6.62 36.44 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.503 1.127 . . . . 75.31 110.272 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 231' ' ' ARG . . . . . 0.44 ' N ' ' O ' ' A' ' 227' ' ' ASN . 14.9 tpt180 -95.9 -79.82 0.43 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.528 1.143 . . . . 75.05 110.254 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -146.25 53.37 1.13 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.501 1.126 . . . . 74.34 110.268 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -165.73 -173.12 2.6 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.503 1.127 . . . . 72.1 111.064 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 7.5 mm -138.55 161.18 30.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.469 1.106 . . . . 75.24 109.308 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.47 0 O-C-N 124.542 1.151 . . . . 75.31 109.288 179.99 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.006 0 N-CA-C 111.018 -0.833 . . . . 61.53 111.018 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.97 145.04 31.07 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.536 1.809 . . . . 72.23 111.039 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -110.5 121.58 45.65 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.393 1.058 . . . . 72.31 109.278 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 71.21 59.15 5.15 Favored Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.501 1.126 . . . . 61.22 110.975 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.424 ' OG ' ' N ' ' A' ' 75' ' ' GLU . 0.8 OUTLIER -119.53 175.16 5.98 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.455 0.738 . . . . 75.25 110.027 179.976 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.424 ' N ' ' OG ' ' A' ' 74' ' ' SER . 10.2 tt0 -39.07 149.42 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.535 1.147 . . . . 73.44 110.3 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -140.54 127.85 21.15 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.468 1.105 . . . . 74.01 110.325 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.427 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 5.3 p -140.37 160.03 25.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 O-C-N 124.452 1.095 . . . . 74.42 109.303 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.519 ' CE2' ' OH ' ' A' ' 215' ' ' TYR . 5.6 t80 -88.68 24.82 1.89 Allowed 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.481 1.113 . . . . 74.33 111.004 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.407 ' C ' ' O ' ' A' ' 78' ' ' PHE . 3.2 tp -39.5 143.14 0.23 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.486 1.116 . . . . 74.41 109.269 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.501 ' O ' ' CB ' ' A' ' 133' ' ' ALA . 8.2 ttmt -79.03 -62.3 1.74 Allowed 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.522 1.139 . . . . 62.43 109.249 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.607 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -165.47 140.09 4.87 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.563 1.164 . . . . 75.14 110.979 179.97 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.468 ' CG2' ' HE3' ' A' ' 115' ' ' MET . 7.5 p -90.69 167.49 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 O-C-N 124.428 1.08 . . . . 65.23 109.313 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.496 HD13 ' CZ ' ' A' ' 81' ' ' PHE . 3.8 mp -132.64 92.0 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.47 1.106 . . . . 72.03 109.33 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.465 ' CD1' ' HB3' ' A' ' 128' ' ' ALA . 5.9 mp -70.16 113.22 7.13 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.454 1.096 . . . . 73.32 109.304 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.568 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -128.44 174.39 9.39 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.465 1.103 . . . . 74.1 109.661 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -113.24 162.47 15.98 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.538 1.149 . . . . 72.53 109.309 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -64.31 -11.33 31.02 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.541 1.151 . . . . 61.01 110.374 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -81.68 -45.95 15.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.482 1.114 . . . . 74.44 109.284 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -124.58 44.21 2.82 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.441 1.088 . . . . 64.02 109.265 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.568 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -75.54 -33.89 60.71 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.456 1.098 . . . . 75.3 110.383 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -79.01 -17.21 55.75 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.537 1.148 . . . . 74.15 109.354 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -79.39 -54.04 6.32 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.548 1.155 . . . . 72.4 110.302 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.46 ' CB ' HD21 ' A' ' 138' ' ' LEU . . . -65.16 -19.75 66.12 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.473 1.108 . . . . 73.41 109.251 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.96 -51.89 5.57 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.573 1.17 . . . . 71.04 109.264 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -45.27 -33.32 2.33 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.514 1.133 . . . . 72.52 110.334 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.466 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 10.7 p -82.77 -55.89 6.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.516 1.135 . . . . 74.43 109.295 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.466 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -48.24 -22.12 0.61 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.466 1.104 . . . . 73.23 110.339 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -77.21 -38.61 51.03 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.466 1.104 . . . . 74.24 109.334 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.488 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -83.08 -21.99 33.57 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.473 1.108 . . . . 72.52 109.263 -179.98 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.442 ' N ' HD22 ' A' ' 99' ' ' LEU . 71.9 mt -63.44 -51.51 65.37 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.529 1.143 . . . . 64.02 109.276 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -77.5 54.79 1.21 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.487 1.117 . . . . 74.44 110.306 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -176.3 -67.05 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.482 1.114 . . . . 70.04 109.321 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -43.57 -54.09 5.17 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.462 1.101 . . . . 53.0 109.276 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.417 ' CZ ' ' HB3' ' A' ' 203' ' ' PRO . 6.4 m-85 -107.96 -31.2 8.08 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.507 1.13 . . . . 72.41 110.992 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 104.78 41.98 1.9 Allowed Glycine 0 CA--C 1.531 1.048 0 O-C-N 124.482 1.114 . . . . 71.34 110.996 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.556 HG23 ' CE1' ' A' ' 81' ' ' PHE . 11.1 mm -82.97 79.69 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.555 0.797 . . . . 75.04 109.295 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.505 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -131.76 156.39 80.18 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.522 1.139 . . . . 74.24 109.321 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.505 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.0 160.1 97.05 Favored 'Cis proline' 0 C--N 1.36 1.168 0 C-N-CA 120.981 -2.508 . . . . 74.34 110.994 -0.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -122.7 141.48 14.03 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.466 1.104 . . . . 71.52 111.046 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -158.72 130.16 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.5 0.765 . . . . 75.15 109.275 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.422 HD11 ' NE2' ' A' ' 85' ' ' HIS . 1.9 pt -96.67 156.88 3.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.571 1.169 . . . . 73.45 109.291 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -54.65 -19.17 5.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.491 1.12 . . . . 65.35 110.998 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.525 ' HB1' ' CE1' ' A' ' 85' ' ' HIS . . . -76.26 -51.58 11.74 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.541 1.15 . . . . 53.35 109.356 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -71.02 -25.93 62.89 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.425 1.078 . . . . 73.14 110.319 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.468 ' HE3' ' CG2' ' A' ' 82' ' ' VAL . 34.8 tpp -38.12 111.03 0.57 Allowed Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.508 1.13 . . . . 73.14 110.974 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.96 140.21 25.31 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.483 1.781 . . . . 64.52 111.048 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.438 ' CE1' ' CD1' ' A' ' 122' ' ' LEU . 10.2 p80 -166.01 109.47 0.79 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.543 1.152 . . . . 71.2 109.605 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -68.64 -27.77 73.6 Favored Glycine 0 CA--C 1.531 1.041 0 O-C-N 124.547 1.154 . . . . 74.35 111.079 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 22.0 ttm-85 -63.0 151.04 40.86 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.588 0.817 . . . . 74.33 110.307 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -54.66 -176.65 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.535 1.147 . . . . 74.53 110.274 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -47.68 136.0 10.97 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.48 1.113 . . . . 74.14 109.658 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.441 ' CD1' ' N ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -137.49 127.12 25.23 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.498 1.123 . . . . 75.2 109.337 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -101.83 5.61 41.17 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.477 1.111 . . . . 51.41 110.315 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 73.7 m-80 -73.53 99.36 3.01 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.555 1.159 . . . . 74.3 109.342 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -75.01 -17.27 60.55 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.532 1.145 . . . . 63.24 109.242 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.9 -40.06 72.49 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.55 1.157 . . . . 75.33 109.265 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -43.9 -54.53 5.24 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.548 1.155 . . . . 75.53 109.302 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.465 ' HB3' ' CD1' ' A' ' 84' ' ' LEU . . . -60.5 -36.03 77.37 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.53 1.144 . . . . 70.23 109.293 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.456 HG22 ' CD2' ' A' ' 157' ' ' LEU . 3.4 t -73.31 -5.5 6.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.526 1.141 . . . . 73.31 109.276 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -109.59 119.81 40.55 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.473 1.108 . . . . 72.42 109.268 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 78.77 63.49 2.09 Favored Glycine 0 CA--C 1.529 0.951 0 O-C-N 124.436 1.085 . . . . 63.25 111.033 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 50.9 p -163.52 155.94 17.94 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.45 0.735 . . . . 42.23 110.073 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.553 ' O ' ' CG ' ' A' ' 134' ' ' TRP . . . -94.92 -22.31 18.07 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.497 1.123 . . . . 73.34 109.336 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.584 ' CZ2' ' HA ' ' A' ' 210' ' ' PHE . 16.1 m-90 -161.07 154.87 22.27 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.492 1.12 . . . . 71.53 108.041 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.438 ' CG2' ' CG1' ' A' ' 82' ' ' VAL . 1.8 p -140.55 122.3 15.36 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.551 1.157 . . . . 75.35 110.391 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.458 ' CG2' HG21 ' A' ' 83' ' ' ILE . 0.9 OUTLIER -84.08 142.09 13.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.542 1.151 . . . . 74.24 109.23 -179.936 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 47.7 mt -130.06 98.88 4.88 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.535 1.147 . . . . 72.13 109.378 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.473 HD21 ' CB ' ' A' ' 85' ' ' HIS . 0.1 OUTLIER -62.46 102.23 0.3 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.571 1.169 . . . . 73.51 109.307 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.466 ' CD2' HG22 ' A' ' 185' ' ' THR . 0.2 OUTLIER -68.56 99.13 0.94 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.474 1.109 . . . . 75.51 109.269 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.447 ' O ' ' N ' ' A' ' 144' ' ' LEU . 2.4 m -125.34 141.55 52.01 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.582 1.176 . . . . 74.14 110.394 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . 0.44 ' HB3' ' CD2' ' A' ' 180' ' ' LEU . 0.1 OUTLIER -47.41 -46.18 26.11 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.512 1.132 . . . . 73.33 110.307 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . 0.453 ' OD1' ' N ' ' A' ' 143' ' ' PHE . 11.2 p30 -73.04 -47.57 43.6 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.562 1.164 . . . . 71.43 109.331 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.612 ' CZ ' ' CG2' ' A' ' 147' ' ' THR . 76.9 t80 -60.24 -19.37 54.26 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.44 1.087 . . . . 72.54 110.997 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.468 ' C ' ' CD1' ' A' ' 144' ' ' LEU . 2.0 tm? -66.83 -67.54 0.44 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.515 1.134 . . . . 73.35 109.319 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.447 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 30.3 mmt180 -50.95 -21.51 1.78 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.534 1.146 . . . . 75.42 110.276 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 92.7 m-20 -78.36 -72.33 0.38 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.442 1.089 . . . . 74.15 109.283 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.612 ' CG2' ' CZ ' ' A' ' 143' ' ' PHE . 20.6 p -58.64 -56.0 27.76 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.489 1.118 . . . . 73.44 110.394 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -43.48 -56.65 3.51 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.98 -1.119 . . . . 75.01 107.98 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . 0.447 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 42.6 t -58.86 -37.88 77.51 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.446 1.091 . . . . 74.13 108.261 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.453 ' N ' ' O ' ' A' ' 147' ' ' THR . 14.5 t-20 -63.5 -27.6 69.38 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.47 1.106 . . . . 72.45 109.3 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.657 ' CZ ' ' CD1' ' A' ' 157' ' ' LEU . 10.1 m-30 -87.15 -13.3 44.46 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.452 1.095 . . . . 72.41 110.978 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -75.46 -35.76 60.83 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.541 1.151 . . . . 71.1 110.293 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.594 ' CD1' ' C ' ' A' ' 153' ' ' PHE . 0.8 OUTLIER -94.08 -21.4 19.15 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.489 1.118 . . . . 74.1 111.017 -179.989 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -115.24 109.74 18.41 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.519 1.137 . . . . 73.33 111.043 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' THR . . . . . 0.44 ' O ' ' ND2' ' A' ' 159' ' ' ASN . 1.2 t -85.81 -5.98 59.17 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.573 1.17 . . . . 72.45 110.369 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 1.6 t -72.52 -31.89 65.69 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.543 1.152 . . . . 73.15 110.051 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.657 ' CD1' ' CZ ' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -85.46 -25.87 26.65 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.471 1.107 . . . . 73.03 109.291 179.984 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' MET . . . . . 0.467 ' HE2' ' CG2' ' A' ' 161' ' ' VAL . 7.0 mmt -67.64 -25.61 65.82 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.445 1.091 . . . . 74.45 110.978 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' ASN . . . . . 0.633 ' N ' HD21 ' A' ' 159' ' ' ASN . 0.9 OUTLIER -78.08 -15.81 58.57 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.475 1.11 . . . . 73.43 109.354 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.451 ' O ' ' NH1' ' A' ' 163' ' ' ARG . 0.5 OUTLIER -80.0 -43.08 22.61 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.521 1.138 . . . . 65.32 109.976 179.978 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . 0.467 ' CG2' ' HE2' ' A' ' 158' ' ' MET . 35.5 m -61.02 -17.02 15.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 O-C-N 124.447 1.092 . . . . 75.55 109.258 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -76.04 -0.8 23.04 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.509 1.13 . . . . 73.5 109.323 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.499 ' HA ' ' CZ ' ' A' ' 163' ' ' ARG . 2.6 mmp_? 51.35 58.64 5.3 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.472 1.108 . . . . 74.52 110.32 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -78.62 -163.54 0.47 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.51 1.131 . . . . 73.3 110.353 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -112.17 54.48 0.7 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.476 1.11 . . . . 73.43 109.552 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . 0.571 ' HG3' ' CD2' ' A' ' 167' ' ' TYR . 3.5 tptt -97.72 164.46 12.39 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.476 1.11 . . . . 63.54 109.309 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' TYR . . . . . 0.581 ' CD1' ' N ' ' A' ' 168' ' ' ASN . 40.0 p90 -58.09 -48.22 80.83 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.46 1.1 . . . . 74.2 110.983 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.581 ' N ' ' CD1' ' A' ' 167' ' ' TYR . 7.8 p30 -79.86 134.88 36.34 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.519 1.137 . . . . 64.12 109.264 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' SER . . . . . 0.574 ' HB3' ' CD1' ' A' ' 134' ' ' TRP . 47.0 t -113.06 132.3 55.47 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.463 1.102 . . . . 73.53 109.992 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.467 ' H ' ' NH2' ' A' ' 163' ' ' ARG . 9.6 t -99.48 133.98 40.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.494 1.121 . . . . 64.23 109.272 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . 0.457 ' CD1' ' O ' ' A' ' 170' ' ' VAL . 1.2 mp -140.52 108.05 6.61 Favored Pre-proline 0 C--N 1.326 -0.44 0 O-C-N 124.389 1.056 . . . . 72.54 109.361 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . 0.509 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -74.99 106.57 2.3 Favored 'Trans proline' 0 C--N 1.359 1.097 0 O-C-N 124.537 1.809 . . . . 74.21 111.012 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 6.7 ttt -89.21 156.41 18.79 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.579 1.175 . . . . 74.34 110.983 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 8.7 mmm-85 -114.94 121.62 35.02 Favored Pre-proline 0 C--N 1.324 -0.506 0 O-C-N 124.47 1.106 . . . . 74.13 110.284 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.01 159.94 40.71 Favored 'Trans proline' 0 C--N 1.359 1.114 0 O-C-N 124.516 1.798 . . . . 73.22 110.975 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . 0.496 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -104.21 -40.17 6.24 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.523 1.139 . . . . 73.12 109.278 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . 0.402 HD21 ' N ' ' A' ' 177' ' ' ASN . 1.3 m-80 -72.89 -23.76 60.76 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.543 1.152 . . . . 75.1 109.311 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -110.19 105.91 57.59 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.503 1.127 . . . . 75.11 109.34 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.92 115.67 4.36 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.466 1.772 . . . . 74.02 111.049 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . 0.469 HD22 ' CB ' ' A' ' 184' ' ' ARG . 2.1 tm? -139.12 101.67 7.61 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.432 1.083 . . . . 72.21 109.342 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.99 171.79 17.64 Favored 'Trans proline' 0 C--N 1.362 1.245 0 O-C-N 124.441 1.759 . . . . 74.22 110.993 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 3.5 ptp85 -59.53 -32.17 70.08 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.505 1.128 . . . . 64.22 110.299 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -48.47 -31.82 6.92 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.523 1.14 . . . . 62.4 110.279 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 184' ' ' ARG . . . . . 0.469 ' CB ' HD22 ' A' ' 180' ' ' LEU . 39.6 mmt180 -96.11 -22.38 17.36 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.507 1.129 . . . . 63.5 110.292 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 185' ' ' THR . . . . . 0.466 HG22 ' CD2' ' A' ' 139' ' ' LEU . 12.1 m -77.44 144.35 70.09 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.492 1.12 . . . . 75.24 110.424 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 185' ' ' THR . 18.2 Cg_endo -74.97 164.6 33.07 Favored 'Trans proline' 0 C--N 1.36 1.155 0 O-C-N 124.404 1.739 . . . . 60.24 110.989 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 187' ' ' PHE . . . . . 0.466 ' O ' ' CG2' ' A' ' 191' ' ' THR . 32.2 p90 -77.35 -6.92 55.07 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.596 1.185 . . . . 75.33 111.028 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -95.33 -51.29 4.65 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.434 1.084 . . . . 71.4 109.279 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 49.4 mt -68.39 -42.66 78.77 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.502 1.126 . . . . 74.24 109.257 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 190' ' ' GLN . . . . . 0.428 ' CG ' HG22 ' A' ' 191' ' ' THR . 2.0 pt20 -65.2 -9.68 25.4 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.505 1.128 . . . . 75.31 110.262 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 191' ' ' THR . . . . . 0.466 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 80.8 p -120.84 24.55 10.17 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.491 1.119 . . . . 73.32 110.403 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.496 ' CG2' ' N ' ' A' ' 193' ' ' ASN . 7.8 mt -123.41 163.32 22.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.499 1.125 . . . . 75.43 109.315 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 193' ' ' ASN . . . . . 0.496 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 2.4 m-20 -66.71 74.22 0.1 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.558 1.161 . . . . 70.44 109.284 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . 0.509 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -71.04 162.3 29.66 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.452 1.095 . . . . 73.55 109.3 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 195' ' ' LEU . . . . . 0.461 ' CD2' HD12 ' A' ' 209' ' ' ILE . 0.3 OUTLIER -106.72 149.32 27.41 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.478 1.111 . . . . 75.31 109.288 -179.967 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -142.94 142.07 31.59 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.477 1.111 . . . . 71.34 110.335 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . 0.471 ' HG3' ' CD2' ' A' ' 176' ' ' LEU . 3.4 pm0 -113.62 -28.67 7.4 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.464 1.103 . . . . 72.23 110.233 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? -77.39 0.7 21.47 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.488 1.118 . . . . 75.04 110.334 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 6.9 t -104.28 161.33 14.14 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.49 1.119 . . . . 71.22 110.042 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 22.0 ttt-85 -77.55 -26.14 50.7 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.458 1.099 . . . . 72.0 110.274 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -88.73 21.99 23.67 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.554 1.159 . . . . 42.03 110.98 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 202' ' ' PHE . . . . . 0.646 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 0.3 OUTLIER -61.18 -41.96 83.35 Favored Pre-proline 0 C--N 1.326 -0.438 0 O-C-N 124.458 0.74 . . . . 73.34 110.981 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 203' ' ' PRO . . . . . 0.646 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.6 Cg_endo -74.94 -37.43 2.08 Favored 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.494 1.786 . . . . 73.01 111.049 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.36 -50.98 61.3 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.558 1.161 . . . . 75.4 110.406 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 205' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 3.0 mt-30 -71.05 -40.15 71.83 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.559 1.162 . . . . 74.55 110.326 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 206' ' ' VAL . . . . . 0.523 ' CG2' ' O ' ' A' ' 202' ' ' PHE . 57.1 t -62.82 -26.64 41.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 O-C-N 124.586 1.179 . . . . 75.15 109.261 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -81.01 -49.93 10.32 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.482 1.114 . . . . 75.15 110.345 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 83.7 mtt-85 -67.46 -62.75 1.27 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.57 1.169 . . . . 75.51 110.293 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 209' ' ' ILE . . . . . 0.578 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 96.5 mt -45.61 -50.0 3.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.554 1.159 . . . . 71.14 109.325 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 210' ' ' PHE . . . . . 0.584 ' HA ' ' CZ2' ' A' ' 134' ' ' TRP . 1.5 m-85 -105.83 67.39 0.75 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.524 1.14 . . . . 71.11 111.01 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -111.04 142.95 42.51 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.485 1.116 . . . . 72.23 110.324 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.448 ' CG ' ' HE3' ' A' ' 216' ' ' LYS . 7.1 tt0 -49.06 -54.42 16.01 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.498 1.124 . . . . 65.12 110.324 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.01 -25.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.499 1.125 . . . . 51.3 109.993 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 42.5 t -96.1 -28.45 3.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.487 1.117 . . . . 72.3 109.279 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 215' ' ' TYR . . . . . 0.519 ' OH ' ' CE2' ' A' ' 78' ' ' PHE . 32.0 t80 -64.69 -30.77 71.79 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.522 1.139 . . . . 74.12 111.051 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . 0.448 ' HE3' ' CG ' ' A' ' 212' ' ' GLU . 12.7 mttp -63.11 -66.32 0.56 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.565 1.166 . . . . 73.42 109.323 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 86.9 m -41.01 -55.26 2.59 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.502 1.126 . . . . 74.45 110.362 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 218' ' ' GLN . . . . . 0.453 ' O ' ' N ' ' A' ' 221' ' ' ILE . 18.6 mm-40 -57.15 -67.2 0.34 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.496 1.122 . . . . 75.32 110.321 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 37.8 tp60 -44.05 -27.36 0.37 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.539 1.15 . . . . 74.23 110.385 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 4.4 m -81.2 -41.01 22.96 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.503 1.127 . . . . 74.12 110.392 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 221' ' ' ILE . . . . . 0.453 ' N ' ' O ' ' A' ' 218' ' ' GLN . 14.5 mt -66.56 -31.26 52.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.439 1.087 . . . . 75.42 109.215 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 222' ' ' TRP . . . . . 0.508 ' O ' ' CG2' ' A' ' 225' ' ' THR . 28.9 t90 -69.57 -61.46 1.78 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.549 1.156 . . . . 74.5 107.968 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . 0.513 ' HA ' ' CD ' ' A' ' 226' ' ' ARG . 0.0 OUTLIER -54.05 -20.48 6.51 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.564 1.165 . . . . 74.4 109.275 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -93.23 -23.13 18.64 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.518 1.136 . . . . 73.51 110.344 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 225' ' ' THR . . . . . 0.508 ' CG2' ' O ' ' A' ' 222' ' ' TRP . 5.8 t -64.02 -15.05 58.52 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.554 1.159 . . . . 75.44 110.353 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 226' ' ' ARG . . . . . 0.513 ' CD ' ' HA ' ' A' ' 223' ' ' LYS . 0.8 OUTLIER -76.69 -30.39 56.69 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.503 1.127 . . . . 74.3 110.279 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 227' ' ' ASN . . . . . 0.65 ' N ' HD21 ' A' ' 227' ' ' ASN . 0.9 OUTLIER -79.7 -59.72 2.63 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.467 1.105 . . . . 62.13 109.243 -179.94 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 228' ' ' MET . . . . . 0.416 ' HG3' ' N ' ' A' ' 229' ' ' VAL . 10.1 ptp -41.82 -36.64 1.08 Allowed 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.577 1.173 . . . . 73.44 111.041 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 229' ' ' VAL . . . . . 0.416 ' N ' ' HG3' ' A' ' 228' ' ' MET . 5.7 t -76.76 -41.84 33.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.411 1.07 . . . . 75.31 109.297 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 230' ' ' GLN . . . . . 0.448 ' N ' ' O ' ' A' ' 227' ' ' ASN . 0.0 OUTLIER -68.29 -12.84 61.69 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.452 1.095 . . . . 73.43 110.322 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 38.2 mmm-85 -91.55 -80.34 0.35 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.501 1.126 . . . . 74.31 110.315 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -147.79 54.22 1.05 Allowed 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.547 1.154 . . . . 73.45 110.319 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -161.53 173.27 15.05 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.6 1.187 . . . . 73.12 110.944 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 13.4 mm -136.47 159.56 37.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.494 1.121 . . . . 72.44 109.367 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.468 0 O-C-N 124.492 1.12 . . . . 74.3 109.316 179.964 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.997 0 N-CA-C 111.002 -0.839 . . . . 61.03 111.002 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 169.2 23.14 Favored 'Trans proline' 0 C--N 1.359 1.103 0 O-C-N 124.465 1.771 . . . . 72.22 111.009 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -109.4 -43.78 4.04 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.572 1.17 . . . . 64.03 109.275 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -76.67 -63.89 2.25 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.53 1.144 . . . . 73.12 110.985 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.33 166.26 0.89 Allowed 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.51 0.771 . . . . 73.54 110.026 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.3 tp10 -59.83 144.28 49.0 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.415 1.072 . . . . 74.42 110.32 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.404 ' OE1' ' NH1' ' A' ' 226' ' ' ARG . 2.5 tt0 -129.18 127.79 42.06 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.555 1.159 . . . . 71.25 110.265 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.54 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.7 p -124.72 162.71 26.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 124.454 1.096 . . . . 73.51 109.288 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.402 ' O ' ' C ' ' A' ' 79' ' ' LEU . 8.3 m-85 -88.84 25.21 1.83 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.494 1.121 . . . . 74.43 111.007 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.402 ' C ' ' O ' ' A' ' 78' ' ' PHE . 6.1 tp -40.07 158.51 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.553 1.158 . . . . 73.34 109.317 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.409 ' NZ ' ' HA ' ' A' ' 106' ' ' ILE . 11.4 ptmt -111.76 -47.68 3.13 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.458 1.099 . . . . 71.21 109.338 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.614 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.1 OUTLIER -166.48 151.3 7.84 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.567 1.167 . . . . 75.43 110.936 -179.972 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.456 HG21 ' CE ' ' A' ' 115' ' ' MET . 3.9 p -104.86 167.78 2.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.451 1.095 . . . . 75.44 109.347 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.61 ' CD1' ' CZ ' ' A' ' 81' ' ' PHE . 2.3 mp -126.49 105.03 13.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 O-C-N 124.525 1.14 . . . . 63.31 109.412 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.458 HD23 ' CD1' ' A' ' 112' ' ' PHE . 5.3 mt -70.22 133.27 46.88 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.464 1.102 . . . . 53.31 109.259 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.57 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -156.61 174.45 15.43 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.519 1.137 . . . . 72.45 109.568 179.972 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.432 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -119.2 164.92 14.88 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.514 1.133 . . . . 73.22 109.307 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -54.46 -35.12 62.69 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 124.478 1.111 . . . . 73.31 110.267 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -69.28 -46.33 67.46 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.554 1.159 . . . . 65.41 109.281 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.455 ' O ' ' CD2' ' A' ' 138' ' ' LEU . 2.1 m-20 -108.02 44.43 1.1 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.464 1.103 . . . . 74.04 109.33 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.57 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -80.42 -51.59 8.65 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.47 1.106 . . . . 74.14 110.39 -179.962 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.04 -32.88 74.59 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.479 1.112 . . . . 73.22 109.289 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.404 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 4.5 tp10 -58.61 -67.8 0.32 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.498 1.124 . . . . 71.41 110.288 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.482 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -47.71 -29.66 3.23 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.495 1.122 . . . . 72.31 109.302 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 tt -69.9 -49.62 50.4 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.506 1.128 . . . . 75.41 109.332 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -47.19 -33.15 5.03 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.474 1.109 . . . . 73.34 110.326 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.444 ' CG2' ' OE1' ' A' ' 197' ' ' GLU . 1.8 t -79.31 -64.69 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.531 1.145 . . . . 73.55 109.224 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.437 ' N ' HG11 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -45.08 -22.48 0.1 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.489 1.118 . . . . 74.12 110.353 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.435 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.0 OUTLIER -78.02 -59.91 2.59 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.541 1.151 . . . . 75.21 109.291 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.504 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -61.73 -21.55 64.61 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.509 1.131 . . . . 72.55 109.375 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.426 ' N ' HD21 ' A' ' 99' ' ' LEU . 22.6 mt -66.42 -52.61 44.73 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.521 1.138 . . . . 73.4 109.292 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . 0.409 ' O ' ' HG3' ' A' ' 101' ' ' GLN . 10.4 pt20 -81.0 49.86 1.3 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.485 1.116 . . . . 72.42 110.276 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -169.63 -65.79 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.498 1.124 . . . . 64.23 109.337 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -48.42 -48.13 37.38 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.455 1.097 . . . . 75.04 109.29 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.565 ' CE2' HG12 ' A' ' 206' ' ' VAL . 5.5 m-85 -115.94 -29.8 6.24 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.596 1.185 . . . . 74.45 111.018 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.43 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 95.21 45.83 2.95 Favored Glycine 0 CA--C 1.53 1.012 0 O-C-N 124.517 1.136 . . . . 73.32 110.95 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.409 ' HA ' ' NZ ' ' A' ' 80' ' ' LYS . 10.0 mm -81.29 68.12 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.452 0.736 . . . . 75.34 109.326 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.503 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -118.42 155.46 51.96 Favored Pre-proline 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 72.33 109.327 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.503 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.96 154.43 99.69 Favored 'Cis proline' 0 C--N 1.359 1.117 0 C-N-CA 120.925 -2.531 . . . . 72.31 111.049 -0.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -135.2 142.99 14.49 Favored Glycine 0 CA--C 1.531 1.038 0 O-C-N 124.468 1.105 . . . . 72.54 110.957 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 3.3 tt -153.2 151.92 10.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.506 0.768 . . . . 75.41 109.269 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 21.3 pt -95.73 -178.14 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.445 1.091 . . . . 74.41 109.293 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.458 ' CD1' HD23 ' A' ' 84' ' ' LEU . 8.0 t80 -82.07 -19.21 40.7 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.488 1.118 . . . . 64.14 111.059 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.45 -4.37 51.41 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.425 1.078 . . . . 63.04 109.251 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -109.09 -12.22 14.85 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.502 1.126 . . . . 71.05 110.292 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.456 ' CE ' HG21 ' A' ' 82' ' ' VAL . 6.2 ttm -55.74 143.89 58.08 Favored Pre-proline 0 C--N 1.326 -0.439 0 O-C-N 124.465 1.103 . . . . 73.44 111.06 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.99 83.48 1.81 Allowed 'Trans proline' 0 C--N 1.36 1.159 0 O-C-N 124.498 1.788 . . . . 72.03 110.964 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.435 ' CD2' ' HB3' ' A' ' 115' ' ' MET . 1.6 p80 -165.56 145.58 6.71 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.51 1.131 . . . . 73.31 109.627 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -151.5 94.14 0.15 Allowed Glycine 0 CA--C 1.529 0.96 0 O-C-N 124.526 1.141 . . . . 63.11 110.961 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.414 ' N ' ' HD3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER -123.02 177.69 5.4 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.427 0.722 . . . . 65.21 110.332 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -47.66 -72.08 0.06 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.529 1.143 . . . . 74.34 110.326 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 3.8 t-160 -104.3 -175.57 2.83 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.521 1.138 . . . . 72.1 109.612 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.68 23.15 13.17 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.513 1.133 . . . . 74.21 109.332 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.89 175.5 0.12 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.559 1.162 . . . . 73.33 110.318 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 65.28 50.01 1.84 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.485 1.116 . . . . 74.12 109.274 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 2.4 pp -59.8 -17.61 37.15 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.479 1.112 . . . . 72.11 109.249 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -62.81 -14.12 41.72 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 124.568 1.168 . . . . 74.1 109.295 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -55.54 -26.29 42.42 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.518 1.136 . . . . 73.21 109.366 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -93.91 -22.5 18.57 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.459 1.099 . . . . 72.23 109.324 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.493 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 25.4 t -82.8 5.17 2.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.5 1.125 . . . . 64.52 109.259 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 -143.55 118.54 10.02 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.579 1.175 . . . . 74.22 109.293 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 102.1 42.19 2.29 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.478 1.111 . . . . 30.35 111.032 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' SER . . . . . 0.451 ' CB ' ' HA ' ' A' ' 81' ' ' PHE . 0.2 OUTLIER -163.26 -177.03 5.11 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.513 0.772 . . . . 54.44 110.014 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.647 ' CB ' ' CZ3' ' A' ' 134' ' ' TRP . . . -107.24 -25.86 11.31 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.536 1.148 . . . . 73.12 109.343 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.647 ' CZ3' ' CB ' ' A' ' 133' ' ' ALA . 4.2 m-90 -159.66 172.9 16.91 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.487 1.117 . . . . 74.54 108.035 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.491 ' O ' ' CD1' ' A' ' 137' ' ' LEU . 38.9 p -147.25 124.62 11.6 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.518 1.136 . . . . 75.32 110.421 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.405 ' O ' ' O ' ' A' ' 84' ' ' LEU . 1.1 mp -84.32 128.65 38.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.528 1.143 . . . . 72.54 109.353 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.532 ' CD1' ' N ' ' A' ' 137' ' ' LEU . 2.0 mp -110.96 101.69 10.23 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.508 1.13 . . . . 74.33 109.252 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.592 ' O ' ' CD1' ' A' ' 143' ' ' PHE . 0.1 OUTLIER -62.02 89.87 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.43 1.081 . . . . 73.52 109.306 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.422 ' CD2' HG21 ' A' ' 185' ' ' THR . 5.2 tp -63.04 99.99 0.19 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.472 1.107 . . . . 73.21 109.27 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 18.9 m -131.11 154.11 48.65 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.542 1.151 . . . . 74.22 110.397 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -52.71 -34.32 51.81 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.54 1.15 . . . . 72.12 110.304 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -89.39 -53.06 4.72 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.541 1.151 . . . . 73.45 109.324 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.592 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 58.7 t80 -55.16 -19.8 8.69 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.442 1.089 . . . . 71.11 110.982 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.502 ' O ' ' CB ' ' A' ' 148' ' ' TRP . 3.0 tm? -63.08 -67.83 0.39 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.52 1.138 . . . . 75.04 109.3 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.454 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 0.2 OUTLIER -62.7 -15.03 50.87 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.521 1.138 . . . . 72.04 110.255 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -64.21 -60.65 2.95 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.551 1.157 . . . . 65.41 109.246 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.552 ' OG1' ' CE1' ' A' ' 151' ' ' PHE . 1.0 OUTLIER -92.06 -47.03 7.48 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.523 1.139 . . . . 74.44 110.392 -179.946 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.504 ' CZ3' ' HE1' ' A' ' 158' ' ' MET . 30.2 t-105 -43.37 -35.72 1.65 Allowed 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.503 1.127 . . . . 75.34 108.017 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . 0.454 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 17.9 t -80.37 -45.01 18.45 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.479 1.112 . . . . 73.42 108.282 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.427 ' N ' ' O ' ' A' ' 147' ' ' THR . 24.3 t-20 -60.7 -15.65 31.26 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.461 1.1 . . . . 74.23 109.317 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.56 ' CZ ' HD12 ' A' ' 157' ' ' LEU . 10.7 m-30 -82.41 -50.91 8.36 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.54 1.15 . . . . 75.21 110.951 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -46.26 -38.11 8.11 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.507 1.13 . . . . 73.42 110.385 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -77.66 -33.76 53.32 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.483 1.114 . . . . 72.4 110.957 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -116.41 91.32 3.55 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.468 1.105 . . . . 73.22 110.966 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.2 t -62.56 -13.03 26.52 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.5 1.125 . . . . 72.41 110.334 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 12.1 t -70.19 -18.64 63.19 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.461 1.1 . . . . 63.24 109.956 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.56 HD12 ' CZ ' ' A' ' 151' ' ' PHE . 0.2 OUTLIER -88.58 -36.02 16.57 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.523 1.139 . . . . 75.42 109.315 179.98 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' MET . . . . . 0.504 ' HE1' ' CZ3' ' A' ' 148' ' ' TRP . 2.2 mmt -68.67 -11.55 60.3 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.53 1.144 . . . . 65.05 110.989 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -77.58 -48.52 16.73 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.465 1.103 . . . . 75.33 109.317 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.471 ' HB3' ' CG2' ' A' ' 170' ' ' VAL . 0.4 OUTLIER -59.86 -24.88 64.59 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.495 1.122 . . . . 70.43 110.019 179.958 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . 0.487 ' O ' ' CD1' ' A' ' 192' ' ' ILE . 44.2 t -62.01 -18.03 18.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.513 1.133 . . . . 74.14 109.337 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . 0.421 ' HB3' ' NE2' ' A' ' 164' ' ' GLN . 4.0 t-20 -79.45 1.36 25.82 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.427 1.079 . . . . 71.32 109.271 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.487 ' NH1' ' ND2' ' A' ' 193' ' ' ASN . 17.6 mmm-85 63.33 62.97 0.93 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.449 1.093 . . . . 73.51 110.323 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . 0.54 HE21 ' N ' ' A' ' 164' ' ' GLN . 0.0 OUTLIER -60.1 -173.66 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 75.21 110.244 -179.973 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -124.54 24.72 7.8 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.572 1.17 . . . . 73.13 109.62 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -82.95 174.89 10.49 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.566 1.166 . . . . 74.22 109.284 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' TYR . . . . . 0.464 ' CA ' HG23 ' A' ' 221' ' ' ILE . 9.9 t80 -45.27 -65.47 0.53 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.53 1.144 . . . . 74.4 111.04 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.402 ' CG ' ' O ' ' A' ' 129' ' ' VAL . 2.6 p30 -76.84 154.67 33.64 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.487 1.117 . . . . 63.32 109.316 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 43.2 m -140.23 168.09 20.63 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.479 1.112 . . . . 74.43 110.065 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.471 ' CG2' ' HB3' ' A' ' 160' ' ' SER . 73.0 t -122.72 130.96 74.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.546 1.154 . . . . 62.11 109.253 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . 0.464 ' CD1' ' O ' ' A' ' 170' ' ' VAL . 1.1 mp -142.34 110.74 5.9 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.52 1.138 . . . . 73.1 109.313 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . 0.508 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.0 Cg_endo -75.06 106.77 2.34 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.533 1.807 . . . . 75.43 110.939 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' MET . . . . . 0.407 ' HE2' ' CD1' ' A' ' 195' ' ' LEU . 5.1 ttt -87.37 155.69 19.92 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.515 1.135 . . . . 71.12 110.968 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . 0.423 ' NE ' ' HA ' ' A' ' 174' ' ' ARG . 0.0 OUTLIER -115.89 116.53 40.44 Favored Pre-proline 0 C--N 1.325 -0.46 0 O-C-N 124.49 1.119 . . . . 73.21 110.321 -179.966 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.04 160.12 40.41 Favored 'Trans proline' 0 C--N 1.359 1.109 0 O-C-N 124.492 1.786 . . . . 72.2 110.943 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . 0.554 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -95.25 -43.8 7.9 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.526 1.141 . . . . 73.42 109.257 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . 0.448 ' H ' ' ND2' ' A' ' 177' ' ' ASN . 1.9 p30 -72.77 -25.71 61.28 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.509 1.13 . . . . 60.33 109.25 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -110.26 102.38 51.05 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.52 1.138 . . . . 73.35 109.326 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.04 134.32 17.61 Favored 'Trans proline' 0 C--N 1.359 1.118 0 O-C-N 124.48 1.779 . . . . 75.23 110.969 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -141.18 97.18 6.98 Favored Pre-proline 0 C--N 1.326 -0.42 0 O-C-N 124.493 1.121 . . . . 61.52 109.3 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.02 165.8 30.52 Favored 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.495 1.787 . . . . 61.35 110.973 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . 0.416 ' HG3' ' N ' ' A' ' 183' ' ' GLU . 5.4 ptm180 -68.11 -22.33 64.9 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.54 1.15 . . . . 73.21 110.283 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' A' ' 182' ' ' ARG . 11.6 pt-20 -61.96 -14.5 35.45 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.53 1.144 . . . . 72.31 110.262 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -121.4 3.43 10.26 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.594 1.184 . . . . 74.44 110.313 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 185' ' ' THR . . . . . 0.422 HG21 ' CD2' ' A' ' 139' ' ' LEU . 10.5 m -100.42 144.13 27.87 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.476 1.11 . . . . 73.13 110.425 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 185' ' ' THR . 18.4 Cg_endo -74.95 164.38 33.52 Favored 'Trans proline' 0 C--N 1.36 1.179 0 O-C-N 124.522 1.801 . . . . 72.31 110.97 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 187' ' ' PHE . . . . . 0.495 ' O ' ' CG2' ' A' ' 191' ' ' THR . 5.7 p90 -77.01 -7.0 54.87 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.515 1.134 . . . . 74.44 110.996 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -95.03 -51.36 4.69 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.557 1.161 . . . . 74.53 109.252 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 51.9 mt -68.41 -42.55 78.82 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.555 1.159 . . . . 74.55 109.37 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 190' ' ' GLN . . . . . 0.4 ' CG ' HG21 ' A' ' 191' ' ' THR . 1.9 pt20 -65.3 -9.41 24.07 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.494 1.121 . . . . 74.23 110.241 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 191' ' ' THR . . . . . 0.495 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 67.7 p -119.32 17.95 13.0 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.472 1.107 . . . . 63.04 110.439 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.487 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 7.4 mt -112.97 157.36 13.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.552 1.157 . . . . 73.44 109.277 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 193' ' ' ASN . . . . . 0.487 ' ND2' ' NH1' ' A' ' 163' ' ' ARG . 46.2 p-10 -65.53 75.38 0.06 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.477 1.111 . . . . 72.54 109.324 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . 0.508 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -71.9 149.58 45.0 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.424 1.078 . . . . 74.31 109.292 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 195' ' ' LEU . . . . . 0.407 ' CD1' ' HE2' ' A' ' 173' ' ' MET . 0.5 OUTLIER -93.15 124.53 37.19 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.533 1.146 . . . . 75.43 109.291 -179.951 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -118.6 109.17 15.83 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.529 1.143 . . . . 72.21 110.287 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . 0.556 ' HA ' ' CD1' ' A' ' 202' ' ' PHE . 14.0 pt-20 -79.63 -34.03 40.93 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.453 1.095 . . . . 73.51 110.314 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . 0.466 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 11.7 pt-20 -79.62 2.43 22.51 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.49 1.119 . . . . 73.45 110.303 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 29.4 t -96.52 145.35 25.78 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.445 1.09 . . . . 62.44 110.063 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -57.55 -28.69 63.76 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.535 1.147 . . . . 72.44 110.371 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -93.59 23.44 30.41 Favored Glycine 0 CA--C 1.53 1.027 0 O-C-N 124.552 1.158 . . . . 75.33 111.03 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 202' ' ' PHE . . . . . 0.619 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 0.2 OUTLIER -59.04 -43.14 97.04 Favored Pre-proline 0 C--N 1.324 -0.534 0 O-C-N 124.567 0.804 . . . . 75.3 111.027 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 203' ' ' PRO . . . . . 0.619 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -75.03 -36.05 2.76 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.487 1.783 . . . . 71.03 110.971 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -57.87 -47.2 83.42 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.483 1.114 . . . . 70.14 110.36 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 205' ' ' GLN . . . . . 0.401 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 1.8 mt-30 -70.67 -40.04 73.19 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.495 1.122 . . . . 64.44 110.293 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 206' ' ' VAL . . . . . 0.565 HG12 ' CE2' ' A' ' 104' ' ' PHE . 89.7 t -66.85 -27.83 41.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.453 1.095 . . . . 74.45 109.273 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 207' ' ' GLU . . . . . 0.477 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 2.3 mt-10 -80.31 -51.72 8.56 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.494 1.121 . . . . 72.24 110.253 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 77.4 mtt180 -62.75 -57.92 9.26 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.518 1.136 . . . . 72.44 110.34 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 209' ' ' ILE . . . . . 0.628 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 65.5 mt -52.49 -53.82 18.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.485 1.116 . . . . 73.02 109.29 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 210' ' ' PHE . . . . . 0.628 ' CE1' ' CG2' ' A' ' 209' ' ' ILE . 1.1 m-85 -104.97 57.51 0.69 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.488 1.118 . . . . 74.44 110.959 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 211' ' ' GLN . . . . . 0.477 ' CB ' ' O ' ' A' ' 207' ' ' GLU . 0.0 OUTLIER -96.23 139.51 32.28 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.414 1.071 . . . . 53.43 110.291 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 215' ' ' TYR . 56.9 tt0 -49.98 -53.35 27.03 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.516 1.135 . . . . 74.01 110.309 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -47.1 -24.25 0.63 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.478 1.111 . . . . 74.2 110.013 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 34.6 t -95.9 -32.02 4.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.513 1.133 . . . . 73.21 109.261 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 215' ' ' TYR . . . . . 0.45 ' N ' ' O ' ' A' ' 212' ' ' GLU . 4.5 t80 -63.3 -36.41 83.6 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.512 1.133 . . . . 75.43 111.027 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt -50.4 -60.86 2.57 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.547 1.154 . . . . 72.23 109.289 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 1.3 m -51.98 -46.89 65.03 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.446 1.091 . . . . 73.21 110.443 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 11.0 mm-40 -49.11 -54.67 15.11 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.476 1.11 . . . . 71.01 110.265 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 21.8 tp60 -45.42 -52.81 9.59 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.514 1.134 . . . . 75.13 110.295 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -59.09 -44.87 91.96 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.483 1.115 . . . . 74.02 110.399 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 221' ' ' ILE . . . . . 0.468 ' HA ' ' CG ' ' A' ' 224' ' ' GLU . 17.4 mt -59.18 -27.31 36.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.536 1.148 . . . . 72.41 109.311 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 222' ' ' TRP . . . . . 0.54 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 21.2 t90 -89.41 -17.42 28.8 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.98 -1.119 . . . . 75.33 107.98 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 1.6 tmmm? -85.91 -29.73 23.41 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.457 1.098 . . . . 71.43 109.351 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . 0.468 ' CG ' ' HA ' ' A' ' 221' ' ' ILE . 0.2 OUTLIER -86.67 -35.26 19.43 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.458 1.099 . . . . 72.41 110.262 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 225' ' ' THR . . . . . 0.456 ' CG2' ' HA ' ' A' ' 222' ' ' TRP . 14.9 t -62.57 -12.72 24.5 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.503 1.127 . . . . 75.03 110.357 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 226' ' ' ARG . . . . . 0.501 ' CG ' ' O ' ' A' ' 222' ' ' TRP . 6.2 mtm180 -79.47 -16.48 56.0 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.483 1.114 . . . . 75.51 110.243 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 227' ' ' ASN . . . . . 0.401 ' O ' ' N ' ' A' ' 231' ' ' ARG . 1.0 OUTLIER -89.21 -46.76 8.55 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.452 1.095 . . . . 62.13 109.277 -179.95 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 10.6 mtm -57.53 -34.37 69.06 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.543 1.152 . . . . 75.33 110.977 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 229' ' ' VAL . . . . . 0.401 ' CG2' ' N ' ' A' ' 230' ' ' GLN . 21.2 m -73.7 -51.21 25.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 O-C-N 124.507 1.129 . . . . 72.41 109.324 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 230' ' ' GLN . . . . . 0.401 ' N ' ' CG2' ' A' ' 229' ' ' VAL . 4.5 tp-100 -71.41 -7.5 47.72 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.491 1.119 . . . . 72.21 110.314 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 231' ' ' ARG . . . . . 0.401 ' N ' ' O ' ' A' ' 227' ' ' ASN . 15.2 ttp180 -92.87 -82.42 0.33 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.468 1.105 . . . . 72.4 110.289 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -143.29 50.62 1.4 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.533 1.146 . . . . 55.41 110.318 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -163.18 -174.07 3.68 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.506 1.129 . . . . 75.41 111.022 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 16.8 mm -139.84 150.94 21.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 124.454 1.097 . . . . 71.34 109.337 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.498 0 O-C-N 124.529 1.143 . . . . 72.42 109.275 -179.975 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.054 0 N-CA-C 110.93 -0.868 . . . . 60.41 110.93 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.97 -165.88 0.31 Allowed 'Trans proline' 0 C--N 1.361 1.188 0 O-C-N 124.533 1.807 . . . . 72.03 111.064 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.411 ' C ' ' CD1' ' A' ' 72' ' ' LEU . 0.1 OUTLIER -116.64 -73.11 0.66 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.503 1.127 . . . . 75.31 109.356 179.923 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -93.48 -54.93 1.62 Allowed Glycine 0 CA--C 1.529 0.943 0 O-C-N 124.503 1.127 . . . . 73.31 111.023 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 68.82 10.47 7.92 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.509 0.77 . . . . 73.22 109.977 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -43.49 130.48 5.12 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.491 1.119 . . . . 73.43 110.336 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -118.29 130.79 56.24 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.42 1.075 . . . . 73.21 110.303 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.505 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 2.9 p -132.05 157.27 43.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.568 1.168 . . . . 72.34 109.307 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.498 ' CE2' ' HG3' ' A' ' 108' ' ' PRO . 51.4 p90 -89.72 30.95 0.98 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.448 1.092 . . . . 74.22 110.984 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.461 HD13 ' CG2' ' A' ' 110' ' ' ILE . 6.1 tp -39.91 134.81 1.39 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.553 1.158 . . . . 72.13 109.359 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.475 ' O ' ' CB ' ' A' ' 133' ' ' ALA . 9.1 ttmt -74.84 -67.07 0.67 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.589 1.181 . . . . 72.33 109.365 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.628 ' CZ ' ' CD1' ' A' ' 83' ' ' ILE . 1.5 p90 -152.16 140.68 20.69 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.384 1.052 . . . . 74.31 111.018 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.484 ' CG1' ' HB ' ' A' ' 135' ' ' THR . 8.6 p -84.07 171.59 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 O-C-N 124.48 1.112 . . . . 64.34 109.306 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.628 ' CD1' ' CZ ' ' A' ' 81' ' ' PHE . 2.8 mp -137.4 86.04 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.574 1.172 . . . . 73.54 109.224 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.57 HD23 ' CE1' ' A' ' 112' ' ' PHE . 12.8 mt -70.41 101.38 1.94 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.501 1.125 . . . . 74.41 109.275 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.585 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -121.32 174.62 6.61 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 124.552 1.157 . . . . 65.15 109.6 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.403 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -117.37 164.49 14.78 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.444 1.09 . . . . 74.4 109.252 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.4 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 21.0 tt0 -63.54 -11.4 24.04 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.512 1.132 . . . . 71.54 110.316 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -83.66 -45.93 12.89 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.488 1.118 . . . . 55.11 109.278 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -123.05 44.44 2.66 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.475 1.11 . . . . 74.52 109.324 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.585 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -76.03 -28.94 57.89 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.49 1.119 . . . . 71.54 110.42 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -84.72 -24.2 29.0 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.472 1.108 . . . . 73.23 109.408 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.423 ' HG3' ' ND2' ' A' ' 177' ' ' ASN . 0.0 OUTLIER -71.68 -54.73 9.38 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.495 1.122 . . . . 74.53 110.325 179.972 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.481 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -59.63 -35.63 74.75 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.471 1.107 . . . . 52.42 109.296 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.422 ' CD2' ' C ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -69.95 -49.6 50.17 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.537 1.148 . . . . 72.32 109.249 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.97 -37.83 4.29 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.515 1.134 . . . . 73.43 110.232 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.467 ' O ' ' N ' ' A' ' 99' ' ' LEU . 2.1 t -73.63 -64.51 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.489 1.118 . . . . 74.13 109.268 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.428 ' N ' HG11 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -41.67 -26.53 0.08 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.463 1.102 . . . . 74.2 110.302 -179.95 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.449 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.4 t-20 -71.34 -49.68 39.96 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.516 1.135 . . . . 73.3 109.286 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.506 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -74.95 -22.19 58.72 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.555 1.159 . . . . 74.12 109.333 -179.995 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.477 HD22 ' CD2' ' A' ' 99' ' ' LEU . 30.8 mt -62.83 -51.73 65.89 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.529 1.143 . . . . 71.25 109.281 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 101' ' ' GLN . 10.0 pt20 -79.81 51.48 1.32 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.538 1.149 . . . . 74.21 110.297 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -170.13 -66.55 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.566 1.166 . . . . 61.14 109.27 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -50.28 -44.67 53.95 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.466 1.104 . . . . 75.15 109.36 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.563 ' CE2' HG11 ' A' ' 206' ' ' VAL . 1.6 m-85 -116.5 -32.27 5.28 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.514 1.134 . . . . 74.53 111.011 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.429 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 98.47 44.7 2.47 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 124.474 1.109 . . . . 72.13 110.978 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.421 HG22 ' CD ' ' A' ' 80' ' ' LYS . 8.9 mm -84.1 72.64 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.519 0.776 . . . . 72.04 109.31 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.489 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -119.9 156.69 54.01 Favored Pre-proline 0 C--N 1.324 -0.51 0 O-C-N 124.515 1.135 . . . . 74.44 109.322 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.498 ' HG3' ' CE2' ' A' ' 78' ' ' PHE . 18.1 Cg_endo -75.06 164.39 88.49 Favored 'Cis proline' 0 C--N 1.359 1.121 0 C-N-CA 120.994 -2.502 . . . . 65.21 110.953 0.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.44 125.4 5.02 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.405 1.066 . . . . 74.22 111.008 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.461 ' CG2' HD13 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -141.17 130.27 24.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.439 0.729 . . . . 75.54 109.271 179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.454 ' CD1' ' HB2' ' A' ' 113' ' ' ALA . 1.8 pt -94.19 148.49 4.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 124.447 1.092 . . . . 74.21 109.326 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.57 ' CE1' HD23 ' A' ' 84' ' ' LEU . 2.6 t80 -51.59 -20.25 1.88 Allowed 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.49 1.119 . . . . 70.42 110.965 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.454 ' HB2' ' CD1' ' A' ' 111' ' ' ILE . . . -78.89 -35.98 42.78 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.512 1.132 . . . . 64.44 109.288 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -83.37 -24.87 31.83 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.474 1.109 . . . . 71.4 110.327 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 42.1 tpp -37.37 110.81 0.51 Allowed Pre-proline 0 C--N 1.326 -0.45 0 O-C-N 124.536 1.147 . . . . 75.24 110.997 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.95 -16.54 20.28 Favored 'Trans proline' 0 C--N 1.36 1.158 0 O-C-N 124.525 1.803 . . . . 75.33 110.994 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -42.76 -34.12 0.86 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.514 1.134 . . . . 75.51 109.629 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 179.58 165.02 32.98 Favored Glycine 0 CA--C 1.53 1.027 0 O-C-N 124.494 1.121 . . . . 63.42 110.967 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 36.6 mtt180 -41.38 -74.31 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.516 0.774 . . . . 74.53 110.345 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -133.47 -70.67 0.52 Allowed 'General case' 0 C--N 1.324 -0.535 0 O-C-N 124.553 1.158 . . . . 70.53 110.306 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -105.5 99.61 9.21 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.512 1.133 . . . . 74.01 109.571 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.547 ' CD1' ' N ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -110.94 -29.24 8.01 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.44 1.088 . . . . 75.03 109.279 179.995 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.416 ' N ' HD23 ' A' ' 122' ' ' LEU . 71.9 mm-40 -151.56 170.12 20.43 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.516 1.135 . . . . 72.14 110.313 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -43.97 149.84 0.3 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.491 1.119 . . . . 62.21 109.341 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.16 -17.37 26.6 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.564 1.165 . . . . 71.43 109.31 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -59.8 -20.23 55.52 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.504 1.127 . . . . 71.41 109.328 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -55.3 -21.87 16.49 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.434 1.084 . . . . 74.24 109.281 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.454 ' CB ' ' CD1' ' A' ' 84' ' ' LEU . . . -77.42 -40.87 41.99 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.488 1.118 . . . . 65.21 109.326 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 3.6 m -92.27 29.3 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 O-C-N 124.576 1.173 . . . . 73.53 109.26 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 24.4 m-20 -109.97 124.22 51.03 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.493 1.121 . . . . 73.32 109.283 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . 0.555 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 44.21 73.05 0.28 Allowed Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.532 1.145 . . . . 41.2 111.028 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' SER . . . . . 0.402 ' O ' ' O ' ' A' ' 167' ' ' TYR . 2.5 m -162.96 -175.79 4.56 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.491 0.76 . . . . 73.24 109.955 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.581 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -99.83 -77.11 0.53 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.497 1.123 . . . . 74.43 109.296 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.581 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 0.8 OUTLIER -125.18 176.16 6.91 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.544 1.153 . . . . 74.4 108.001 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.484 ' HB ' ' CG1' ' A' ' 82' ' ' VAL . 3.4 t -153.98 130.86 10.89 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.462 1.101 . . . . 73.33 110.423 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 1.4 mp -84.33 133.53 29.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.514 1.134 . . . . 64.04 109.303 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.597 ' CD1' ' CG1' ' A' ' 170' ' ' VAL . 10.2 mt -116.13 96.75 5.71 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.51 1.131 . . . . 75.11 109.311 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.505 ' O ' ' CD2' ' A' ' 143' ' ' PHE . 0.1 OUTLIER -62.34 92.08 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.522 1.139 . . . . 75.03 109.311 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 97.4 mt -68.43 111.04 4.42 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.513 1.133 . . . . 74.05 109.3 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.479 ' O ' ' CB ' ' A' ' 144' ' ' LEU . 4.5 m -124.61 160.97 27.26 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 124.482 1.114 . . . . 72.14 110.47 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -56.04 -39.12 71.51 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.523 1.14 . . . . 73.43 110.352 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -89.6 -52.62 4.92 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.452 1.095 . . . . 71.31 109.318 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.505 ' CD2' ' O ' ' A' ' 138' ' ' LEU . 55.3 t80 -53.23 -24.92 12.34 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.536 1.148 . . . . 74.22 110.968 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.479 ' CB ' ' O ' ' A' ' 140' ' ' THR . 2.0 tm? -70.95 -67.19 0.52 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.545 1.153 . . . . 75.34 109.304 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -46.23 -25.03 0.54 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.526 1.141 . . . . 70.32 110.296 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -81.03 -54.54 5.46 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.545 1.153 . . . . 74.02 109.263 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.545 ' O ' ' CG ' ' A' ' 151' ' ' PHE . 27.2 p -70.48 -7.54 44.23 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.497 1.123 . . . . 74.32 110.414 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.564 ' CZ2' ' HB3' ' A' ' 186' ' ' PRO . 0.8 OUTLIER -96.77 -25.75 15.39 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.447 1.092 . . . . 75.23 108.059 179.916 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 14.5 t -82.77 -39.48 21.77 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.448 1.093 . . . . 74.42 108.269 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.405 ' O ' ' N ' ' A' ' 154' ' ' TYR . 4.0 m120 -68.12 -53.13 27.6 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.442 1.089 . . . . 75.15 109.269 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.645 ' CE1' ' CD1' ' A' ' 157' ' ' LEU . 6.9 m-30 -46.43 -53.2 11.55 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.512 1.132 . . . . 75.52 111.01 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -46.83 -47.53 21.12 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.534 1.146 . . . . 74.43 110.301 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -79.54 -19.43 49.57 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.581 1.176 . . . . 74.41 110.965 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.405 ' N ' ' O ' ' A' ' 150' ' ' ASN . 3.1 m-30 -113.31 97.82 6.72 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.551 1.157 . . . . 73.54 110.998 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' THR . . . . . 0.416 ' O ' ' ND2' ' A' ' 159' ' ' ASN . 1.2 t -74.93 -3.01 29.63 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.509 1.131 . . . . 74.34 110.389 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 8.8 t -78.51 -67.82 0.7 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.578 1.174 . . . . 74.14 109.939 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.645 ' CD1' ' CE1' ' A' ' 151' ' ' PHE . 0.4 OUTLIER -44.04 -51.69 7.65 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.491 1.12 . . . . 71.34 109.263 -179.933 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' MET . . . . . 0.561 ' HE1' ' CD2' ' A' ' 151' ' ' PHE . 6.6 mmt -44.15 -43.24 6.91 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.558 1.161 . . . . 75.12 110.937 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' ASN . . . . . 0.416 ' ND2' ' O ' ' A' ' 155' ' ' THR . 17.6 m-20 -64.24 -42.29 96.6 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 75.42 109.241 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.403 ' CB ' HG23 ' A' ' 170' ' ' VAL . 1.3 m -59.37 -35.2 73.46 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.592 1.183 . . . . 72.14 110.001 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . 0.473 ' O ' ' CD1' ' A' ' 192' ' ' ILE . 36.1 t -62.08 -18.36 19.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 O-C-N 124.577 1.173 . . . . 73.13 109.348 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -87.48 11.42 14.79 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.579 1.174 . . . . 72.54 109.282 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.465 ' CZ ' HG23 ' A' ' 192' ' ' ILE . 0.6 OUTLIER 38.75 59.08 1.63 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.55 1.156 . . . . 74.5 110.271 -179.956 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -73.17 -173.11 1.23 Allowed 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.557 1.161 . . . . 74.11 110.284 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 27.6 p80 -85.59 51.04 2.08 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.528 1.143 . . . . 73.21 109.595 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.9 173.33 6.38 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.518 1.136 . . . . 75.45 109.23 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' TYR . . . . . 0.402 ' O ' ' O ' ' A' ' 132' ' ' SER . 28.2 p90 -87.46 40.33 0.92 Allowed 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.465 1.103 . . . . 75.1 110.964 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -164.16 124.13 2.06 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.519 1.137 . . . . 71.32 109.296 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' SER . . . . . 0.505 ' HB3' ' CD1' ' A' ' 134' ' ' TRP . 27.6 t -118.28 105.79 12.12 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.441 1.088 . . . . 74.23 110.052 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.597 ' CG1' ' CD1' ' A' ' 137' ' ' LEU . 5.0 t -79.53 122.08 34.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.495 1.122 . . . . 74.15 109.319 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.3 mp -128.67 113.74 19.24 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.464 1.103 . . . . 63.42 109.251 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . 0.483 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.1 Cg_endo -75.04 107.43 2.48 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.502 1.791 . . . . 74.21 110.992 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 3.2 ttt -87.75 152.25 22.27 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.501 1.126 . . . . 65.34 110.976 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . 0.403 ' NE ' ' O ' ' A' ' 180' ' ' LEU . 0.0 OUTLIER -100.76 112.41 64.64 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.509 1.131 . . . . 72.32 110.305 179.975 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.97 151.57 39.86 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.58 1.831 . . . . 74.02 111.026 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . 0.61 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -86.56 -42.68 13.31 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.581 1.175 . . . . 70.15 109.33 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . 0.423 ' ND2' ' HG3' ' A' ' 92' ' ' GLU . 7.2 p30 -72.17 -28.0 62.94 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.528 1.142 . . . . 71.21 109.269 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -110.7 98.19 36.41 Favored Pre-proline 0 C--N 1.324 -0.507 0 O-C-N 124.533 1.146 . . . . 73.4 109.325 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.98 114.98 4.15 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.565 1.824 . . . . 72.41 110.992 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . 0.483 ' CD1' ' OG1' ' A' ' 185' ' ' THR . 0.4 OUTLIER -121.88 96.65 46.8 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.509 1.131 . . . . 74.32 109.313 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.05 167.49 26.89 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.44 1.758 . . . . 63.41 110.989 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 14.4 ptt180 -61.55 -25.58 67.39 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.563 1.164 . . . . 71.22 110.33 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -71.31 -9.99 59.03 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.433 1.083 . . . . 72.51 110.343 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -112.95 -28.87 7.56 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.482 1.114 . . . . 74.04 110.295 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 185' ' ' THR . . . . . 0.483 ' OG1' ' CD1' ' A' ' 180' ' ' LEU . 53.4 m -72.3 143.92 86.29 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.463 1.102 . . . . 70.51 110.352 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . 0.564 ' HB3' ' CZ2' ' A' ' 148' ' ' TRP . 18.7 Cg_endo -74.96 146.56 32.96 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.492 1.785 . . . . 74.32 111.067 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 187' ' ' PHE . . . . . 0.492 ' O ' ' CG2' ' A' ' 191' ' ' THR . 24.7 p90 -61.69 -12.49 16.71 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.56 1.162 . . . . 73.54 110.991 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -87.05 -53.62 4.77 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.53 1.144 . . . . 72.32 109.306 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 23.2 mt -74.53 -16.34 60.83 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.562 1.164 . . . . 73.53 109.311 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 190' ' ' GLN . . . . . 0.401 ' O ' ' CG ' ' A' ' 190' ' ' GLN . 6.2 tt0 -86.68 -8.25 57.59 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.567 1.167 . . . . 72.54 110.243 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 191' ' ' THR . . . . . 0.492 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 31.5 p -115.73 18.71 15.63 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.515 1.134 . . . . 75.14 110.322 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.473 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 8.8 mt -130.73 145.84 34.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.444 1.09 . . . . 72.12 109.248 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -52.77 118.53 3.73 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.504 1.127 . . . . 74.11 109.27 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . 0.483 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -110.95 177.6 4.61 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.5 1.125 . . . . 73.33 109.297 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 195' ' ' LEU . . . . . 0.439 HD22 ' CD1' ' A' ' 209' ' ' ILE . 0.2 OUTLIER -109.63 127.84 54.82 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.452 1.095 . . . . 74.1 109.238 -179.958 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -109.51 120.04 41.28 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.526 1.141 . . . . 75.35 110.258 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . 0.578 ' OE1' ' CE1' ' A' ' 202' ' ' PHE . 12.0 tp10 -101.84 -22.41 14.36 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.516 1.135 . . . . 65.32 110.236 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . 0.433 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 1.3 pt-20 -94.06 9.88 35.9 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.455 1.097 . . . . 75.5 110.298 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 2.3 t -112.31 151.22 29.96 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.504 1.127 . . . . 64.1 109.979 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 26.5 ttt85 -64.23 -26.46 68.51 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.52 1.138 . . . . 74.51 110.286 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -89.51 26.7 8.75 Favored Glycine 0 CA--C 1.53 0.989 0 O-C-N 124.465 1.103 . . . . 63.04 111.001 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 202' ' ' PHE . . . . . 0.687 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 3.3 t80 -68.34 -38.72 13.75 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 124.506 0.768 . . . . 73.51 110.972 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 203' ' ' PRO . . . . . 0.687 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.1 Cg_endo -74.95 -30.11 7.59 Favored 'Trans proline' 0 C--N 1.36 1.168 0 O-C-N 124.519 1.8 . . . . 62.44 111.021 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -64.14 -65.73 0.64 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.475 1.109 . . . . 74.34 110.4 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 205' ' ' GLN . . . . . 0.402 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 2.4 mt-30 -50.09 -41.82 48.92 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.49 1.118 . . . . 73.34 110.334 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 206' ' ' VAL . . . . . 0.563 HG11 ' CE2' ' A' ' 104' ' ' PHE . 53.7 t -59.84 -30.06 44.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.514 1.134 . . . . 62.33 109.288 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -79.81 -53.25 6.96 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.516 1.135 . . . . 74.32 110.297 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -55.91 -59.15 5.3 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.503 1.127 . . . . 73.32 110.305 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 209' ' ' ILE . . . . . 0.439 ' CD1' HD22 ' A' ' 195' ' ' LEU . 73.2 mt -54.29 -59.15 2.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.572 1.17 . . . . 73.51 109.29 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 210' ' ' PHE . . . . . 0.571 ' HA ' ' CZ2' ' A' ' 134' ' ' TRP . 1.0 OUTLIER -92.17 62.34 4.11 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.501 1.126 . . . . 73.34 111.05 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.87 145.46 38.23 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.52 1.137 . . . . 73.32 110.289 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 215' ' ' TYR . 27.8 tt0 -49.11 -55.14 13.19 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.487 1.117 . . . . 74.14 110.333 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.68 -24.23 1.3 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.517 1.136 . . . . 71.54 110.022 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 40.4 t -96.31 -27.46 3.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.539 1.149 . . . . 63.31 109.265 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 215' ' ' TYR . . . . . 0.447 ' N ' ' O ' ' A' ' 212' ' ' GLU . 12.0 t80 -66.08 -27.21 67.9 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.493 1.121 . . . . 74.14 110.973 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . 0.443 ' O ' ' N ' ' A' ' 220' ' ' THR . 12.8 mmtp -59.49 -58.27 9.35 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.382 1.051 . . . . 53.14 109.274 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 4.4 m -50.1 -62.94 1.28 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.503 1.127 . . . . 73.41 110.355 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -54.2 -27.1 32.1 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.533 1.146 . . . . 64.25 110.333 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 219' ' ' GLN . . . . . 0.444 ' O ' ' NE2' ' A' ' 219' ' ' GLN . 30.8 tp60 -82.29 -25.86 33.63 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.464 1.102 . . . . 71.21 110.269 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 220' ' ' THR . . . . . 0.444 ' O ' ' CG ' ' A' ' 224' ' ' GLU . 1.1 m -88.09 -20.32 25.86 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.53 1.144 . . . . 74.54 110.388 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 221' ' ' ILE . . . . . . . . . . . . . 19.8 mt -82.12 -41.76 18.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.424 1.078 . . . . 74.15 109.27 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 222' ' ' TRP . . . . . 0.555 ' CD1' ' HA2' ' A' ' 131' ' ' GLY . 13.9 t90 -64.51 -55.86 17.9 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.507 1.13 . . . . 73.33 107.999 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.02 -18.64 25.48 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.46 1.1 . . . . 73.34 109.318 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . 0.444 ' CG ' ' O ' ' A' ' 220' ' ' THR . 3.0 mm-40 -90.0 -33.63 16.28 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.522 1.139 . . . . 72.35 110.304 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 4.1 t -65.17 -21.72 66.81 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.568 1.167 . . . . 72.43 110.383 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 1.1 mtm105 -77.85 -19.21 55.27 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.503 1.127 . . . . 72.52 110.275 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 227' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -87.39 -38.63 16.0 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.39 1.057 . . . . 70.33 109.316 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 9.6 mtm -60.2 -38.69 84.1 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.487 1.117 . . . . 73.45 110.989 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 229' ' ' VAL . . . . . . . . . . . . . 29.4 m -70.86 -48.55 56.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 O-C-N 124.501 1.126 . . . . 75.42 109.281 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 230' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.2 -5.6 42.88 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.449 1.093 . . . . 71.54 110.301 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -90.04 -82.42 0.27 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.595 1.184 . . . . 75.14 110.223 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 3.7 tp60 -141.36 35.86 1.68 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.547 1.154 . . . . 74.32 110.32 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -149.19 42.37 0.93 Allowed 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.465 1.103 . . . . 73.31 110.963 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 7.6 mm -53.2 150.74 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 O-C-N 124.488 1.118 . . . . 62.33 109.267 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.484 0 O-C-N 124.499 1.125 . . . . 75.54 109.35 179.922 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.997 0 N-CA-C 110.959 -0.857 . . . . 74.34 110.959 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 159.6 41.22 Favored 'Trans proline' 0 C--N 1.36 1.137 0 O-C-N 124.483 1.78 . . . . 74.23 111.001 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -105.45 126.55 52.25 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.501 1.126 . . . . 64.01 109.314 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 56.69 82.0 0.06 OUTLIER Glycine 0 CA--C 1.531 1.032 0 O-C-N 124.515 1.134 . . . . 65.3 111.019 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.4 p -109.43 171.44 7.44 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.57 0.806 . . . . 74.22 109.995 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 76' ' ' GLU . 31.5 tp10 -56.69 153.21 10.89 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.502 1.126 . . . . 61.03 110.302 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.404 ' N ' ' HG3' ' A' ' 75' ' ' GLU . 2.1 tt0 -136.06 127.84 29.18 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.48 1.112 . . . . 64.03 110.281 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.426 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 6.5 p -124.88 149.38 29.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 O-C-N 124.507 1.13 . . . . 74.31 109.274 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.415 ' O ' ' C ' ' A' ' 79' ' ' LEU . 34.1 t80 -80.38 12.76 2.77 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.463 1.102 . . . . 74.54 111.016 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.416 ' HG ' ' N ' ' A' ' 80' ' ' LYS . 15.5 tp -39.19 157.58 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.531 1.144 . . . . 75.43 109.299 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.546 ' NZ ' ' H ' ' A' ' 107' ' ' LYS . 5.0 ptpt -100.83 -45.81 5.33 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.515 1.134 . . . . 71.11 109.333 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.599 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.7 OUTLIER -167.78 129.1 1.46 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.46 1.1 . . . . 73.3 110.963 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.526 ' CG1' ' CG2' ' A' ' 135' ' ' THR . 9.3 p -84.51 174.33 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.506 1.129 . . . . 74.24 109.317 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.422 HD13 ' CZ ' ' A' ' 81' ' ' PHE . 2.1 mp -129.32 95.1 2.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.419 1.075 . . . . 73.54 109.344 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.465 ' HG ' ' CB ' ' A' ' 128' ' ' ALA . 1.0 OUTLIER -74.21 93.73 2.37 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.479 1.112 . . . . 74.41 109.232 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.609 ' CE1' ' OG1' ' A' ' 90' ' ' THR . 0.0 OUTLIER -112.85 174.49 5.87 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.49 1.119 . . . . 74.31 109.643 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.566 ' HB1' ' CD1' ' A' ' 143' ' ' PHE . . . -110.75 148.35 32.51 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.472 1.107 . . . . 71.52 109.276 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -50.3 -21.8 1.54 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.562 1.164 . . . . 74.52 110.411 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -77.37 -46.26 23.36 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.47 1.106 . . . . 75.21 109.299 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.42 ' CB ' HD13 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -117.05 44.46 2.07 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.581 1.176 . . . . 75.11 109.288 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.609 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -76.79 -44.1 34.12 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.478 1.112 . . . . 72.12 110.366 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -63.14 -37.67 88.13 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.487 1.117 . . . . 54.51 109.339 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.446 ' O ' ' N ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -55.63 -69.38 0.14 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.428 1.08 . . . . 73.24 110.339 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.483 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -47.73 -36.75 11.89 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.496 1.122 . . . . 74.45 109.268 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.486 ' O ' ' CD2' ' A' ' 94' ' ' LEU . 0.6 OUTLIER -67.7 -36.18 80.18 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.466 1.104 . . . . 75.42 109.364 179.936 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.446 ' N ' ' O ' ' A' ' 92' ' ' GLU . 17.5 tpp85 -61.0 -47.84 84.58 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.448 1.093 . . . . 73.54 110.32 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.549 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 0.3 OUTLIER -69.59 -52.83 28.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.595 1.185 . . . . 74.14 109.31 179.993 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.549 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -51.8 -17.77 1.05 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.612 1.195 . . . . 72.33 110.347 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.411 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -81.83 -52.41 7.14 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.484 1.115 . . . . 74.21 109.27 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.491 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -68.16 -22.46 64.85 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.475 1.109 . . . . 74.43 109.328 -179.937 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.427 ' N ' HD22 ' A' ' 99' ' ' LEU . 32.8 mt -66.81 -48.36 69.19 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.46 1.1 . . . . 73.04 109.298 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -79.52 52.84 1.45 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.501 1.126 . . . . 73.31 110.323 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -175.97 -64.17 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.529 1.143 . . . . 73.5 109.263 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -46.01 -45.95 16.19 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.473 1.108 . . . . 63.21 109.283 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -116.47 -32.02 5.38 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.444 1.09 . . . . 70.52 111.01 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.405 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 108.15 37.9 2.07 Favored Glycine 0 CA--C 1.53 1.02 0 O-C-N 124.538 1.148 . . . . 73.44 111.015 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.457 HG21 ' CE1' ' A' ' 81' ' ' PHE . 16.6 mm -78.56 74.87 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.516 0.774 . . . . 75.12 109.362 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.546 ' H ' ' NZ ' ' A' ' 80' ' ' LYS . 0.0 OUTLIER -126.92 155.99 74.76 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.516 1.135 . . . . 72.11 109.28 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.493 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.4 Cg_endo -74.94 161.22 95.27 Favored 'Cis proline' 0 C--N 1.36 1.152 0 C-N-CA 121.026 -2.489 . . . . 74.24 111.02 -0.031 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -117.6 119.3 4.38 Favored Glycine 0 CA--C 1.53 0.97 0 O-C-N 124.422 1.076 . . . . 73.13 111.036 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.95 128.59 31.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.469 0.746 . . . . 73.14 109.287 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.409 HD13 ' NE2' ' A' ' 85' ' ' HIS . 39.3 pt -89.28 174.4 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.456 1.097 . . . . 73.23 109.323 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.503 ' CE1' ' CB ' ' A' ' 128' ' ' ALA . 2.4 t80 -75.2 -18.65 60.1 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.418 1.074 . . . . 71.41 110.967 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.5 -3.11 53.53 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.493 1.121 . . . . 71.32 109.256 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -107.65 -26.74 10.71 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.532 1.145 . . . . 71.13 110.281 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.465 ' CE ' HG23 ' A' ' 82' ' ' VAL . 35.6 tpp -41.72 110.77 0.81 Allowed Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.502 1.126 . . . . 74.25 111.011 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -74.92 115.35 4.26 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.479 1.779 . . . . 74.4 111.066 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.454 ' CD2' ' HG3' ' A' ' 115' ' ' MET . 12.2 m-70 -121.02 -176.34 3.25 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.511 1.132 . . . . 75.43 109.616 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -77.37 -146.86 2.56 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.526 1.141 . . . . 61.33 111.018 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 31.2 ttp85 -107.64 42.1 1.4 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.475 0.75 . . . . 74.11 110.276 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -122.79 158.91 29.19 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.528 1.143 . . . . 75.44 110.303 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . 0.403 ' CD2' ' H ' ' A' ' 121' ' ' HIS . 4.4 p80 -96.29 79.71 3.15 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.462 1.101 . . . . 73.24 109.587 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.402 ' CD1' ' N ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -44.2 145.45 0.78 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.517 1.135 . . . . 74.24 109.322 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -132.13 11.04 4.6 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.494 1.121 . . . . 72.13 110.283 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -113.28 116.74 30.22 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.422 1.076 . . . . 71.02 109.351 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.472 ' CD1' ' CD1' ' A' ' 157' ' ' LEU . 3.6 pp -85.3 -17.25 37.44 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.567 1.167 . . . . 65.13 109.304 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -63.09 -14.3 46.7 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.566 1.166 . . . . 74.55 109.332 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.48 -48.79 65.7 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.438 1.087 . . . . 74.12 109.292 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.503 ' CB ' ' CE1' ' A' ' 112' ' ' PHE . . . -65.64 -22.71 66.67 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.499 1.124 . . . . 74.33 109.357 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.456 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 70.9 t -86.6 10.04 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.517 1.136 . . . . 72.23 109.339 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -135.64 119.34 17.15 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 124.534 1.146 . . . . 75.22 109.302 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 91.76 47.98 3.29 Favored Glycine 0 CA--C 1.53 0.974 0 O-C-N 124.474 1.109 . . . . 71.13 111.033 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 3.2 m -163.35 171.14 16.5 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.496 0.762 . . . . 75.31 109.956 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.579 ' HB2' ' CE3' ' A' ' 134' ' ' TRP . . . -104.85 -27.35 11.79 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.535 1.147 . . . . 74.34 109.251 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.579 ' CE3' ' HB2' ' A' ' 133' ' ' ALA . 6.6 m-90 -158.82 157.83 32.34 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.536 1.148 . . . . 74.23 108.0 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.526 ' CG2' ' CG1' ' A' ' 82' ' ' VAL . 6.3 p -140.56 128.77 22.31 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.5 1.125 . . . . 64.22 110.412 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.411 ' HA ' ' O ' ' A' ' 171' ' ' ILE . 1.4 mp -84.07 149.6 4.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 124.423 1.077 . . . . 71.23 109.321 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.453 ' CD1' HG12 ' A' ' 170' ' ' VAL . 47.6 mt -131.35 108.02 9.35 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.507 1.13 . . . . 74.01 109.356 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.603 ' O ' ' CD2' ' A' ' 143' ' ' PHE . 1.4 mm? -62.35 93.25 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.502 1.126 . . . . 72.1 109.306 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.444 ' CD2' HG22 ' A' ' 185' ' ' THR . 6.3 tp -69.12 99.15 1.08 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.55 1.156 . . . . 73.14 109.334 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.427 ' O ' ' N ' ' A' ' 144' ' ' LEU . 2.5 m -127.05 162.68 25.47 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.568 1.167 . . . . 74.21 110.401 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -69.41 -29.95 67.81 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.5 1.125 . . . . 70.5 110.329 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -89.61 -25.06 21.49 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.457 1.098 . . . . 70.24 109.318 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.636 ' CE2' ' CG2' ' A' ' 147' ' ' THR . 82.0 t80 -90.16 -19.8 23.82 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.472 1.107 . . . . 73.02 111.016 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' A' ' 140' ' ' THR . 2.7 tm? -53.62 -67.61 0.24 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.602 1.188 . . . . 75.43 109.292 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 54.6 mmm-85 -57.98 -16.38 12.25 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.545 1.153 . . . . 71.01 110.273 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -77.47 -34.68 54.27 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.522 1.139 . . . . 64.12 109.336 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.636 ' CG2' ' CE2' ' A' ' 143' ' ' PHE . 2.1 p -102.87 -8.3 20.85 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.555 1.16 . . . . 73.33 110.406 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.421 ' N ' ' O ' ' A' ' 144' ' ' LEU . 0.3 OUTLIER -95.85 -25.35 16.05 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.077 -1.082 . . . . 75.11 108.077 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 16.8 t -92.53 -37.71 12.34 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.534 1.146 . . . . 71.34 108.275 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.516 ' O ' ' CG ' ' A' ' 154' ' ' TYR . 68.7 m-20 -68.47 -49.65 58.25 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.52 1.137 . . . . 73.44 109.255 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.649 ' CE2' ' CG2' ' A' ' 161' ' ' VAL . 6.4 m-30 -60.88 -55.33 34.34 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.505 1.128 . . . . 71.43 111.007 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 30.3 tp60 -48.1 -47.74 34.16 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.517 1.136 . . . . 71.32 110.323 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -74.1 -20.3 60.31 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.495 1.122 . . . . 74.24 110.962 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.516 ' CG ' ' O ' ' A' ' 150' ' ' ASN . 15.8 m-30 -117.79 83.2 1.95 Allowed 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.49 1.119 . . . . 71.42 111.032 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.3 t -49.7 -22.84 1.49 Allowed 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.429 1.081 . . . . 73.25 110.364 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 11.3 p -62.03 -40.58 96.22 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.49 1.119 . . . . 73.41 109.992 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.472 ' CD1' ' CD1' ' A' ' 125' ' ' LEU . 6.4 mt -68.5 -47.41 67.07 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.441 1.088 . . . . 65.0 109.272 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' MET . . . . . 0.41 ' HE2' ' CB ' ' A' ' 161' ' ' VAL . 5.3 mmt -47.04 -33.04 4.45 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.512 1.133 . . . . 64.42 111.0 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -66.11 -44.76 83.36 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 124.496 1.122 . . . . 54.33 109.328 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.475 ' HB3' ' CG2' ' A' ' 170' ' ' VAL . 1.4 m -71.83 -28.76 63.79 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.542 1.151 . . . . 74.24 110.011 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . 0.649 ' CG2' ' CE2' ' A' ' 151' ' ' PHE . 3.5 t -56.84 -18.08 6.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.508 1.13 . . . . 73.25 109.318 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . 0.479 ' O ' ' N ' ' A' ' 164' ' ' GLN . 1.5 t-20 -90.61 20.97 4.24 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.491 1.12 . . . . 74.14 109.354 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.422 ' C ' ' O ' ' A' ' 162' ' ' ASN . 0.1 OUTLIER 36.43 31.79 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.492 1.12 . . . . 74.33 110.294 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . 0.479 ' N ' ' O ' ' A' ' 162' ' ' ASN . 34.1 mt-30 -38.34 132.03 1.12 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.471 1.107 . . . . 73.23 110.224 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.527 ' CG ' ' O ' ' A' ' 165' ' ' HIS . 5.4 p80 -69.47 72.2 0.32 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.513 1.133 . . . . 73.43 109.565 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . 0.44 ' O ' ' NE2' ' A' ' 218' ' ' GLN . 0.5 OUTLIER -125.13 -178.7 4.28 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.467 1.104 . . . . 71.1 109.336 179.928 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' TYR . . . . . 0.414 ' N ' HG22 ' A' ' 221' ' ' ILE . 37.8 p90 -49.82 -35.83 24.38 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.662 1.226 . . . . 73.0 111.029 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -117.12 129.41 55.95 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.52 1.138 . . . . 74.3 109.323 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -119.87 155.59 32.37 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.436 1.085 . . . . 62.51 109.992 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.475 ' CG2' ' HB3' ' A' ' 160' ' ' SER . 18.5 t -118.82 122.06 68.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.437 1.086 . . . . 74.22 109.26 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . 0.411 ' O ' ' HA ' ' A' ' 136' ' ' ILE . 1.7 mp -127.1 112.84 21.71 Favored Pre-proline 0 C--N 1.324 -0.522 0 O-C-N 124.503 1.127 . . . . 74.22 109.348 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . 0.496 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.96 106.6 2.3 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.518 1.799 . . . . 75.33 111.024 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 11.0 ttt -82.92 166.32 18.99 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.531 1.144 . . . . 74.33 110.943 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 17.0 mmm-85 -131.21 126.47 21.47 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.485 1.115 . . . . 74.21 110.356 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.01 163.18 35.83 Favored 'Trans proline' 0 C--N 1.36 1.14 0 O-C-N 124.481 1.78 . . . . 73.44 110.984 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . 0.626 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -94.85 -47.19 6.56 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.531 1.144 . . . . 75.33 109.289 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -71.27 -25.27 62.39 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.533 1.146 . . . . 73.35 109.365 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -109.39 100.95 43.78 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.551 1.157 . . . . 72.52 109.305 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.03 138.92 23.59 Favored 'Trans proline' 0 C--N 1.361 1.205 0 O-C-N 124.488 1.783 . . . . 72.31 111.037 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -141.18 96.76 7.08 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.465 1.103 . . . . 73.43 109.314 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.95 166.31 29.51 Favored 'Trans proline' 0 C--N 1.361 1.22 0 O-C-N 124.51 1.795 . . . . 61.51 111.039 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 26.2 mtm105 -60.38 -26.72 66.86 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.467 1.104 . . . . 75.42 110.283 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -61.49 -18.74 60.42 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.514 1.134 . . . . 72.41 110.367 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -113.09 -0.59 14.66 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.508 1.13 . . . . 74.12 110.265 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 185' ' ' THR . . . . . 0.444 HG22 ' CD2' ' A' ' 139' ' ' LEU . 20.6 m -108.53 143.66 27.94 Favored Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.493 1.12 . . . . 62.22 110.368 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 185' ' ' THR . 18.5 Cg_endo -74.95 155.78 43.18 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.428 1.751 . . . . 75.31 111.027 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 187' ' ' PHE . . . . . 0.502 ' O ' ' CG2' ' A' ' 191' ' ' THR . 49.3 p90 -69.45 -7.27 36.43 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.541 1.151 . . . . 74.51 111.024 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.81 -52.91 4.23 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.551 1.157 . . . . 53.43 109.305 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 44.6 mt -68.57 -42.3 78.49 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.515 1.134 . . . . 72.12 109.285 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -63.73 -11.09 23.26 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.551 1.157 . . . . 75.44 110.334 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 191' ' ' THR . . . . . 0.502 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 35.5 p -113.35 6.91 17.49 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.451 1.095 . . . . 64.42 110.383 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.476 ' CG2' ' N ' ' A' ' 193' ' ' ASN . 7.5 mt -103.79 162.2 4.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.465 1.103 . . . . 74.31 109.315 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 193' ' ' ASN . . . . . 0.476 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 30.8 p-10 -66.57 74.44 0.1 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.553 1.158 . . . . 75.11 109.251 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . 0.496 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -79.3 128.58 33.5 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.617 1.198 . . . . 74.32 109.298 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 195' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.47 124.8 24.56 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.45 1.094 . . . . 71.43 109.241 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -109.18 111.18 22.65 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.468 1.105 . . . . 72.32 110.379 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . 0.594 ' OE2' ' CD1' ' A' ' 202' ' ' PHE . 35.6 tp10 -87.7 -22.45 24.63 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.547 1.154 . . . . 75.31 110.278 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . 0.47 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 7.3 pt-20 -95.08 22.86 6.16 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.451 1.095 . . . . 74.44 110.275 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 4.0 t -127.58 143.91 51.12 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.548 1.155 . . . . 74.13 109.936 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 55.1 mtt180 -58.79 -20.93 54.38 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.537 1.148 . . . . 71.23 110.29 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -88.77 11.53 68.46 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.517 1.136 . . . . 55.34 110.97 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 202' ' ' PHE . . . . . 0.594 ' CD1' ' OE2' ' A' ' 197' ' ' GLU . 0.1 OUTLIER -53.45 -45.19 98.64 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.531 0.783 . . . . 72.1 110.976 179.967 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 203' ' ' PRO . . . . . 0.594 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.07 -37.89 1.8 Allowed 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.518 1.799 . . . . 70.4 110.944 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.49 -49.54 72.28 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.506 1.129 . . . . 75.4 110.367 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -68.86 -41.35 78.53 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.51 1.131 . . . . 74.22 110.314 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 206' ' ' VAL . . . . . 0.508 ' CG2' ' O ' ' A' ' 202' ' ' PHE . 69.3 t -64.64 -27.37 42.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.476 1.11 . . . . 75.03 109.283 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -80.64 -51.1 9.1 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.45 1.094 . . . . 72.44 110.349 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 87.6 mtt-85 -64.43 -62.31 1.68 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.461 1.101 . . . . 73.43 110.278 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 209' ' ' ILE . . . . . 0.639 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 90.9 mt -46.87 -44.75 7.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.454 1.096 . . . . 75.11 109.286 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 210' ' ' PHE . . . . . 0.639 ' CE1' ' CG2' ' A' ' 209' ' ' ILE . 1.3 m-85 -111.92 67.82 0.66 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.521 1.138 . . . . 74.42 111.066 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -110.7 143.61 40.92 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.508 1.13 . . . . 71.32 110.267 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.456 ' O ' ' N ' ' A' ' 215' ' ' TYR . 23.8 tt0 -49.58 -54.66 16.95 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.403 1.064 . . . . 70.12 110.273 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.89 -24.29 0.98 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.571 1.169 . . . . 72.12 110.005 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 40.0 t -96.15 -29.71 3.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.489 1.118 . . . . 72.44 109.294 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 215' ' ' TYR . . . . . 0.456 ' N ' ' O ' ' A' ' 212' ' ' GLU . 6.3 t80 -64.5 -34.08 77.38 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.477 1.111 . . . . 72.52 111.006 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp -55.59 -59.88 4.21 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 71.01 109.326 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 217' ' ' THR . . . . . 0.456 ' O ' ' N ' ' A' ' 220' ' ' THR . 99.2 m -58.43 -66.45 0.49 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.523 1.139 . . . . 75.14 110.386 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 218' ' ' GLN . . . . . 0.44 ' NE2' ' O ' ' A' ' 166' ' ' LYS . 28.0 mm-40 -39.44 -40.48 0.83 Allowed 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.527 1.142 . . . . 72.42 110.313 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 219' ' ' GLN . . . . . 0.449 ' O ' ' NE2' ' A' ' 219' ' ' GLN . 16.9 tp60 -65.96 -46.66 77.32 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.441 1.088 . . . . 70.43 110.254 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 220' ' ' THR . . . . . 0.456 ' N ' ' O ' ' A' ' 217' ' ' THR . 1.3 m -68.04 -23.1 64.94 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.506 1.129 . . . . 64.45 110.435 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 221' ' ' ILE . . . . . 0.438 HD11 ' CG2' ' A' ' 217' ' ' THR . 17.1 mt -78.6 -32.5 16.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 O-C-N 124.508 1.13 . . . . 75.51 109.33 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 222' ' ' TRP . . . . . 0.459 ' O ' ' CG2' ' A' ' 225' ' ' THR . 26.5 t90 -71.13 -50.59 31.94 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.539 1.15 . . . . 75.15 108.038 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.95 -18.04 63.85 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.425 1.078 . . . . 74.3 109.285 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -92.63 -28.1 16.91 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.47 1.106 . . . . 75.34 110.28 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 225' ' ' THR . . . . . 0.459 ' CG2' ' O ' ' A' ' 222' ' ' TRP . 6.2 t -62.87 -20.38 65.06 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.453 1.095 . . . . 72.45 110.362 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 1.8 mtm180 -77.8 -16.46 58.34 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.514 1.134 . . . . 72.24 110.343 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 227' ' ' ASN . . . . . 0.448 ' O ' ' N ' ' A' ' 231' ' ' ARG . 1.0 OUTLIER -87.15 -41.37 13.82 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.496 1.123 . . . . 72.44 109.266 179.972 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 8.8 mtt -58.81 -41.06 85.92 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.528 1.142 . . . . 75.22 111.009 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 229' ' ' VAL . . . . . 0.413 HG11 ' N ' ' A' ' 230' ' ' GLN . 8.3 p -67.19 -48.72 77.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.486 1.116 . . . . 72.22 109.316 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 230' ' ' GLN . . . . . 0.413 ' N ' HG11 ' A' ' 229' ' ' VAL . 2.6 tp60 -77.54 -2.67 36.78 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.464 1.102 . . . . 73.1 110.305 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 231' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 227' ' ' ASN . 10.4 tpt180 -92.04 -75.02 0.49 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.535 1.147 . . . . 74.11 110.324 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -149.54 39.78 0.82 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.477 1.11 . . . . 72.35 110.274 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -151.22 39.15 0.66 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 63.43 110.938 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . 0.457 ' CG2' ' N ' ' A' ' 235' ' ' ALA . 2.0 mp -42.16 161.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 O-C-N 124.527 1.142 . . . . 70.41 109.288 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 235' ' ' ALA . . . . . 0.457 ' N ' ' CG2' ' A' ' 234' ' ' ILE . . . . . . . . 0 C--N 1.325 -0.473 0 O-C-N 124.453 1.096 . . . . 62.04 109.317 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.975 0 N-CA-C 111.018 -0.833 . . . . 62.01 111.018 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.02 177.04 9.13 Favored 'Trans proline' 0 C--N 1.36 1.175 0 O-C-N 124.442 1.759 . . . . 71.44 111.03 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.53 138.73 41.72 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.483 1.114 . . . . 73.43 109.297 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 37.9 58.47 1.51 Allowed Glycine 0 CA--C 1.53 1.027 0 O-C-N 124.477 1.11 . . . . 63.2 110.956 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.32 169.56 13.59 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.53 0.782 . . . . 72.25 109.992 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' A' ' 76' ' ' GLU . 16.8 tp10 -88.48 163.44 15.93 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.537 1.148 . . . . 75.02 110.288 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.411 ' N ' ' HG3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -131.64 143.87 50.63 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.496 1.123 . . . . 75.12 110.277 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.41 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 5.8 p -174.65 159.2 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.47 1.106 . . . . 72.11 109.329 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.404 ' O ' ' C ' ' A' ' 79' ' ' LEU . 55.1 p90 -88.56 24.37 1.99 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.436 1.085 . . . . 74.23 110.966 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.404 ' C ' ' O ' ' A' ' 78' ' ' PHE . 6.6 tp -40.14 152.77 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.463 1.102 . . . . 74.34 109.27 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.47 ' CD ' HG22 ' A' ' 106' ' ' ILE . 6.4 ttmt -92.43 -60.29 1.87 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.522 1.139 . . . . 73.21 109.281 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.548 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.4 OUTLIER -162.14 138.69 7.95 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.532 1.145 . . . . 75.41 110.969 179.996 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.485 ' CG1' ' O ' ' A' ' 128' ' ' ALA . 2.8 p -89.63 160.23 2.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 O-C-N 124.567 1.167 . . . . 73.32 109.347 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.413 ' N ' HG23 ' A' ' 82' ' ' VAL . 4.3 mp -118.13 92.46 2.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.499 1.124 . . . . 73.3 109.33 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.437 ' HG ' ' CB ' ' A' ' 128' ' ' ALA . 6.1 mt -70.18 118.73 13.38 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.54 1.15 . . . . 73.25 109.291 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.576 ' CE1' ' OG1' ' A' ' 90' ' ' THR . 0.0 OUTLIER -143.89 174.53 10.75 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.463 1.102 . . . . 75.22 109.574 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -110.85 152.1 27.07 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.463 1.102 . . . . 74.34 109.273 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.09 -18.34 5.33 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.439 1.087 . . . . 75.23 110.277 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -69.97 -46.35 65.42 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.586 1.179 . . . . 72.44 109.225 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.435 ' CG ' ' ND2' ' A' ' 178' ' ' ASN . 2.5 m-20 -130.16 43.76 3.07 Favored 'General case' 0 C--N 1.323 -0.557 0 O-C-N 124.497 1.123 . . . . 73.03 109.319 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.576 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -73.91 -20.85 60.27 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.54 1.15 . . . . 74.21 110.412 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -81.44 -39.13 25.34 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.568 1.167 . . . . 71.41 109.301 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -59.86 -50.46 73.7 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 124.535 1.147 . . . . 71.11 110.261 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.537 ' CB ' ' CD2' ' A' ' 138' ' ' LEU . . . -59.93 -35.09 74.17 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.446 1.091 . . . . 61.42 109.286 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.503 ' CD2' ' C ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -68.66 -44.62 73.72 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.518 1.136 . . . . 73.03 109.306 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.408 ' N ' HD13 ' A' ' 94' ' ' LEU . 8.8 tpt180 -48.94 -31.57 7.56 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.58 1.175 . . . . 72.32 110.261 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.504 ' CG2' ' OE2' ' A' ' 197' ' ' GLU . 2.1 t -78.64 -65.26 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.557 1.16 . . . . 61.31 109.288 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.436 ' NE2' ' O ' ' A' ' 109' ' ' GLY . 0.0 OUTLIER -40.3 -27.35 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.486 1.117 . . . . 75.13 110.315 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.455 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.3 t-20 -71.75 -60.48 2.21 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.475 1.11 . . . . 73.04 109.288 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.47 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -61.6 -22.55 65.32 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.542 1.151 . . . . 74.22 109.339 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.417 ' N ' HD23 ' A' ' 99' ' ' LEU . 26.7 mt -65.59 -50.81 63.73 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.492 1.12 . . . . 74.41 109.277 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -76.97 55.69 1.14 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.469 1.105 . . . . 75.12 110.311 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.0 t70 179.71 -63.29 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.489 1.118 . . . . 73.14 109.299 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.559 ' HB3' ' CD1' ' A' ' 104' ' ' PHE . 64.0 t0 -43.99 -53.71 6.03 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.488 1.117 . . . . 75.32 109.292 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.559 ' CD1' ' HB3' ' A' ' 103' ' ' ASP . 0.3 OUTLIER -113.43 -23.87 9.61 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.496 1.123 . . . . 72.34 111.014 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.98 37.68 4.33 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.509 1.131 . . . . 74.44 111.036 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.47 HG22 ' CD ' ' A' ' 80' ' ' LYS . 8.1 mm -81.97 81.14 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.436 0.727 . . . . 75.13 109.362 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.483 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -128.21 156.76 76.06 Favored Pre-proline 0 C--N 1.325 -0.459 0 O-C-N 124.537 1.148 . . . . 65.24 109.276 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.483 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.93 152.89 98.8 Favored 'Cis proline' 0 C--N 1.36 1.141 0 C-N-CA 121.052 -2.479 . . . . 74.14 111.015 -0.062 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.436 ' O ' ' NE2' ' A' ' 97' ' ' GLN . . . -119.28 110.86 1.95 Allowed Glycine 0 CA--C 1.531 1.043 0 O-C-N 124.513 1.133 . . . . 62.33 111.018 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.473 ' CD1' ' HA ' ' A' ' 115' ' ' MET . 0.3 OUTLIER -129.02 144.68 37.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.54 0.788 . . . . 72.32 109.32 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.408 ' HB ' ' NE2' ' A' ' 85' ' ' HIS . 20.7 pt -97.16 -177.3 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.499 1.124 . . . . 71.33 109.275 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.509 ' CD1' ' SD ' ' A' ' 115' ' ' MET . 2.2 t80 -81.77 -18.85 42.73 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.464 1.103 . . . . 75.04 110.964 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -96.44 -2.55 45.2 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.479 1.112 . . . . 73.13 109.312 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.401 ' CG ' ' CG1' ' A' ' 111' ' ' ILE . 67.1 mm-40 -110.44 -26.69 9.39 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.465 1.103 . . . . 73.53 110.328 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.509 ' SD ' ' CD1' ' A' ' 112' ' ' PHE . 1.2 ptp -70.02 135.03 87.4 Favored Pre-proline 0 C--N 1.325 -0.462 0 O-C-N 124.534 1.146 . . . . 73.01 111.016 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.93 122.04 6.99 Favored 'Trans proline' 0 C--N 1.36 1.163 0 O-C-N 124.51 1.795 . . . . 53.45 111.004 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -90.73 159.9 16.1 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.495 1.122 . . . . 75.55 109.591 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -101.73 -9.58 42.93 Favored Glycine 0 CA--C 1.531 1.06 0 O-C-N 124.566 1.167 . . . . 53.42 110.954 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 22.4 mtp85 -138.26 147.77 44.0 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.526 0.78 . . . . 75.54 110.314 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -49.56 -42.07 43.28 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.531 1.144 . . . . 72.23 110.255 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -93.69 138.62 31.71 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.528 1.143 . . . . 74.34 109.624 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.466 ' CD1' ' N ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -127.77 36.18 4.38 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.465 1.103 . . . . 71.23 109.282 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -63.29 -16.03 59.07 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.478 1.111 . . . . 73.23 110.324 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -86.48 106.48 17.51 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.507 1.129 . . . . 73.55 109.338 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.496 ' CD2' ' OD1' ' A' ' 150' ' ' ASN . 1.0 OUTLIER -83.9 -17.36 41.02 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.489 1.118 . . . . 65.03 109.296 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.407 ' O ' ' N ' ' A' ' 129' ' ' VAL . 10.9 t70 -49.69 -37.49 29.05 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.47 1.106 . . . . 74.21 109.26 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -50.88 -41.31 58.14 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.551 1.157 . . . . 75.12 109.335 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.485 ' O ' ' CG1' ' A' ' 82' ' ' VAL . . . -69.99 -26.44 64.08 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.493 1.12 . . . . 75.41 109.246 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.482 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 63.1 t -89.11 14.38 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.509 1.131 . . . . 64.24 109.281 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -111.55 140.06 46.47 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.464 1.102 . . . . 75.44 109.272 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . 0.485 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 39.29 77.78 0.06 OUTLIER Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.485 1.116 . . . . 73.25 110.98 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -163.48 167.02 22.04 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.475 0.75 . . . . 75.22 110.017 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.644 ' CB ' ' CZ3' ' A' ' 134' ' ' TRP . . . -95.67 -36.0 11.38 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.549 1.156 . . . . 71.43 109.285 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.644 ' CZ3' ' CB ' ' A' ' 133' ' ' ALA . 1.1 m-90 -161.57 170.13 20.42 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.505 1.128 . . . . 74.32 108.039 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 56.2 p -138.78 138.19 37.37 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.573 1.171 . . . . 73.25 110.41 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 39.2 mm -84.35 140.97 15.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.491 1.119 . . . . 64.41 109.28 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -128.61 86.97 2.51 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.509 1.131 . . . . 72.3 109.323 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.537 ' CD2' ' CB ' ' A' ' 93' ' ' ALA . 0.3 OUTLIER -62.74 88.06 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.48 1.112 . . . . 74.53 109.306 -179.99 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.81 116.64 4.99 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.503 1.127 . . . . 75.42 109.246 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.456 ' HB ' ' CB ' ' A' ' 143' ' ' PHE . 7.4 m -136.41 169.69 17.26 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.491 1.12 . . . . 71.53 110.381 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -64.25 -39.74 94.58 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.559 1.162 . . . . 75.52 110.275 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . 0.441 ' CG ' ' N ' ' A' ' 143' ' ' PHE . 7.9 p30 -89.54 -46.74 8.46 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.45 1.094 . . . . 73.33 109.279 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.626 ' CE1' ' CG2' ' A' ' 147' ' ' THR . 7.1 t80 -53.07 -25.94 14.47 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.481 1.113 . . . . 72.12 110.951 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.483 ' C ' ' CD1' ' A' ' 144' ' ' LEU . 1.8 tm? -54.46 -68.11 0.21 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.54 1.15 . . . . 75.35 109.319 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.459 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 28.5 mmm180 -65.94 -14.33 61.38 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.415 1.072 . . . . 61.41 110.313 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -70.69 -51.87 24.82 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.511 1.132 . . . . 74.23 109.349 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.626 ' CG2' ' CE1' ' A' ' 143' ' ' PHE . 4.3 p -92.75 -52.99 4.35 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.513 1.133 . . . . 74.31 110.422 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.498 ' CH2' ' CB ' ' A' ' 186' ' ' PRO . 20.5 t-105 -41.87 -47.4 4.22 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.565 1.165 . . . . 74.32 107.977 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . 0.459 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 7.4 t -69.85 -44.54 69.66 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.436 1.085 . . . . 52.24 108.322 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.496 ' OD1' ' CD2' ' A' ' 125' ' ' LEU . 34.2 t-20 -51.7 -29.52 18.63 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.465 1.103 . . . . 74.13 109.302 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.564 ' CZ ' ' HB ' ' A' ' 147' ' ' THR . 8.2 m-30 -77.6 -44.94 26.73 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.472 1.108 . . . . 75.32 111.005 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 42.2 tp60 -41.46 -39.73 1.59 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.437 1.086 . . . . 74.15 110.256 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -80.78 -34.3 34.27 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.453 1.096 . . . . 74.42 110.959 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.441 ' N ' ' O ' ' A' ' 151' ' ' PHE . 3.3 m-85 -117.05 87.52 2.72 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.558 1.161 . . . . 75.23 111.015 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 2.3 t -60.14 -25.17 65.3 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.451 1.095 . . . . 72.11 110.368 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 54.7 p -58.57 -16.88 17.62 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 124.527 1.142 . . . . 72.14 109.998 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.564 ' HG ' ' CD1' ' A' ' 151' ' ' PHE . 0.2 OUTLIER -75.85 -51.73 11.91 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.451 1.094 . . . . 73.52 109.316 -179.97 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' MET . . . . . 0.446 ' HA ' ' CE ' ' A' ' 158' ' ' MET . 5.6 mmt -50.04 -32.99 16.79 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.436 1.085 . . . . 64.01 110.962 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -64.16 -38.6 91.63 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.524 1.14 . . . . 74.45 109.312 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.433 ' CB ' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -66.19 -33.1 75.0 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.555 1.159 . . . . 73.43 109.948 -179.962 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . 0.496 ' O ' ' CD1' ' A' ' 192' ' ' ILE . 48.3 t -59.09 -18.16 13.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.425 1.078 . . . . 71.11 109.358 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 30.8 m-20 -77.95 -27.71 49.35 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.46 1.1 . . . . 73.34 109.308 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.404 ' O ' ' O ' ' A' ' 164' ' ' GLN . 21.3 mtp180 68.78 29.06 5.3 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.464 1.102 . . . . 74.4 110.253 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . 0.404 ' O ' ' O ' ' A' ' 163' ' ' ARG . 8.8 mt-30 -50.75 -177.84 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.527 1.142 . . . . 72.23 110.315 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -78.93 70.64 5.3 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.577 1.173 . . . . 75.31 109.567 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.92 177.47 5.75 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.496 1.122 . . . . 74.22 109.353 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' TYR . . . . . 0.417 ' N ' HG23 ' A' ' 221' ' ' ILE . 49.9 p90 -90.02 29.85 1.16 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.489 1.118 . . . . 75.22 110.957 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.467 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 3.5 p30 -169.56 108.8 0.42 Allowed 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.435 1.085 . . . . 70.24 109.29 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 6.3 m -102.04 164.04 11.92 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.436 1.085 . . . . 73.42 110.003 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.433 HG21 ' CB ' ' A' ' 160' ' ' SER . 76.0 t -130.5 125.03 58.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 124.459 1.099 . . . . 75.52 109.273 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.5 mp -131.48 113.75 15.61 Favored Pre-proline 0 C--N 1.326 -0.445 0 O-C-N 124.475 1.109 . . . . 63.42 109.237 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . 0.502 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.04 111.72 3.39 Favored 'Trans proline' 0 C--N 1.36 1.139 0 O-C-N 124.539 1.81 . . . . 73.35 110.975 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' MET . . . . . 0.424 ' HE2' ' CG2' ' A' ' 96' ' ' VAL . 4.5 ttt -92.74 152.08 19.69 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.531 1.144 . . . . 72.02 111.004 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 21.2 mtp180 -110.85 116.66 51.7 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.546 1.154 . . . . 74.51 110.239 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.01 164.61 33.01 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.474 1.776 . . . . 74.44 111.006 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . 0.449 HD21 ' N ' ' A' ' 198' ' ' GLU . 0.1 OUTLIER -104.02 -44.4 5.02 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.597 1.186 . . . . 72.41 109.264 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -72.13 -20.81 61.56 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.409 1.068 . . . . 73.25 109.266 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' ASN . . . . . 0.435 ' ND2' ' CG ' ' A' ' 89' ' ' ASP . 0.6 OUTLIER -110.2 107.49 58.64 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.539 1.149 . . . . 74.45 109.293 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 118.12 5.15 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.549 1.815 . . . . 72.44 111.041 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . 0.473 HD22 ' CB ' ' A' ' 184' ' ' ARG . 1.1 tm? -140.42 96.56 7.78 Favored Pre-proline 0 C--N 1.325 -0.475 0 O-C-N 124.505 1.128 . . . . 73.43 109.28 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.95 168.23 25.3 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.47 1.774 . . . . 74.32 111.025 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -56.48 -27.69 57.7 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.435 1.084 . . . . 73.33 110.302 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -61.35 -26.56 67.9 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 124.474 1.109 . . . . 71.04 110.262 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 184' ' ' ARG . . . . . 0.473 ' CB ' HD22 ' A' ' 180' ' ' LEU . 69.0 mmt-85 -96.4 -24.51 16.1 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.455 1.097 . . . . 72.44 110.288 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 185' ' ' THR . . . . . . . . . . . . . 18.9 m -74.77 143.94 79.25 Favored Pre-proline 0 C--N 1.325 -0.468 0 O-C-N 124.436 1.085 . . . . 72.13 110.396 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . 0.498 ' CB ' ' CH2' ' A' ' 148' ' ' TRP . 18.4 Cg_endo -74.94 155.41 43.21 Favored 'Trans proline' 0 C--N 1.36 1.142 0 O-C-N 124.476 1.777 . . . . 75.13 110.983 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 187' ' ' PHE . . . . . 0.498 ' O ' ' CG2' ' A' ' 191' ' ' THR . 17.1 p90 -69.76 -6.89 35.15 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.461 1.101 . . . . 75.31 111.035 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -94.37 -52.96 4.11 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.491 1.12 . . . . 75.43 109.289 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.472 ' CD2' ' HG3' ' A' ' 172' ' ' PRO . 51.5 mt -68.45 -42.08 79.31 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.378 1.049 . . . . 74.12 109.268 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -64.48 -10.09 23.03 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.485 1.116 . . . . 73.23 110.327 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 191' ' ' THR . . . . . 0.498 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 39.9 p -115.08 11.12 16.32 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.545 1.153 . . . . 74.02 110.343 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.496 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 4.0 mt -125.46 148.82 29.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.457 1.098 . . . . 74.21 109.255 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 -47.55 102.64 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.392 1.058 . . . . 74.04 109.254 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . 0.502 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -99.54 129.84 45.74 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.499 1.124 . . . . 65.41 109.327 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 195' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.58 136.9 56.3 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.49 1.119 . . . . 73.45 109.316 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . 0.447 ' CB ' ' HB3' ' A' ' 199' ' ' SER . 31.3 mt-10 -114.93 131.48 56.87 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.463 1.102 . . . . 73.11 110.325 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . 0.504 ' OE2' ' CG2' ' A' ' 96' ' ' VAL . 3.4 tt0 -109.47 -23.19 11.64 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.492 1.12 . . . . 64.33 110.321 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . 0.449 ' N ' HD21 ' A' ' 176' ' ' LEU . 0.0 OUTLIER -107.09 8.44 30.22 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.483 1.115 . . . . 72.15 110.269 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 199' ' ' SER . . . . . 0.447 ' HB3' ' CB ' ' A' ' 196' ' ' GLU . 28.6 t -99.91 163.49 12.43 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.545 1.153 . . . . 75.04 109.982 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 5.8 tpm_? -75.81 -20.83 57.88 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.477 1.111 . . . . 74.02 110.301 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -99.88 26.26 25.12 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.53 1.143 . . . . 70.41 111.045 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 202' ' ' PHE . . . . . 0.616 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 0.2 OUTLIER -60.87 -43.9 93.08 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.483 0.755 . . . . 72.13 110.983 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 203' ' ' PRO . . . . . 0.616 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -74.96 -37.89 1.85 Allowed 'Trans proline' 0 C--N 1.361 1.19 0 O-C-N 124.447 1.761 . . . . 61.51 110.944 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.04 -57.99 9.47 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.558 1.161 . . . . 71.34 110.431 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 205' ' ' GLN . . . . . 0.441 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 1.1 mt-30 -59.57 -45.64 91.25 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.45 1.094 . . . . 74.31 110.293 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 206' ' ' VAL . . . . . 0.542 HG12 ' CE1' ' A' ' 104' ' ' PHE . 55.0 t -56.48 -33.8 39.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 O-C-N 124.477 1.11 . . . . 74.43 109.269 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -73.57 -60.0 2.45 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.496 1.123 . . . . 64.5 110.241 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 80.5 mtt-85 -56.06 -63.38 1.2 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.538 1.149 . . . . 74.15 110.332 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 209' ' ' ILE . . . . . 0.578 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 25.7 mt -46.45 -62.46 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.554 1.159 . . . . 72.21 109.339 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 210' ' ' PHE . . . . . 0.578 ' CE1' ' CG2' ' A' ' 209' ' ' ILE . 1.8 m-85 -97.09 68.8 2.29 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.502 1.126 . . . . 74.43 111.034 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.79 144.52 39.65 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.497 1.123 . . . . 74.11 110.299 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 215' ' ' TYR . 39.6 tt0 -49.21 -55.16 13.41 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.479 1.112 . . . . 65.54 110.355 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.26 -23.96 1.04 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.452 1.095 . . . . 72.13 110.005 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 40.6 t -96.25 -29.19 3.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.412 1.07 . . . . 71.03 109.237 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 215' ' ' TYR . . . . . 0.45 ' N ' ' O ' ' A' ' 212' ' ' GLU . 5.8 t80 -62.98 -32.42 73.76 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.469 1.106 . . . . 73.31 110.966 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 45.6 mmtt -63.33 -46.95 84.24 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.51 1.131 . . . . 74.41 109.27 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 87.9 m -53.49 -66.45 0.39 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.457 1.098 . . . . 63.41 110.372 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 12.5 mp0 -55.5 -18.54 7.43 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.451 1.094 . . . . 74.42 110.23 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 219' ' ' GLN . . . . . 0.438 ' O ' ' NE2' ' A' ' 219' ' ' GLN . 23.8 tp60 -84.62 -33.31 23.33 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 124.471 1.107 . . . . 75.21 110.28 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 220' ' ' THR . . . . . 0.451 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 3.0 m -82.42 -28.93 31.06 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.508 1.13 . . . . 51.41 110.458 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 221' ' ' ILE . . . . . 0.417 HG23 ' N ' ' A' ' 167' ' ' TYR . 8.9 mt -75.07 -34.67 32.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.462 1.101 . . . . 74.43 109.323 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 222' ' ' TRP . . . . . 0.485 ' CD1' ' HA2' ' A' ' 131' ' ' GLY . 35.8 t90 -71.51 -57.84 4.05 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.492 1.12 . . . . 75.4 107.985 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . 0.451 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -52.74 -24.09 8.06 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.522 1.139 . . . . 74.21 109.239 179.989 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -88.16 -32.9 18.4 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.501 1.126 . . . . 62.12 110.373 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 2.4 t -61.01 -19.43 61.32 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.48 1.113 . . . . 64.13 110.407 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -77.87 -16.77 58.01 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.455 1.097 . . . . 73.4 110.214 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 227' ' ' ASN . . . . . 0.407 ' O ' ' N ' ' A' ' 231' ' ' ARG . 1.2 m-80 -86.81 -41.33 14.15 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.464 1.102 . . . . 74.33 109.239 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 52.7 mtm -58.26 -39.47 79.27 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.579 1.175 . . . . 72.22 111.027 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 229' ' ' VAL . . . . . . . . . . . . . 13.4 p -68.81 -48.86 68.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.538 1.149 . . . . 74.22 109.295 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 230' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.88 -1.27 27.6 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.448 1.092 . . . . 70.51 110.256 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 231' ' ' ARG . . . . . 0.407 ' N ' ' O ' ' A' ' 227' ' ' ASN . 12.9 tpp180 -95.06 -77.56 0.47 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.476 1.11 . . . . 63.34 110.262 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -146.72 43.48 1.17 Allowed 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.444 1.09 . . . . 74.15 110.323 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -155.0 34.93 0.39 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.403 1.064 . . . . 72.4 110.953 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 58.8 mt -52.6 153.01 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.469 1.106 . . . . 64.14 109.289 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.499 0 O-C-N 124.491 1.119 . . . . 73.41 109.314 179.993 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.992 0 N-CA-C 110.967 -0.853 . . . . 62.42 110.967 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.89 169.41 22.66 Favored 'Trans proline' 0 C--N 1.36 1.175 0 O-C-N 124.48 1.779 . . . . 63.43 111.039 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.19 -59.93 2.48 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.59 1.181 . . . . 75.34 109.29 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -162.44 89.47 0.11 Allowed Glycine 0 CA--C 1.53 0.999 0 O-C-N 124.519 1.137 . . . . 73.41 111.021 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.9 p -110.08 150.16 28.98 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.533 0.784 . . . . 63.1 110.049 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -39.63 127.92 1.97 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.466 1.104 . . . . 74.13 110.309 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.533 ' OE1' ' CH2' ' A' ' 222' ' ' TRP . 0.3 OUTLIER -97.44 156.15 16.6 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.513 1.133 . . . . 74.21 110.324 179.987 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.59 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 7.3 p -176.14 161.8 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.522 1.139 . . . . 75.43 109.262 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.404 ' O ' ' C ' ' A' ' 79' ' ' LEU . 31.9 t80 -86.83 18.25 3.58 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.473 1.108 . . . . 74.24 110.969 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.404 ' C ' ' O ' ' A' ' 78' ' ' PHE . 3.9 tp -39.31 157.33 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.498 1.124 . . . . 75.34 109.318 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.488 ' CG ' ' N ' ' A' ' 81' ' ' PHE . 4.9 ptmm? -104.69 -51.59 3.04 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.472 1.108 . . . . 74.4 109.335 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.589 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.2 OUTLIER -167.51 142.83 3.94 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.479 1.112 . . . . 73.31 111.043 179.99 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.475 HG23 ' CE ' ' A' ' 115' ' ' MET . 7.4 p -97.98 172.7 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.51 1.131 . . . . 72.31 109.272 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.456 ' CG2' ' HB ' ' A' ' 136' ' ' ILE . 5.3 mp -129.55 96.87 3.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.481 1.113 . . . . 71.5 109.288 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.463 ' HG ' ' CB ' ' A' ' 128' ' ' ALA . 5.5 mt -70.41 117.62 12.18 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.537 1.148 . . . . 74.52 109.317 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.577 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -142.22 174.57 10.49 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.559 1.162 . . . . 73.52 109.622 179.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.455 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -117.0 149.55 40.07 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.492 1.12 . . . . 63.55 109.282 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.08 -21.34 1.83 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.459 1.099 . . . . 74.34 110.28 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -66.66 -45.87 77.52 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.543 1.152 . . . . 74.24 109.304 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -132.0 44.22 2.93 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.453 1.096 . . . . 74.52 109.328 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.577 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -74.73 -23.83 58.63 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.466 1.104 . . . . 73.14 110.44 179.955 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -76.3 -39.04 55.18 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.464 1.103 . . . . 75.1 109.264 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.409 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 0.1 OUTLIER -61.57 -50.54 72.2 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.482 1.114 . . . . 71.22 110.285 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.539 ' CB ' ' CD2' ' A' ' 138' ' ' LEU . . . -59.71 -27.95 66.9 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.569 1.168 . . . . 71.1 109.348 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.424 ' O ' ' CD2' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -82.87 -33.38 27.02 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.524 1.14 . . . . 74.14 109.323 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 9.3 tpp180 -57.16 -28.51 62.82 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.517 1.136 . . . . 72.33 110.368 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.453 ' CG2' ' HE1' ' A' ' 173' ' ' MET . 1.7 t -84.48 -65.35 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.435 1.085 . . . . 75.52 109.324 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.434 ' HG3' ' N ' ' A' ' 98' ' ' ASN . 0.0 OUTLIER -39.99 -28.12 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.538 1.149 . . . . 71.42 110.319 179.993 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.442 ' N ' ' O ' ' A' ' 96' ' ' VAL . 2.1 t-20 -69.85 -52.67 22.91 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.504 1.128 . . . . 74.13 109.252 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.507 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -71.03 -21.58 62.25 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.549 1.155 . . . . 71.34 109.355 179.981 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.485 HD23 ' CD2' ' A' ' 99' ' ' LEU . 25.4 mt -60.15 -58.23 9.44 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.508 1.13 . . . . 74.24 109.277 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -75.28 59.13 1.0 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.534 1.146 . . . . 71.32 110.336 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -178.2 -64.06 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.439 1.087 . . . . 70.42 109.241 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -49.73 -50.68 43.19 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.491 1.119 . . . . 74.33 109.324 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.463 ' CZ ' HG11 ' A' ' 206' ' ' VAL . 2.6 m-85 -114.42 -22.47 9.84 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.494 1.121 . . . . 73.03 110.997 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.49 44.7 3.93 Favored Glycine 0 CA--C 1.53 1.021 0 O-C-N 124.524 1.14 . . . . 44.41 110.987 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.455 ' CG2' ' HD3' ' A' ' 80' ' ' LYS . 3.6 mm -86.97 87.66 2.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.476 0.75 . . . . 73.21 109.323 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.481 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -132.36 158.5 75.46 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.555 1.159 . . . . 70.14 109.28 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.481 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.01 167.06 81.6 Favored 'Cis proline' 0 C--N 1.36 1.175 0 C-N-CA 121.033 -2.486 . . . . 73.42 110.979 0.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.75 129.07 6.06 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.547 1.155 . . . . 74.41 110.989 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -148.05 132.4 9.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.502 0.766 . . . . 72.44 109.318 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 44.2 pt -91.83 -178.35 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.457 1.098 . . . . 75.33 109.318 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -81.53 -19.1 42.84 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.522 1.139 . . . . 70.55 111.006 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.465 ' CB ' HG21 ' A' ' 90' ' ' THR . . . -91.54 -3.05 56.92 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.455 1.097 . . . . 74.13 109.332 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -109.79 -26.75 9.66 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.465 1.103 . . . . 71.12 110.314 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.475 ' CE ' HG23 ' A' ' 82' ' ' VAL . 23.4 tpp -39.93 111.06 0.69 Allowed Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.571 1.169 . . . . 74.3 111.017 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.99 112.02 3.46 Favored 'Trans proline' 0 C--N 1.36 1.16 0 O-C-N 124.479 1.779 . . . . 75.13 111.021 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.765 ' CE1' ' CD2' ' A' ' 121' ' ' HIS . 54.2 m-70 -41.97 160.34 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.512 1.132 . . . . 74.23 109.654 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -103.02 -68.48 0.79 Allowed Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.53 1.144 . . . . 63.23 110.969 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 17.3 tpp180 -106.31 -73.52 0.68 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.5 0.765 . . . . 75.33 110.331 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -114.83 -75.11 0.59 Allowed 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.483 1.115 . . . . 72.12 110.337 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . 0.765 ' CD2' ' CE1' ' A' ' 117' ' ' HIS . 63.6 t-80 -159.42 173.65 15.91 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.49 1.119 . . . . 62.55 109.567 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.517 ' O ' ' CE1' ' A' ' 121' ' ' HIS . 0.0 OUTLIER -131.17 146.04 52.19 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.568 1.168 . . . . 72.13 109.299 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -129.09 14.91 6.26 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.494 1.121 . . . . 75.44 110.304 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -110.24 131.22 55.25 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.507 1.129 . . . . 63.23 109.287 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.0 -17.19 47.74 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.497 1.123 . . . . 72.24 109.263 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.438 ' O ' ' N ' ' A' ' 129' ' ' VAL . 2.4 t70 -64.44 -22.24 66.9 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.526 1.141 . . . . 75.23 109.29 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -49.91 -23.48 1.98 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.501 1.126 . . . . 75.12 109.363 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.463 ' CB ' ' HG ' ' A' ' 84' ' ' LEU . . . -89.3 -33.16 17.03 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.469 1.105 . . . . 62.13 109.261 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.488 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 73.6 t -92.94 30.48 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.499 1.124 . . . . 74.1 109.299 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -135.29 118.89 16.99 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.544 1.152 . . . . 74.33 109.234 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . 0.561 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 66.59 62.97 4.17 Favored Glycine 0 CA--C 1.531 1.033 0 O-C-N 124.51 1.131 . . . . 73.21 111.009 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -154.92 -176.87 6.15 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.552 0.796 . . . . 75.54 110.068 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.576 ' HB1' ' CE3' ' A' ' 134' ' ' TRP . . . -113.23 -32.22 6.36 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.438 1.086 . . . . 73.3 109.235 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.576 ' CE3' ' HB1' ' A' ' 133' ' ' ALA . 1.4 m-90 -161.48 160.2 28.93 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.489 1.118 . . . . 73.24 107.997 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.9 p -132.82 131.49 41.1 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.487 1.117 . . . . 74.41 110.428 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.456 ' HB ' ' CG2' ' A' ' 83' ' ' ILE . 9.8 mm -84.6 138.64 18.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.524 1.14 . . . . 74.03 109.334 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.407 ' CD1' HG12 ' A' ' 170' ' ' VAL . 4.1 mt -130.34 94.5 3.68 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.477 1.111 . . . . 74.03 109.341 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.539 ' CD2' ' CB ' ' A' ' 93' ' ' ALA . 0.5 OUTLIER -62.55 99.63 0.15 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.528 1.142 . . . . 71.33 109.32 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.55 116.35 5.54 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.43 1.081 . . . . 75.14 109.334 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.429 ' HB ' ' CB ' ' A' ' 143' ' ' PHE . 5.8 m -139.4 179.69 6.4 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.559 1.162 . . . . 72.52 110.397 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -84.87 -36.67 21.39 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.482 1.114 . . . . 74.15 110.227 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -88.44 -32.82 18.09 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.494 1.121 . . . . 74.11 109.308 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.573 ' CD2' HG22 ' A' ' 147' ' ' THR . 51.1 t80 -72.44 -36.75 68.63 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.437 1.086 . . . . 72.33 110.926 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.483 ' CD1' ' N ' ' A' ' 145' ' ' ARG . 1.5 tm? -54.7 -67.49 0.26 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.533 1.145 . . . . 73.31 109.32 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.483 ' N ' ' CD1' ' A' ' 144' ' ' LEU . 0.0 OUTLIER -55.39 -18.4 6.7 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.551 1.157 . . . . 73.42 110.312 -179.975 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.69 -32.93 25.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.466 1.104 . . . . 72.22 109.321 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.603 ' O ' ' CD1' ' A' ' 151' ' ' PHE . 80.8 p -97.39 -7.02 32.76 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.552 1.158 . . . . 74.04 110.388 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.487 ' CH2' ' CB ' ' A' ' 186' ' ' PRO . 0.1 OUTLIER -94.24 -26.55 16.59 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.951 -1.129 . . . . 74.13 107.951 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 51.6 t -95.62 -26.39 15.77 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.488 1.117 . . . . 63.44 108.316 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 9.6 m-20 -77.92 -42.79 31.97 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.506 1.129 . . . . 72.15 109.347 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.647 ' CE2' ' CD1' ' A' ' 157' ' ' LEU . 4.0 m-85 -69.39 -51.08 40.11 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 73.13 110.981 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -46.6 -47.78 19.84 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.518 1.136 . . . . 73.35 110.266 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -68.83 -22.66 64.22 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.54 1.15 . . . . 72.13 110.983 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -118.9 91.94 3.68 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.464 1.103 . . . . 73.03 110.949 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.6 t -60.87 -15.65 32.93 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.537 1.148 . . . . 74.34 110.372 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 93.0 p -69.86 -20.7 63.4 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.449 1.093 . . . . 75.53 109.966 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.647 ' CD1' ' CE2' ' A' ' 151' ' ' PHE . 0.0 OUTLIER -86.27 -37.17 18.84 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.563 1.164 . . . . 75.24 109.279 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' MET . . . . . 0.435 ' HE2' ' CG1' ' A' ' 161' ' ' VAL . 18.4 mmt -62.95 -11.58 19.67 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.517 1.136 . . . . 71.51 111.001 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -62.47 -68.48 0.33 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.513 1.133 . . . . 74.13 109.29 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -34.21 71.86 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.506 1.129 . . . . 74.51 110.042 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . 0.508 ' CG1' ' CB ' ' A' ' 188' ' ' ALA . 87.5 t -55.68 -18.99 5.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.516 1.135 . . . . 75.02 109.357 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -92.03 35.7 0.98 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.555 1.16 . . . . 74.22 109.278 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.466 ' CD ' ' CG1' ' A' ' 192' ' ' ILE . 0.1 OUTLIER 40.18 64.31 0.93 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.494 1.121 . . . . 72.3 110.294 -179.998 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -96.28 -174.78 3.16 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.479 1.112 . . . . 73.33 110.293 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 31.9 p80 -141.72 55.75 1.5 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.479 1.112 . . . . 73.3 109.598 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.2 tptm -90.89 -175.46 4.36 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.497 1.123 . . . . 74.2 109.272 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' TYR . . . . . 0.662 ' CD1' ' CG2' ' A' ' 221' ' ' ILE . 10.8 m-85 -37.65 -46.86 0.91 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.435 1.084 . . . . 74.35 110.893 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.435 ' ND2' ' O ' ' A' ' 129' ' ' VAL . 0.6 OUTLIER -112.58 164.11 13.71 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.467 1.104 . . . . 74.44 109.305 -179.99 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' SER . . . . . 0.418 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 5.9 m -124.66 175.11 7.42 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.515 1.135 . . . . 72.42 110.057 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.407 HG12 ' CD1' ' A' ' 137' ' ' LEU . 2.1 t -133.88 122.44 42.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 O-C-N 124.491 1.119 . . . . 75.43 109.319 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.4 mp -132.72 103.24 13.36 Favored Pre-proline 0 C--N 1.324 -0.506 0 O-C-N 124.583 1.177 . . . . 73.21 109.254 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . 0.488 ' CB ' ' HB3' ' A' ' 189' ' ' LEU . 18.3 Cg_endo -74.99 112.65 3.61 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.51 1.795 . . . . 72.11 111.025 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' MET . . . . . 0.453 ' HE1' ' CG2' ' A' ' 96' ' ' VAL . 5.5 ttt -92.92 157.55 16.29 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.443 1.089 . . . . 73.15 110.961 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -113.54 120.26 39.96 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.511 1.132 . . . . 75.34 110.288 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.01 154.47 42.46 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.455 1.766 . . . . 73.12 110.963 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . 0.613 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -88.22 -43.21 11.77 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.528 1.143 . . . . 75.52 109.249 -179.996 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -72.23 -27.15 62.34 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.461 1.101 . . . . 72.31 109.296 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 9.8 m-20 -110.33 99.39 40.15 Favored Pre-proline 0 C--N 1.325 -0.483 0 O-C-N 124.484 1.115 . . . . 75.02 109.279 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -74.97 124.61 8.77 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.493 1.786 . . . . 74.13 111.058 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . 0.469 HD11 ' CB ' ' A' ' 184' ' ' ARG . 0.4 OUTLIER -136.0 96.34 13.02 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.531 1.145 . . . . 71.01 109.304 -179.983 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -75.07 171.7 17.79 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.481 1.78 . . . . 73.04 110.998 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 17.2 ptt180 -59.37 -32.27 69.97 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 73.31 110.255 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -60.74 -14.82 23.58 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.487 1.117 . . . . 75.3 110.328 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 184' ' ' ARG . . . . . 0.469 ' CB ' HD11 ' A' ' 180' ' ' LEU . 30.8 mmt180 -113.79 -28.61 7.37 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.48 1.113 . . . . 72.11 110.232 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 185' ' ' THR . . . . . . . . . . . . . 61.0 m -66.51 139.47 96.1 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.49 1.119 . . . . 73.33 110.422 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . 0.487 ' CB ' ' CH2' ' A' ' 148' ' ' TRP . 18.4 Cg_endo -74.96 145.4 31.53 Favored 'Trans proline' 0 C--N 1.36 1.132 0 O-C-N 124.488 1.783 . . . . 61.23 110.997 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 187' ' ' PHE . . . . . 0.479 ' O ' ' CD1' ' A' ' 187' ' ' PHE . 5.2 t80 -59.73 -13.67 11.05 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.512 1.133 . . . . 72.23 110.985 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . 0.508 ' CB ' ' CG1' ' A' ' 161' ' ' VAL . . . -86.92 -53.77 4.71 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.509 1.131 . . . . 74.43 109.301 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.488 ' HB3' ' CB ' ' A' ' 172' ' ' PRO . 23.9 mt -76.57 -11.8 59.92 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.41 1.068 . . . . 74.5 109.261 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 190' ' ' GLN . . . . . 0.499 ' CG ' ' O ' ' A' ' 190' ' ' GLN . 4.7 tt0 -86.81 -0.78 57.03 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.494 1.121 . . . . 53.14 110.283 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 191' ' ' THR . . . . . 0.416 ' HB ' ' CZ ' ' A' ' 163' ' ' ARG . 3.4 p -115.72 -30.7 6.05 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.517 1.135 . . . . 74.54 110.426 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.466 ' CG1' ' CD ' ' A' ' 163' ' ' ARG . 7.2 mt -65.1 169.36 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.507 1.129 . . . . 74.23 109.3 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -76.17 57.32 1.11 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.497 1.123 . . . . 72.43 109.32 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . 0.445 ' O ' ' NE2' ' A' ' 205' ' ' GLN . . . -43.07 142.08 1.03 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.451 1.094 . . . . 72.3 109.307 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 195' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.9 126.1 35.24 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.499 1.125 . . . . 63.42 109.297 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . 0.404 ' HB3' ' CB ' ' A' ' 199' ' ' SER . 38.7 mt-10 -101.44 130.57 47.7 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.549 1.156 . . . . 72.42 110.326 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . 0.465 ' HG3' ' CD2' ' A' ' 176' ' ' LEU . 8.8 tp10 -113.61 -23.94 9.49 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.517 1.135 . . . . 75.13 110.311 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -103.06 4.03 36.72 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.498 1.124 . . . . 72.01 110.296 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 199' ' ' SER . . . . . 0.404 ' CB ' ' HB3' ' A' ' 196' ' ' GLU . 14.7 t -97.59 174.9 6.42 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.489 1.118 . . . . 70.35 109.98 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -70.64 -60.36 2.3 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.515 1.134 . . . . 74.44 110.244 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -78.82 51.34 3.76 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.459 1.099 . . . . 71.41 110.976 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 202' ' ' PHE . . . . . 0.614 ' CD1' ' C ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -78.39 -47.27 2.0 Allowed Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.526 0.78 . . . . 74.15 110.972 -179.993 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 203' ' ' PRO . . . . . 0.58 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.3 Cg_endo -75.02 -27.44 9.97 Favored 'Trans proline' 0 C--N 1.36 1.145 0 O-C-N 124.444 1.76 . . . . 71.23 110.99 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.51 -50.77 71.38 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.615 1.197 . . . . 73.44 110.438 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 205' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 0.2 OUTLIER -58.75 -63.18 1.38 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.518 1.136 . . . . 75.12 110.31 -179.989 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 206' ' ' VAL . . . . . 0.58 ' CG1' ' HA ' ' A' ' 203' ' ' PRO . 2.7 p -38.82 -33.86 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.495 1.122 . . . . 71.2 109.304 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 207' ' ' GLU . . . . . 0.414 ' N ' ' C ' ' A' ' 205' ' ' GLN . 1.0 OUTLIER -76.39 -65.68 0.9 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.541 1.151 . . . . 71.51 110.283 -179.961 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 82.9 mtt-85 -47.82 -58.07 4.82 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.53 1.144 . . . . 71.54 110.276 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 209' ' ' ILE . . . . . 0.595 HG23 ' CE1' ' A' ' 210' ' ' PHE . 3.3 mt -52.56 -70.75 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.481 1.113 . . . . 73.12 109.341 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 210' ' ' PHE . . . . . 0.595 ' CE1' HG23 ' A' ' 209' ' ' ILE . 0.7 OUTLIER -84.9 65.28 9.11 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.534 1.146 . . . . 72.32 111.045 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 211' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' A' ' 215' ' ' TYR . 0.2 OUTLIER -110.59 146.65 35.73 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.447 1.092 . . . . 75.22 110.262 -179.968 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' A' ' 215' ' ' TYR . 60.7 tt0 -48.33 -55.39 10.8 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 73.43 110.334 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.3 m -48.6 -25.23 1.64 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.544 1.152 . . . . 74.45 109.995 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 32.8 t -96.21 -26.35 4.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.485 1.116 . . . . 70.2 109.304 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 215' ' ' TYR . . . . . 0.455 ' N ' ' O ' ' A' ' 212' ' ' GLU . 8.5 t80 -69.27 -33.83 73.82 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.519 1.137 . . . . 75.43 110.987 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . 0.442 ' O ' ' N ' ' A' ' 220' ' ' THR . 4.2 mmtp -52.18 -54.84 25.92 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.486 1.116 . . . . 75.53 109.265 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 217' ' ' THR . . . . . 0.452 ' O ' ' N ' ' A' ' 220' ' ' THR . 1.3 m -54.82 -65.19 0.62 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.478 1.111 . . . . 61.35 110.38 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -48.87 -28.35 3.7 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.472 1.107 . . . . 71.03 110.284 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 39.1 tp60 -84.68 -27.75 26.85 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.483 1.115 . . . . 73.23 110.328 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 220' ' ' THR . . . . . 0.452 ' N ' ' O ' ' A' ' 217' ' ' THR . 1.0 OUTLIER -79.96 -17.41 53.03 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.529 1.143 . . . . 71.45 110.465 179.923 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 221' ' ' ILE . . . . . 0.662 ' CG2' ' CD1' ' A' ' 167' ' ' TYR . 7.4 mt -89.21 -45.58 15.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.559 1.162 . . . . 74.51 109.329 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 222' ' ' TRP . . . . . 0.59 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 41.7 t90 -68.57 -18.74 64.4 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.573 1.171 . . . . 74.2 107.982 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.76 -24.12 20.46 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.448 1.093 . . . . 71.12 109.271 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -93.35 -19.45 21.33 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.495 1.122 . . . . 75.13 110.294 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 225' ' ' THR . . . . . 0.579 ' HB ' ' CE1' ' A' ' 167' ' ' TYR . 2.1 t -70.65 -32.4 69.67 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.516 1.135 . . . . 75.14 110.384 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -75.98 -16.44 59.98 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.48 1.113 . . . . 71.13 110.3 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 227' ' ' ASN . . . . . 0.443 ' O ' ' N ' ' A' ' 231' ' ' ARG . 0.8 OUTLIER -82.79 -56.79 3.63 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.519 1.137 . . . . 75.02 109.263 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 20.2 mtm -46.16 -47.61 17.56 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.56 1.162 . . . . 71.31 110.992 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 229' ' ' VAL . . . . . 0.405 ' O ' ' CG1' ' A' ' 234' ' ' ILE . 14.7 p -59.05 -47.72 89.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 O-C-N 124.502 1.126 . . . . 63.34 109.398 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 230' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -84.03 9.8 11.57 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.466 1.104 . . . . 70.01 110.251 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 231' ' ' ARG . . . . . 0.443 ' N ' ' O ' ' A' ' 227' ' ' ASN . 7.8 tmm_? -108.05 -67.88 0.94 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.454 1.096 . . . . 72.54 110.305 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -152.43 39.74 0.58 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.515 1.135 . . . . 62.44 110.367 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -157.88 41.24 0.28 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.521 1.138 . . . . 74.44 111.024 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . 0.405 ' CG1' ' O ' ' A' ' 229' ' ' VAL . 7.5 mt -60.25 154.68 3.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.445 1.091 . . . . 75.34 109.243 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.498 0 O-C-N 124.513 1.133 . . . . 74.04 109.3 179.999 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.985 0 N-CA-C 111.03 -0.828 . . . . 52.33 111.03 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.99 166.06 30.01 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.494 1.786 . . . . 71.02 110.986 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.13 -41.69 8.97 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.556 1.16 . . . . 75.55 109.326 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -157.38 84.94 0.13 Allowed Glycine 0 CA--C 1.529 0.959 0 O-C-N 124.452 1.095 . . . . 73.44 111.012 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.3 m -143.35 164.4 30.38 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.478 0.752 . . . . 75.13 110.017 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.405 ' HG3' ' N ' ' A' ' 76' ' ' GLU . 23.4 tp10 -80.38 149.28 30.27 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.541 1.151 . . . . 62.23 110.237 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.405 ' N ' ' HG3' ' A' ' 75' ' ' GLU . 0.9 OUTLIER -99.79 153.36 19.18 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.511 1.132 . . . . 73.41 110.322 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.61 ' O ' ' CZ2' ' A' ' 222' ' ' TRP . 3.2 p -176.23 165.0 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 O-C-N 124.531 1.144 . . . . 70.44 109.257 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.438 ' CE1' ' NE2' ' A' ' 219' ' ' GLN . 5.8 t80 -87.75 26.9 1.22 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.511 1.132 . . . . 75.45 110.969 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.402 ' O ' ' O ' ' A' ' 78' ' ' PHE . 4.5 tp -41.03 160.89 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.538 1.149 . . . . 74.42 109.309 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.486 ' HZ3' ' N ' ' A' ' 107' ' ' LYS . 6.4 ptmt -111.9 -47.22 3.15 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.529 1.143 . . . . 71.53 109.336 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.596 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.2 OUTLIER -167.32 139.58 3.31 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.516 1.135 . . . . 74.02 110.998 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.471 ' CG2' ' CE ' ' A' ' 115' ' ' MET . 7.3 p -96.72 165.42 2.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.544 1.152 . . . . 72.41 109.322 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.448 HG13 ' CG1' ' A' ' 136' ' ' ILE . 5.3 mp -126.01 97.2 4.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.569 1.168 . . . . 71.44 109.283 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.515 HD22 ' CG ' ' A' ' 112' ' ' PHE . 10.9 mt -70.88 117.37 12.3 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.525 1.14 . . . . 74.2 109.341 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.562 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -138.66 174.26 10.72 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.449 1.093 . . . . 70.1 109.646 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.453 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -124.83 149.08 47.83 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.499 1.125 . . . . 74.32 109.306 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -44.6 -27.05 0.43 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.436 1.085 . . . . 72.34 110.262 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 57.3 t0 -66.62 -44.83 80.99 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.542 1.151 . . . . 70.42 109.309 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.452 ' N ' ' O ' ' A' ' 86' ' ' ALA . 22.9 m-20 -124.01 41.27 3.53 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.515 1.135 . . . . 74.1 109.296 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.562 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -70.51 -41.11 73.03 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.469 1.106 . . . . 74.12 110.442 179.947 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -69.92 -31.96 70.0 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.468 1.105 . . . . 74.51 109.319 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -60.16 -69.45 0.22 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.525 1.141 . . . . 74.14 110.288 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.469 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -46.09 -28.87 1.31 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.526 1.141 . . . . 62.12 109.269 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.37 -57.63 5.04 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.516 1.135 . . . . 71.13 109.286 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 11.4 tpp180 -41.4 -36.2 0.8 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.457 1.098 . . . . 74.52 110.347 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.44 ' C ' ' N ' ' A' ' 98' ' ' ASN . 1.9 t -77.75 -65.15 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 O-C-N 124.493 1.121 . . . . 74.42 109.334 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.432 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.1 OUTLIER -45.14 -21.84 0.09 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.52 1.138 . . . . 74.12 110.309 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.44 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.1 t-20 -78.57 -59.64 2.7 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.519 1.137 . . . . 71.41 109.3 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.511 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -61.8 -22.11 65.18 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.556 1.16 . . . . 74.11 109.312 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 15.5 mt -64.64 -55.55 19.46 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.534 1.147 . . . . 63.12 109.252 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -78.82 54.01 1.47 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.506 1.129 . . . . 74.42 110.287 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -174.78 -67.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.515 1.135 . . . . 75.31 109.242 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -45.26 -51.86 10.29 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.523 1.14 . . . . 73.01 109.346 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.555 ' CE2' HG13 ' A' ' 206' ' ' VAL . 4.6 m-85 -113.4 -24.92 9.05 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.41 1.069 . . . . 75.22 110.942 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.406 ' C ' ' CD ' ' A' ' 107' ' ' LYS . . . 92.59 44.72 3.89 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.538 1.149 . . . . 74.24 111.031 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 8.5 mm -84.35 75.22 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 O-C-N 124.497 0.763 . . . . 73.22 109.35 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.506 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -119.56 156.38 53.51 Favored Pre-proline 0 C--N 1.326 -0.451 0 O-C-N 124.417 1.073 . . . . 71.21 109.282 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.506 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.95 161.36 94.99 Favored 'Cis proline' 0 C--N 1.359 1.111 0 C-N-CA 121.001 -2.499 . . . . 70.55 111.015 -0.048 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -135.91 118.7 1.89 Allowed Glycine 0 CA--C 1.53 0.995 0 O-C-N 124.422 1.076 . . . . 73.22 111.016 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 1.3 tt -136.06 149.89 27.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.55 0.794 . . . . 74.52 109.296 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 33.5 pt -98.11 161.0 3.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.439 1.087 . . . . 73.24 109.336 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.534 ' CZ ' HD23 ' A' ' 122' ' ' LEU . 2.5 t80 -62.04 -19.21 62.66 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.52 1.138 . . . . 74.34 111.059 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -87.33 -11.6 48.96 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.517 1.136 . . . . 74.13 109.386 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -104.08 -20.88 13.69 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.486 1.117 . . . . 73.41 110.321 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.471 ' CE ' ' CG2' ' A' ' 82' ' ' VAL . 21.9 tpp -44.57 134.36 4.66 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 124.464 1.102 . . . . 61.24 110.98 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.02 107.24 2.44 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.531 1.806 . . . . 61.4 110.992 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 21.0 m-70 -136.16 -175.8 4.11 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.432 1.083 . . . . 74.43 109.597 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -66.1 -159.32 0.66 Allowed Glycine 0 CA--C 1.53 1.02 0 O-C-N 124.488 1.117 . . . . 63.04 110.947 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 49.5 ttt-85 -93.56 50.84 1.51 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.496 0.762 . . . . 75.14 110.271 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -173.19 143.96 1.17 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.483 1.115 . . . . 71.02 110.287 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . 0.471 ' CG ' ' N ' ' A' ' 122' ' ' LEU . 28.6 t-80 -60.58 167.52 2.61 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.553 1.158 . . . . 72.32 109.603 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.534 HD23 ' CZ ' ' A' ' 112' ' ' PHE . 0.0 OUTLIER -144.55 119.0 9.64 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.41 1.069 . . . . 72.21 109.333 -179.996 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.478 HE21 ' ND2' ' A' ' 150' ' ' ASN . 3.7 tp60 -83.7 -13.97 52.82 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.484 1.115 . . . . 70.34 110.333 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.4 ' C ' ' O ' ' A' ' 123' ' ' GLN . 9.8 m120 -40.51 112.71 0.3 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.493 1.121 . . . . 73.41 109.294 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.54 -50.63 9.15 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.476 1.11 . . . . 75.23 109.291 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.432 ' HA ' ' CG2' ' A' ' 129' ' ' VAL . 0.6 OUTLIER -41.31 -59.02 1.66 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.481 1.113 . . . . 73.3 109.307 -179.996 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -43.64 -46.95 7.54 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.492 1.12 . . . . 71.55 109.333 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.524 ' HB2' ' CE1' ' A' ' 112' ' ' PHE . . . -61.52 -46.66 89.0 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.427 1.079 . . . . 73.21 109.268 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.432 ' CG2' ' HA ' ' A' ' 126' ' ' ASP . 35.2 m -92.38 30.94 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.525 1.14 . . . . 63.43 109.309 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.403 ' N ' ' O ' ' A' ' 126' ' ' ASP . 8.9 t30 -148.46 118.48 7.2 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.494 1.121 . . . . 75.54 109.32 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 102.78 34.15 4.16 Favored Glycine 0 CA--C 1.53 1.028 0 O-C-N 124.515 1.135 . . . . 74.52 110.928 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' SER . . . . . 0.403 ' O ' ' O ' ' A' ' 167' ' ' TYR . 0.7 OUTLIER -163.54 -173.81 3.46 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.503 0.767 . . . . 74.23 110.025 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.568 ' HB1' ' CE3' ' A' ' 134' ' ' TRP . . . -91.09 -68.59 0.78 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.456 1.097 . . . . 74.35 109.275 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.58 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 0.9 OUTLIER -121.52 174.86 6.51 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.509 1.131 . . . . 73.42 108.021 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.437 ' N ' ' O ' ' A' ' 169' ' ' SER . 2.5 p -143.28 136.0 27.56 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.483 1.114 . . . . 72.32 110.374 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.448 ' CG1' HG13 ' A' ' 83' ' ' ILE . 14.5 mm -89.5 113.46 25.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.477 1.111 . . . . 73.42 109.29 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.593 ' CD1' ' CG1' ' A' ' 170' ' ' VAL . 2.8 mt -99.06 89.65 4.34 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.536 1.147 . . . . 75.24 109.278 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.409 ' O ' ' CG ' ' A' ' 143' ' ' PHE . 2.4 tp -62.2 102.3 0.29 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.472 1.107 . . . . 65.12 109.286 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 55.2 mt -77.37 121.24 23.5 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.461 1.101 . . . . 73.52 109.344 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.463 ' HB ' ' CB ' ' A' ' 143' ' ' PHE . 10.6 m -139.74 162.19 35.73 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.523 1.14 . . . . 70.53 110.397 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -53.65 -40.86 66.21 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.566 1.166 . . . . 74.43 110.295 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . 0.418 ' ND2' ' N ' ' A' ' 143' ' ' PHE . 2.5 p-10 -89.76 -52.32 5.05 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.442 1.089 . . . . 72.31 109.326 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.463 ' CB ' ' HB ' ' A' ' 140' ' ' THR . 6.6 t80 -49.51 -27.64 4.58 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.481 1.113 . . . . 74.55 110.926 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.475 ' O ' ' CB ' ' A' ' 148' ' ' TRP . 2.1 tm? -63.0 -67.98 0.38 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.471 1.107 . . . . 70.43 109.336 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.463 ' CD ' ' C ' ' A' ' 145' ' ' ARG . 0.2 OUTLIER -65.32 -14.7 61.39 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.507 1.129 . . . . 71.31 110.242 -179.977 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -67.51 -60.64 2.4 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.498 1.124 . . . . 74.41 109.313 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.511 ' HB ' ' CE1' ' A' ' 151' ' ' PHE . 2.3 p -84.91 -47.52 10.22 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.519 1.137 . . . . 75.22 110.416 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.475 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 33.0 t-105 -45.7 -30.52 1.61 Allowed 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.517 1.136 . . . . 73.05 108.084 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . 0.452 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 40.5 t -78.47 -45.68 21.52 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.462 1.101 . . . . 75.32 108.27 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.478 ' ND2' HE21 ' A' ' 123' ' ' GLN . 17.2 m-80 -67.41 -13.66 62.22 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.475 1.109 . . . . 75.13 109.289 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.567 ' CZ ' HD22 ' A' ' 157' ' ' LEU . 5.4 m-30 -80.62 -51.05 9.17 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.505 1.128 . . . . 72.41 111.025 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -50.91 -40.36 56.78 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.541 1.151 . . . . 73.34 110.349 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 51.4 t80 -83.8 -17.37 41.29 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.489 1.118 . . . . 62.4 111.017 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.453 ' CD2' ' OG ' ' A' ' 156' ' ' SER . 1.3 t80 -136.9 105.7 5.89 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.515 1.134 . . . . 72.11 110.946 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 4.0 t -78.06 -2.96 39.8 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.411 1.07 . . . . 72.22 110.461 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' SER . . . . . 0.453 ' OG ' ' CD2' ' A' ' 154' ' ' TYR . 10.2 p -44.39 -49.42 9.68 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.474 1.109 . . . . 54.44 110.032 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.567 HD22 ' CZ ' ' A' ' 151' ' ' PHE . 4.4 mp -70.76 -42.47 70.39 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.458 1.099 . . . . 72.11 109.278 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' MET . . . . . 0.424 ' HE2' ' CD2' ' A' ' 151' ' ' PHE . 0.3 OUTLIER -50.57 -21.53 1.58 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.512 1.132 . . . . 73.51 111.002 -179.943 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' ASN . . . . . 0.437 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 74.1 m-20 -82.87 -32.77 27.26 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.549 1.156 . . . . 73.34 109.289 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.455 ' CB ' HG22 ' A' ' 170' ' ' VAL . 6.0 m -79.88 -31.56 40.35 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.55 1.156 . . . . 74.04 110.014 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . 0.543 ' CG1' ' CD1' ' A' ' 192' ' ' ILE . 96.5 t -61.28 -18.59 18.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.482 1.114 . . . . 74.2 109.264 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -66.41 -20.54 66.09 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.526 1.141 . . . . 61.03 109.267 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.467 ' NH1' ' H ' ' A' ' 193' ' ' ASN . 15.7 mmm-85 69.03 43.79 1.09 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.543 1.152 . . . . 74.31 110.301 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . 0.437 ' NE2' ' O ' ' A' ' 159' ' ' ASN . 12.3 mt-30 -69.99 176.73 3.55 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.484 1.115 . . . . 63.14 110.255 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 11.2 m80 -90.69 39.58 0.99 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.523 1.14 . . . . 71.02 109.607 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -90.74 -178.73 5.34 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.53 1.144 . . . . 73.33 109.319 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' TYR . . . . . 0.413 ' N ' HG22 ' A' ' 221' ' ' ILE . 0.4 OUTLIER -85.63 44.46 1.11 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.514 1.133 . . . . 74.33 110.976 -179.983 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.408 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 7.7 p30 -170.36 124.27 0.71 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.505 1.128 . . . . 74.45 109.301 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' SER . . . . . 0.452 ' N ' ' O ' ' A' ' 133' ' ' ALA . 2.5 m -125.0 111.52 15.49 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.486 1.116 . . . . 60.5 110.017 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.593 ' CG1' ' CD1' ' A' ' 137' ' ' LEU . 3.8 t -79.45 112.78 17.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.57 1.168 . . . . 62.35 109.296 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.7 mp -129.15 102.53 18.79 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.524 1.14 . . . . 75.4 109.264 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . 0.504 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.03 114.8 4.11 Favored 'Trans proline' 0 C--N 1.36 1.164 0 O-C-N 124.479 1.779 . . . . 70.41 111.056 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 173' ' ' MET . . . . . 0.466 ' HE1' ' CG ' ' A' ' 197' ' ' GLU . 6.1 ttt -80.2 161.55 25.14 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.527 1.142 . . . . 75.23 110.982 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 195' ' ' LEU . 75.0 mtt-85 -107.63 112.1 62.39 Favored Pre-proline 0 C--N 1.326 -0.435 0 O-C-N 124.528 1.142 . . . . 74.12 110.259 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.98 154.69 42.79 Favored 'Trans proline' 0 C--N 1.36 1.168 0 O-C-N 124.446 1.761 . . . . 74.03 110.987 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . 0.5 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -100.36 -45.34 5.61 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.453 1.095 . . . . 73.21 109.312 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . 0.436 ' H ' ' ND2' ' A' ' 177' ' ' ASN . 2.1 p30 -72.73 -25.12 61.1 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 73.12 109.323 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -108.75 101.7 44.89 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.507 1.129 . . . . 72.43 109.211 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.05 117.61 4.96 Favored 'Trans proline' 0 C--N 1.36 1.184 0 O-C-N 124.499 1.789 . . . . 73.13 111.001 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . 0.406 HD23 ' CB ' ' A' ' 184' ' ' ARG . 0.9 OUTLIER -132.97 96.67 17.57 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.561 1.163 . . . . 71.25 109.279 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.04 164.31 33.54 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.471 1.774 . . . . 63.42 110.991 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.04 -38.98 54.79 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.473 1.108 . . . . 73.24 110.279 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -49.45 -33.16 13.46 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.483 1.115 . . . . 74.24 110.325 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 184' ' ' ARG . . . . . 0.406 ' CB ' HD23 ' A' ' 180' ' ' LEU . 58.7 mmt-85 -91.83 -21.77 20.47 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.584 1.178 . . . . 73.23 110.317 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 185' ' ' THR . . . . . 0.425 ' HA ' ' HD3' ' A' ' 186' ' ' PRO . 19.4 m -84.36 143.86 42.54 Favored Pre-proline 0 C--N 1.325 -0.468 0 O-C-N 124.452 1.095 . . . . 74.41 110.412 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 185' ' ' THR . 18.3 Cg_endo -74.99 156.56 43.04 Favored 'Trans proline' 0 C--N 1.36 1.164 0 O-C-N 124.496 1.787 . . . . 63.42 111.007 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 187' ' ' PHE . . . . . 0.451 ' O ' ' CG2' ' A' ' 191' ' ' THR . 32.3 p90 -70.03 -7.03 37.71 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.493 1.121 . . . . 74.11 110.996 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -94.26 -52.9 4.16 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.46 1.1 . . . . 72.25 109.23 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 44.2 mt -68.48 -42.09 79.19 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.513 1.133 . . . . 75.25 109.334 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 190' ' ' GLN . . . . . 0.417 ' CG ' HG22 ' A' ' 191' ' ' THR . 1.4 pt20 -64.01 -9.9 18.67 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.523 1.139 . . . . 75.45 110.27 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 191' ' ' THR . . . . . 0.451 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 41.4 p -116.56 20.0 14.32 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.451 1.095 . . . . 75.32 110.38 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.543 ' CD1' ' CG1' ' A' ' 161' ' ' VAL . 6.5 mt -120.58 154.43 23.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.478 1.111 . . . . 74.41 109.285 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 193' ' ' ASN . . . . . 0.467 ' H ' ' NH1' ' A' ' 163' ' ' ARG . 35.4 t30 -64.84 77.47 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.491 1.12 . . . . 72.15 109.294 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . 0.504 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -73.51 174.78 7.75 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.496 1.123 . . . . 74.21 109.28 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 195' ' ' LEU . . . . . 0.447 ' O ' ' N ' ' A' ' 174' ' ' ARG . 0.4 OUTLIER -108.3 150.88 26.73 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.472 1.108 . . . . 71.34 109.348 179.97 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . 0.421 ' N ' HD13 ' A' ' 195' ' ' LEU . 26.3 mt-10 -141.92 141.4 32.98 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.429 1.08 . . . . 75.54 110.338 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . 0.466 ' CG ' ' HE1' ' A' ' 173' ' ' MET . 1.2 pt-20 -113.21 -28.78 7.5 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.474 1.109 . . . . 72.1 110.283 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . 0.432 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 21.0 pt-20 -88.37 3.01 51.37 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.488 1.117 . . . . 74.01 110.3 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 5.5 t -97.84 144.47 27.39 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.503 1.127 . . . . 73.35 110.03 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 4.8 tpm_? -61.87 -17.52 56.82 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.454 1.096 . . . . 71.23 110.253 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -103.07 19.05 47.63 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.47 1.106 . . . . 64.33 111.02 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 202' ' ' PHE . . . . . 0.597 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 0.1 OUTLIER -55.03 -44.34 99.55 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.469 0.747 . . . . 71.31 111.025 179.969 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 203' ' ' PRO . . . . . 0.597 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.05 -35.01 3.35 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.516 1.798 . . . . 60.05 110.963 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.98 -48.3 78.74 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.498 1.124 . . . . 74.23 110.362 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 205' ' ' GLN . . . . . 0.454 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 3.1 mt-30 -71.34 -38.7 71.64 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.443 1.09 . . . . 74.54 110.267 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 206' ' ' VAL . . . . . 0.571 HG23 ' CE1' ' A' ' 202' ' ' PHE . 70.7 t -65.71 -28.96 45.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.544 1.153 . . . . 73.31 109.327 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 207' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 2.8 mt-10 -78.04 -47.37 18.54 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.49 1.119 . . . . 72.51 110.337 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -68.97 -62.39 1.4 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.497 1.123 . . . . 70.12 110.253 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 209' ' ' ILE . . . . . 0.588 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 59.8 mt -47.92 -58.28 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.491 1.119 . . . . 73.41 109.328 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 210' ' ' PHE . . . . . 0.588 ' CE1' ' CG2' ' A' ' 209' ' ' ILE . 1.7 m-85 -99.46 66.68 1.48 Allowed 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.547 1.154 . . . . 71.35 110.996 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 211' ' ' GLN . . . . . 0.405 ' CB ' ' O ' ' A' ' 207' ' ' GLU . 0.0 OUTLIER -108.5 144.75 35.74 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.543 1.152 . . . . 75.32 110.321 179.974 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' A' ' 215' ' ' TYR . 29.3 tt0 -48.79 -55.26 12.06 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.575 1.172 . . . . 74.05 110.243 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.43 -24.85 1.39 Allowed 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.484 1.115 . . . . 74.42 110.017 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 43.9 t -96.71 -26.66 4.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.431 1.082 . . . . 72.12 109.277 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 215' ' ' TYR . . . . . 0.488 ' O ' ' CB ' ' A' ' 219' ' ' GLN . 1.8 t80 -69.2 -29.87 67.93 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.481 1.113 . . . . 75.12 110.98 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 29.8 mmtt -65.13 -66.32 0.56 Allowed 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.502 1.126 . . . . 74.44 109.322 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 10.1 m -44.44 -66.46 0.39 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.453 1.095 . . . . 74.21 110.376 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 218' ' ' GLN . . . . . 0.468 ' HA ' ' CD1' ' A' ' 221' ' ' ILE . 6.3 mp0 -47.29 -62.36 1.46 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.54 1.15 . . . . 72.45 110.285 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 219' ' ' GLN . . . . . 0.488 ' CB ' ' O ' ' A' ' 215' ' ' TYR . 33.8 tp60 -40.01 -46.03 2.02 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.452 1.095 . . . . 75.13 110.281 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.1 m -66.09 -44.39 84.52 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.463 1.102 . . . . 71.12 110.4 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 221' ' ' ILE . . . . . 0.468 ' CD1' ' HA ' ' A' ' 218' ' ' GLN . 15.4 mt -56.19 -24.4 17.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 O-C-N 124.559 1.162 . . . . 74.44 109.274 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 222' ' ' TRP . . . . . 0.72 ' CD1' ' NH2' ' A' ' 226' ' ' ARG . 73.4 t90 -78.24 -74.09 0.29 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.529 1.143 . . . . 73.21 108.006 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . 0.42 ' HG3' ' N ' ' A' ' 224' ' ' GLU . 0.3 OUTLIER -44.28 -26.08 0.29 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.44 1.087 . . . . 75.21 109.334 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . 0.436 ' N ' ' C ' ' A' ' 222' ' ' TRP . 3.2 mm-40 -58.21 -53.8 54.23 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.521 1.138 . . . . 73.31 110.263 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 225' ' ' THR . . . . . 0.521 ' CG2' ' NH2' ' A' ' 226' ' ' ARG . 6.5 t -66.81 -16.99 64.65 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.482 1.114 . . . . 71.24 110.375 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 226' ' ' ARG . . . . . 0.72 ' NH2' ' CD1' ' A' ' 222' ' ' TRP . 0.0 OUTLIER -59.75 -34.3 72.79 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.537 1.148 . . . . 73.12 110.269 -179.933 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 227' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -76.01 -31.37 58.89 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.505 1.128 . . . . 75.4 109.331 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 228' ' ' MET . . . . . 0.47 ' CE ' ' HA ' ' A' ' 225' ' ' THR . 29.5 mtt -61.88 -46.57 88.85 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.551 1.157 . . . . 64.44 110.949 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 229' ' ' VAL . . . . . . . . . . . . . 1.2 m -69.97 -42.11 79.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.511 1.132 . . . . 74.41 109.259 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 230' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.14 -10.16 59.49 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.523 1.139 . . . . 75.12 110.306 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 32.3 ttt-85 -88.27 -83.31 0.22 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.567 1.167 . . . . 75.33 110.266 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -140.95 40.02 1.81 Allowed 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.539 1.149 . . . . 64.43 110.291 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.25 37.19 0.61 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.467 1.104 . . . . 73.43 111.006 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -45.39 153.99 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.515 1.134 . . . . 75.02 109.327 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.476 0 O-C-N 124.472 1.108 . . . . 71.15 109.264 -179.972 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.03 0 N-CA-C 110.988 -0.845 . . . . 74.41 110.988 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.97 151.77 40.06 Favored 'Trans proline' 0 C--N 1.359 1.088 0 O-C-N 124.567 1.825 . . . . 74.4 110.995 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -94.08 -46.89 6.92 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.489 1.118 . . . . 74.41 109.311 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -125.57 109.96 1.25 Allowed Glycine 0 CA--C 1.531 1.047 0 O-C-N 124.492 1.12 . . . . 64.44 110.967 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 69.2 p -157.01 159.48 38.05 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.514 0.773 . . . . 63.53 109.971 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -40.93 124.41 2.15 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.45 1.094 . . . . 73.15 110.293 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -119.79 129.44 54.46 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.498 1.124 . . . . 70.33 110.294 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.491 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.5 p -134.24 158.61 42.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.494 1.122 . . . . 73.51 109.332 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.565 ' CE2' ' HD3' ' A' ' 108' ' ' PRO . 8.5 p90 -89.61 29.35 1.15 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.422 1.076 . . . . 72.05 110.99 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 5.8 tp -39.9 155.66 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.529 1.143 . . . . 74.14 109.328 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.414 ' NZ ' HD13 ' A' ' 106' ' ' ILE . 1.4 ttpt -95.69 -58.54 2.08 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.548 1.155 . . . . 72.03 109.31 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.61 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.2 OUTLIER -165.05 146.69 7.76 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.468 1.105 . . . . 70.24 111.056 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.528 ' CG2' ' CE ' ' A' ' 115' ' ' MET . 12.0 p -99.62 151.37 4.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.559 1.162 . . . . 72.23 109.335 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.483 ' CG1' HG13 ' A' ' 136' ' ' ILE . 4.6 mp -114.77 99.41 8.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.525 1.141 . . . . 74.1 109.268 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.428 HD12 ' CB ' ' A' ' 128' ' ' ALA . 1.9 mp -73.45 117.46 15.24 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.566 1.166 . . . . 75.52 109.31 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.594 ' CE1' ' OG1' ' A' ' 90' ' ' THR . 0.0 OUTLIER -135.58 166.49 23.1 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.531 1.144 . . . . 75.51 109.611 -179.999 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.453 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -105.03 155.61 18.81 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.566 1.166 . . . . 72.13 109.341 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -57.49 -17.03 11.4 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.536 1.148 . . . . 75.12 110.349 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -82.99 -43.16 16.71 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.465 1.103 . . . . 63.52 109.292 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.441 ' N ' ' OD1' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -119.1 42.97 2.7 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.525 1.141 . . . . 73.32 109.306 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.594 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -80.62 -25.97 38.07 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.571 1.169 . . . . 71.41 110.409 179.979 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.441 ' O ' ' N ' ' A' ' 95' ' ' ARG . 0.8 OUTLIER -79.81 -35.44 38.43 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.477 1.111 . . . . 75.53 109.334 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.462 ' O ' ' N ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -62.75 -66.89 0.47 Allowed 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.499 1.124 . . . . 71.42 110.259 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.481 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -47.31 -36.89 9.92 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.523 1.139 . . . . 54.41 109.302 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.415 HD21 ' CG ' ' A' ' 97' ' ' GLN . 0.1 OUTLIER -74.97 -33.39 61.88 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 124.483 1.115 . . . . 73.24 109.298 -179.966 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 92' ' ' GLU . 11.6 tpt180 -54.09 -46.67 72.13 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.515 1.135 . . . . 75.14 110.293 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.543 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 0.3 OUTLIER -76.21 -52.39 17.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.415 1.072 . . . . 74.21 109.327 179.978 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.543 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -48.15 -23.49 0.86 Allowed 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.521 1.138 . . . . 74.31 110.343 179.951 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -75.65 -38.59 58.72 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.557 1.161 . . . . 73.42 109.298 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.455 HD21 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -83.26 -21.67 33.26 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.515 1.134 . . . . 71.12 109.318 179.954 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.478 ' CD2' HG21 ' A' ' 206' ' ' VAL . 51.1 mt -61.97 -51.84 66.44 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.485 1.116 . . . . 74.1 109.285 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -76.39 55.1 0.97 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.524 1.14 . . . . 75.04 110.281 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -179.71 -67.43 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.497 1.123 . . . . 74.33 109.318 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -40.73 -60.96 1.03 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.523 1.139 . . . . 73.32 109.36 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.401 ' CZ ' HG13 ' A' ' 206' ' ' VAL . 1.3 m-85 -104.25 -19.47 14.1 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.477 1.111 . . . . 71.13 110.977 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.06 45.18 4.22 Favored Glycine 0 CA--C 1.529 0.945 0 O-C-N 124.493 1.121 . . . . 73.24 111.042 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.414 HD13 ' NZ ' ' A' ' 80' ' ' LYS . 6.6 mm -85.29 86.36 2.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.436 0.727 . . . . 74.02 109.298 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.494 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -138.06 157.2 73.39 Favored Pre-proline 0 C--N 1.326 -0.454 0 O-C-N 124.475 1.11 . . . . 74.2 109.322 179.951 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.565 ' HD3' ' CE2' ' A' ' 78' ' ' PHE . 18.0 Cg_endo -75.12 150.17 94.83 Favored 'Cis proline' 0 C--N 1.36 1.141 0 C-N-CA 120.938 -2.526 . . . . 75.42 110.987 0.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -122.65 137.73 11.44 Favored Glycine 0 CA--C 1.53 1.0 0 O-C-N 124.484 1.115 . . . . 75.4 110.955 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 1.2 tt -153.72 148.26 13.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.516 0.774 . . . . 73.3 109.334 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.421 HD12 ' NE2' ' A' ' 85' ' ' HIS . 32.4 pt -101.39 161.45 3.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.482 1.114 . . . . 73.02 109.272 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -61.55 -19.6 62.33 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.46 1.1 . . . . 73.4 110.95 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -87.64 -12.41 45.59 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.536 1.148 . . . . 71.3 109.304 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -103.83 -17.49 15.03 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.528 1.142 . . . . 72.11 110.276 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.528 ' CE ' ' CG2' ' A' ' 82' ' ' VAL . 9.1 ttm -50.84 143.52 14.93 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.523 1.139 . . . . 71.21 110.996 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.03 -10.11 21.02 Favored 'Trans proline' 0 C--N 1.359 1.13 0 O-C-N 124.532 1.806 . . . . 72.54 111.057 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.429 ' CE1' ' O ' ' A' ' 121' ' ' HIS . 15.4 t-160 -50.05 -50.39 47.89 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 124.444 1.09 . . . . 72.22 109.62 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 107.59 164.2 21.66 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.499 1.124 . . . . 60.41 110.958 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 43.8 mtp180 -97.26 13.07 30.74 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.537 0.787 . . . . 63.23 110.254 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -63.52 -45.59 89.92 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.431 1.082 . . . . 73.42 110.276 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . 0.429 ' O ' ' CE1' ' A' ' 117' ' ' HIS . 21.7 m-70 -156.11 114.98 3.46 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.535 1.147 . . . . 74.25 109.598 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.521 ' CD1' ' N ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -110.62 60.11 0.61 Allowed 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.49 1.118 . . . . 75.25 109.297 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -116.52 44.51 1.99 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.466 1.104 . . . . 74.31 110.286 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 58.2 m-20 -140.94 107.21 5.24 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.529 1.143 . . . . 64.15 109.286 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.495 ' CD1' ' O ' ' A' ' 150' ' ' ASN . 2.9 mt -84.12 -54.05 5.1 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.622 1.202 . . . . 71.14 109.339 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.474 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 0.2 OUTLIER -40.31 -44.23 1.88 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.49 1.119 . . . . 73.34 109.278 -179.995 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -50.07 -49.68 50.54 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.477 1.11 . . . . 55.54 109.362 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.453 ' N ' ' O ' ' A' ' 125' ' ' LEU . . . -68.87 -38.56 79.8 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.53 1.144 . . . . 73.21 109.324 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.473 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 86.9 t -92.93 30.64 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.462 1.101 . . . . 74.4 109.288 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.474 ' CB ' ' O ' ' A' ' 126' ' ' ASP . 6.2 t30 -138.47 152.3 48.18 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.437 1.086 . . . . 75.44 109.296 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 51.35 53.51 27.83 Favored Glycine 0 CA--C 1.53 0.983 0 O-C-N 124.448 1.092 . . . . 32.35 110.982 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 1.2 p -163.4 -179.73 6.74 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.501 0.766 . . . . 74.43 109.974 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.597 ' CB ' ' CZ3' ' A' ' 134' ' ' TRP . . . -104.25 -46.26 4.46 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.524 1.14 . . . . 74.12 109.29 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.597 ' CZ3' ' CB ' ' A' ' 133' ' ' ALA . 0.5 OUTLIER -145.51 174.29 11.28 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.567 1.167 . . . . 75.23 108.042 -179.978 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.438 HG23 ' CG1' ' A' ' 82' ' ' VAL . 2.4 p -139.22 129.18 25.01 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.497 1.123 . . . . 63.3 110.387 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.483 HG13 ' CG1' ' A' ' 83' ' ' ILE . 15.0 mm -84.4 95.0 3.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.393 1.058 . . . . 74.03 109.292 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 13.2 mt -82.69 94.19 7.53 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.486 1.116 . . . . 72.54 109.344 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.59 ' O ' ' CD1' ' A' ' 143' ' ' PHE . 3.3 tp -61.3 97.71 0.07 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.513 1.133 . . . . 75.23 109.345 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.426 HD13 ' CD1' ' A' ' 189' ' ' LEU . 2.0 tp -70.22 105.75 3.07 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.478 1.112 . . . . 74.13 109.296 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.419 ' HB ' ' CB ' ' A' ' 143' ' ' PHE . 4.8 m -133.63 154.88 50.56 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.471 1.107 . . . . 73.3 110.389 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -49.96 -39.1 39.59 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.546 1.154 . . . . 74.02 110.302 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -89.0 -53.89 4.38 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.53 1.144 . . . . 61.11 109.318 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.59 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 16.8 t80 -51.19 -20.53 1.59 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.521 1.138 . . . . 73.11 111.044 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.519 ' O ' ' CB ' ' A' ' 148' ' ' TRP . 2.0 tm? -60.85 -68.06 0.34 Allowed 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.45 1.094 . . . . 71.21 109.336 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.451 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 2.0 mpt_? -67.52 -12.21 59.81 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.462 1.101 . . . . 75.04 110.3 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . 0.4 ' O ' ' CG ' ' A' ' 150' ' ' ASN . 27.6 t0 -65.84 -61.45 2.05 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.563 1.164 . . . . 73.43 109.303 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.555 ' OG1' ' CE1' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -88.23 -46.5 9.19 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.554 1.159 . . . . 62.54 110.407 -179.981 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.519 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 32.1 t-105 -44.52 -34.4 2.09 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.522 1.139 . . . . 65.21 107.979 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . 0.451 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 42.3 t -77.87 -45.43 24.24 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.502 1.126 . . . . 62.13 108.304 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.495 ' O ' ' CD1' ' A' ' 125' ' ' LEU . 31.1 m-20 -62.51 -16.93 58.41 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.446 1.091 . . . . 74.43 109.306 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.568 ' CZ ' ' CD1' ' A' ' 157' ' ' LEU . 8.7 m-30 -82.19 -47.8 12.05 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.515 1.135 . . . . 72.01 111.063 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -48.15 -39.83 21.93 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.499 1.124 . . . . 74.04 110.291 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -83.96 -23.23 31.18 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.47 1.106 . . . . 75.33 110.924 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -129.13 97.99 4.78 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.467 1.105 . . . . 74.14 111.016 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.45 -2.7 57.64 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.523 1.139 . . . . 74.5 110.411 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 1.8 m -53.88 -38.23 64.53 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.513 1.133 . . . . 73.22 110.01 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.568 ' CD1' ' CZ ' ' A' ' 151' ' ' PHE . 2.3 pp -89.58 -27.66 20.08 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.451 1.094 . . . . 75.11 109.315 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' MET . . . . . . . . . . . . . 12.4 tpp -54.66 -26.28 32.28 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.487 1.117 . . . . 64.34 110.972 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' ASN . . . . . 0.423 ' HB3' ' NE2' ' A' ' 164' ' ' GLN . 54.6 m-80 -66.56 -31.17 71.7 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.559 1.162 . . . . 75.25 109.322 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.462 ' HB3' ' CG2' ' A' ' 170' ' ' VAL . 0.3 OUTLIER -74.86 -28.15 60.55 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.521 1.138 . . . . 75.03 110.077 179.922 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . 0.454 HG11 ' CD1' ' A' ' 192' ' ' ILE . 82.4 t -57.39 -17.85 7.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.487 1.117 . . . . 74.31 109.348 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -91.42 35.71 0.94 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.622 1.201 . . . . 73.3 109.211 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.428 ' HE ' ' N ' ' A' ' 163' ' ' ARG . 0.0 OUTLIER 47.34 32.44 2.22 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.49 1.119 . . . . 72.02 110.294 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . 0.423 ' NE2' ' HB3' ' A' ' 159' ' ' ASN . 0.2 OUTLIER -56.42 129.01 38.8 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.469 1.106 . . . . 71.42 110.261 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 16.0 t-80 -85.97 48.57 1.63 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.507 1.129 . . . . 75.1 109.589 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 3.0 tptp -95.63 171.89 8.39 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.506 1.129 . . . . 75.13 109.204 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' TYR . . . . . 0.787 ' CE2' ' CD1' ' A' ' 222' ' ' TRP . 3.4 t80 -38.45 -64.49 0.42 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.501 1.125 . . . . 75.54 111.075 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.431 ' ND2' ' CG1' ' A' ' 129' ' ' VAL . 1.2 p-10 -90.78 133.07 35.47 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.428 1.08 . . . . 72.24 109.271 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' SER . . . . . 0.454 ' N ' ' O ' ' A' ' 133' ' ' ALA . 1.8 t -108.78 177.24 4.83 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.569 1.168 . . . . 65.44 109.98 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.462 ' CG2' ' HB3' ' A' ' 160' ' ' SER . 3.2 t -137.36 103.36 2.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.498 1.124 . . . . 75.31 109.279 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.7 mp -121.95 99.95 43.57 Favored Pre-proline 0 C--N 1.324 -0.513 0 O-C-N 124.527 1.142 . . . . 72.42 109.274 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . 0.519 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.3 Cg_endo -75.03 118.85 5.4 Favored 'Trans proline' 0 C--N 1.36 1.178 0 O-C-N 124.444 1.76 . . . . 73.44 110.98 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 173' ' ' MET . . . . . 0.412 ' CE ' HG12 ' A' ' 96' ' ' VAL . 4.1 ttt -89.09 151.64 22.11 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.471 1.107 . . . . 64.32 110.962 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . 0.544 ' NH2' ' H ' ' A' ' 180' ' ' LEU . 0.2 OUTLIER -105.68 117.52 57.71 Favored Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.469 1.105 . . . . 74.3 110.286 -179.991 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.04 150.0 37.34 Favored 'Trans proline' 0 C--N 1.359 1.112 0 O-C-N 124.515 1.797 . . . . 72.34 110.99 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . 0.496 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -88.64 -38.86 14.48 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.528 1.142 . . . . 74.51 109.331 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -72.78 -26.48 61.55 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.459 1.099 . . . . 74.42 109.255 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 178' ' ' ASN . . . . . 0.437 ' O ' ' NH2' ' A' ' 174' ' ' ARG . 4.0 m-80 -110.76 103.03 53.9 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.55 1.156 . . . . 75.31 109.297 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.05 115.65 4.34 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.543 1.812 . . . . 71.14 110.963 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . 0.544 ' H ' ' NH2' ' A' ' 174' ' ' ARG . 0.4 OUTLIER -116.98 97.09 50.28 Favored Pre-proline 0 C--N 1.325 -0.484 0 O-C-N 124.557 1.161 . . . . 73.34 109.3 179.969 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 164.51 33.22 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.467 1.772 . . . . 75.22 111.016 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 59.4 mtt180 -67.13 -16.64 64.45 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.544 1.152 . . . . 72.31 110.335 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -74.81 -17.09 60.67 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.512 1.133 . . . . 65.4 110.342 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -117.41 16.69 14.71 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.525 1.141 . . . . 73.41 110.357 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 185' ' ' THR . . . . . 0.498 ' OG1' ' CD1' ' A' ' 180' ' ' LEU . 19.1 m -116.86 143.6 31.82 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.456 1.098 . . . . 73.24 110.435 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 185' ' ' THR . 18.5 Cg_endo -75.04 155.99 42.77 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.539 1.81 . . . . 73.54 111.022 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 187' ' ' PHE . . . . . 0.503 ' O ' ' CG2' ' A' ' 191' ' ' THR . 37.9 p90 -69.74 -7.26 37.95 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.516 1.135 . . . . 72.34 110.956 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.87 -52.74 4.29 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.502 1.126 . . . . 70.3 109.312 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.426 ' CD1' HD13 ' A' ' 139' ' ' LEU . 43.4 mt -68.45 -42.31 78.99 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.521 1.138 . . . . 73.42 109.29 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -63.98 -10.76 23.35 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.46 1.1 . . . . 75.4 110.344 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 191' ' ' THR . . . . . 0.503 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 35.7 p -113.64 19.92 16.37 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.535 1.147 . . . . 75.24 110.383 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.454 ' CD1' HG11 ' A' ' 161' ' ' VAL . 28.1 mt -113.28 160.64 12.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.486 1.116 . . . . 74.45 109.262 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 193' ' ' ASN . . . . . 0.44 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 35.7 t30 -76.39 62.88 1.89 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.502 1.127 . . . . 74.1 109.301 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . 0.519 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -56.96 143.41 38.03 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.441 1.088 . . . . 74.13 109.308 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 195' ' ' LEU . . . . . 0.423 HD21 ' N ' ' A' ' 206' ' ' VAL . 0.7 OUTLIER -80.26 123.49 28.01 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.47 1.106 . . . . 71.45 109.27 -179.926 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -103.43 137.5 41.44 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.453 1.096 . . . . 73.32 110.294 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . 0.444 ' HG3' ' CD1' ' A' ' 176' ' ' LEU . 0.6 OUTLIER -113.71 -24.73 9.02 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.552 1.157 . . . . 74.21 110.292 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . 0.414 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 6.5 pt-20 -102.51 21.72 14.75 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.518 1.136 . . . . 62.11 110.269 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -117.34 162.99 17.02 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 124.513 1.133 . . . . 63.4 110.014 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 21.5 ttt-85 -64.88 -42.77 94.55 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.499 1.124 . . . . 71.24 110.316 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -90.9 41.62 2.91 Favored Glycine 0 CA--C 1.531 1.072 0 O-C-N 124.475 1.11 . . . . 71.33 110.97 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 202' ' ' PHE . . . . . 0.611 ' CD1' ' C ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -77.63 -47.71 2.36 Favored Pre-proline 0 C--N 1.325 -0.495 0 O-C-N 124.555 0.797 . . . . 71.23 110.974 -179.983 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 203' ' ' PRO . . . . . 0.578 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.5 Cg_endo -75.02 -25.94 11.35 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.528 1.804 . . . . 73.21 111.053 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 204' ' ' THR . . . . . 0.43 ' O ' ' HD3' ' A' ' 208' ' ' ARG . 0.8 OUTLIER -61.69 -55.45 30.31 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.572 1.17 . . . . 73.23 110.407 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 205' ' ' GLN . . . . . 0.452 ' HB3' ' CD1' ' A' ' 209' ' ' ILE . 2.1 mt-30 -54.55 -62.43 1.66 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.599 1.187 . . . . 75.11 110.377 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 206' ' ' VAL . . . . . 0.578 ' CG1' ' HA ' ' A' ' 203' ' ' PRO . 3.2 p -40.75 -30.98 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.518 1.136 . . . . 75.3 109.351 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 207' ' ' GLU . . . . . 0.402 ' N ' ' C ' ' A' ' 205' ' ' GLN . 0.9 OUTLIER -79.56 -65.88 0.94 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.516 1.135 . . . . 72.21 110.302 179.969 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . 0.43 ' HD3' ' O ' ' A' ' 204' ' ' THR . 4.8 mpt_? -46.13 -58.0 4.01 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.507 1.129 . . . . 74.41 110.264 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 209' ' ' ILE . . . . . 0.488 HG22 ' CE1' ' A' ' 210' ' ' PHE . 15.3 mt -54.57 -66.43 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 O-C-N 124.474 1.109 . . . . 74.23 109.26 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 210' ' ' PHE . . . . . 0.578 ' HA ' ' CZ2' ' A' ' 134' ' ' TRP . 0.4 OUTLIER -90.06 65.95 6.64 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.493 1.121 . . . . 74.15 111.024 -179.986 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -110.31 146.35 35.88 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.595 1.184 . . . . 72.23 110.297 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.458 ' O ' ' N ' ' A' ' 215' ' ' TYR . 22.8 tt0 -48.88 -55.48 11.6 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 124.441 1.088 . . . . 72.22 110.293 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.41 -24.09 1.14 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.48 1.112 . . . . 74.13 109.993 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 24.1 t -96.16 -28.46 3.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.559 1.162 . . . . 73.11 109.297 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 215' ' ' TYR . . . . . 0.458 ' N ' ' O ' ' A' ' 212' ' ' GLU . 12.8 t80 -64.92 -23.41 67.22 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.524 1.14 . . . . 75.44 111.006 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -66.19 0.58 Allowed 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.525 1.141 . . . . 74.3 109.264 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 217' ' ' THR . . . . . 0.483 ' CG2' ' CD1' ' A' ' 221' ' ' ILE . 25.7 m -41.1 -66.12 0.36 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.514 1.134 . . . . 54.53 110.372 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 218' ' ' GLN . . . . . 0.47 ' H ' ' NE2' ' A' ' 218' ' ' GLN . 0.0 OUTLIER -39.66 -53.56 2.15 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.408 1.068 . . . . 74.31 110.292 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 11.8 tp60 -53.92 -53.8 47.63 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.496 1.123 . . . . 72.22 110.261 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 220' ' ' THR . . . . . 0.414 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 1.3 m -62.87 -19.21 63.92 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.498 1.124 . . . . 65.21 110.438 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 221' ' ' ILE . . . . . 0.483 ' CD1' ' CG2' ' A' ' 217' ' ' THR . 56.3 mt -83.62 -25.36 7.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.525 1.141 . . . . 73.31 109.328 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 222' ' ' TRP . . . . . 0.787 ' CD1' ' CE2' ' A' ' 167' ' ' TYR . 6.9 t90 -78.13 -43.36 29.06 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.54 1.15 . . . . 73.15 107.999 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . 0.414 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -68.39 -33.57 74.47 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.542 1.151 . . . . 70.02 109.313 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . 0.414 ' N ' ' HD3' ' A' ' 223' ' ' LYS . 1.8 mm-40 -68.7 -41.22 79.45 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.538 1.149 . . . . 74.44 110.367 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 3.0 t -75.61 -7.89 55.39 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.456 1.098 . . . . 75.43 110.379 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 12.0 mtp85 -84.82 -20.17 31.35 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.491 1.12 . . . . 74.32 110.26 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 227' ' ' ASN . . . . . 0.72 ' N ' HD21 ' A' ' 227' ' ' ASN . 0.8 OUTLIER -91.72 -42.71 9.99 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.546 1.154 . . . . 74.33 109.312 -179.968 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 228' ' ' MET . . . . . 0.409 ' HG3' ' N ' ' A' ' 229' ' ' VAL . 7.2 ptp -60.09 -37.24 79.37 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.503 1.127 . . . . 74.25 111.049 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 229' ' ' VAL . . . . . 0.409 ' N ' ' HG3' ' A' ' 228' ' ' MET . 32.0 m -75.01 -46.76 39.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 O-C-N 124.438 1.086 . . . . 73.34 109.37 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 230' ' ' GLN . . . . . 0.405 ' N ' HG22 ' A' ' 229' ' ' VAL . 4.1 tp-100 -69.24 -10.31 57.19 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.472 1.108 . . . . 71.52 110.28 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -92.61 -81.02 0.36 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.472 1.107 . . . . 75.04 110.25 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -145.12 56.49 1.25 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.454 1.096 . . . . 71.3 110.294 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -167.66 176.6 6.32 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.518 1.136 . . . . 70.35 111.032 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 5.1 mm -130.8 143.91 39.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.557 1.161 . . . . 75.22 109.348 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.462 0 O-C-N 124.522 1.139 . . . . 64.3 109.316 -179.994 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.012 0 N-CA-C 111.011 -0.836 . . . . 72.14 111.011 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.03 170.32 20.67 Favored 'Trans proline' 0 C--N 1.36 1.145 0 O-C-N 124.499 1.789 . . . . 75.22 111.012 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -114.65 -49.65 2.81 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.564 1.165 . . . . 64.22 109.33 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -104.75 -61.25 0.65 Allowed Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.529 1.143 . . . . 72.4 111.013 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.4 m -42.66 162.72 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.477 0.751 . . . . 61.51 110.002 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -94.69 148.2 22.52 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.499 1.125 . . . . 74.11 110.32 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.484 ' OE2' ' CH2' ' A' ' 222' ' ' TRP . 2.8 tt0 -130.55 129.3 42.64 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.52 1.137 . . . . 70.14 110.319 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.471 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 4.2 p -130.79 154.05 40.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.474 1.109 . . . . 73.13 109.254 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.411 ' O ' ' C ' ' A' ' 79' ' ' LEU . 20.0 m-85 -88.39 26.88 1.34 Allowed 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.527 1.142 . . . . 74.31 110.989 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.411 ' C ' ' O ' ' A' ' 78' ' ' PHE . 12.4 tp -39.65 152.05 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.497 1.123 . . . . 73.11 109.337 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.461 ' O ' ' N ' ' A' ' 133' ' ' ALA . 1.4 ttpt -90.09 -60.4 1.94 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.553 1.158 . . . . 73.25 109.337 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.592 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.6 OUTLIER -161.28 131.61 5.05 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.515 1.134 . . . . 75.41 111.014 179.968 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.448 HG12 ' CB ' ' A' ' 128' ' ' ALA . 11.6 p -84.73 162.36 2.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 124.463 1.102 . . . . 65.21 109.29 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.419 HG13 ' CG1' ' A' ' 136' ' ' ILE . 4.9 mp -125.41 96.25 3.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.48 1.113 . . . . 75.54 109.274 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.45 HD22 ' CD1' ' A' ' 112' ' ' PHE . 6.8 mt -69.87 123.55 21.77 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.532 1.145 . . . . 74.43 109.292 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.59 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -146.15 174.46 11.29 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.513 1.133 . . . . 75.3 109.59 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.468 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -127.91 152.3 48.03 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.509 1.13 . . . . 74.31 109.366 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -46.31 -24.25 0.46 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.516 1.135 . . . . 75.35 110.305 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -63.45 -46.52 85.87 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.469 1.106 . . . . 73.21 109.267 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.449 ' OD1' ' ND2' ' A' ' 178' ' ' ASN . 0.0 OUTLIER -134.91 44.81 2.59 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.435 1.085 . . . . 74.41 109.307 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.59 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -75.18 -26.58 59.15 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.567 1.167 . . . . 73.31 110.417 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -82.43 -21.44 35.71 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.576 1.172 . . . . 73.2 109.314 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.3 -54.89 6.13 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.597 1.185 . . . . 71.32 110.261 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.488 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -59.06 -30.48 68.09 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.495 1.122 . . . . 72.33 109.371 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.434 HD21 ' CG ' ' A' ' 97' ' ' GLN . 0.0 OUTLIER -78.62 -51.6 9.65 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.481 1.113 . . . . 74.31 109.326 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 2.2 tmt_? -41.19 -43.19 2.26 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.573 1.17 . . . . 74.55 110.264 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.55 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 0.3 OUTLIER -75.57 -52.96 16.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.479 1.112 . . . . 73.33 109.259 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.55 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -48.87 -20.89 0.55 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.436 1.085 . . . . 73.4 110.304 -179.988 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.41 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -79.82 -41.2 26.89 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.555 1.16 . . . . 64.12 109.235 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.467 HD22 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -77.97 -22.09 49.96 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.44 1.088 . . . . 73.34 109.29 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.467 ' N ' HD22 ' A' ' 99' ' ' LEU . 36.8 mt -67.62 -44.72 77.35 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.513 1.133 . . . . 73.51 109.299 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -82.04 49.62 1.42 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.443 1.089 . . . . 75.31 110.237 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -174.44 -64.95 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.571 1.169 . . . . 74.14 109.294 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -41.56 -52.4 3.73 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.495 1.122 . . . . 75.34 109.241 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -111.03 -30.03 7.66 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.537 1.148 . . . . 71.41 110.995 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.464 ' O ' ' CD ' ' A' ' 107' ' ' LYS . . . 109.1 26.97 5.01 Favored Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.581 1.176 . . . . 72.41 110.979 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.443 HG23 ' CE ' ' A' ' 80' ' ' LYS . 25.4 mm -70.82 95.42 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 O-C-N 124.473 0.749 . . . . 74.42 109.257 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.482 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -142.02 158.48 61.76 Favored Pre-proline 0 C--N 1.326 -0.451 0 O-C-N 124.487 1.117 . . . . 75.21 109.313 179.968 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.482 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.01 161.68 94.36 Favored 'Cis proline' 0 C--N 1.36 1.171 0 C-N-CA 121.009 -2.496 . . . . 73.53 111.011 0.057 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -117.29 112.12 2.41 Favored Glycine 0 CA--C 1.529 0.948 0 O-C-N 124.46 1.1 . . . . 73.23 111.009 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.84 128.81 47.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.44 0.729 . . . . 63.52 109.289 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.41 HD12 ' NE2' ' A' ' 85' ' ' HIS . 43.4 pt -91.44 -176.59 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.528 1.143 . . . . 63.51 109.306 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.45 ' CD1' HD22 ' A' ' 84' ' ' LEU . 1.7 t80 -81.67 -19.99 40.5 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.474 1.109 . . . . 52.1 110.942 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -90.49 -3.45 57.63 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.496 1.122 . . . . 75.14 109.289 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -110.23 -26.58 9.55 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.577 1.173 . . . . 70.54 110.306 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 26.8 tpp -38.77 110.88 0.6 Allowed Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.512 1.132 . . . . 74.13 110.995 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 67.24 5.99 Favored 'Trans proline' 0 C--N 1.36 1.141 0 O-C-N 124.481 1.78 . . . . 72.22 110.951 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -107.39 12.96 27.48 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.531 1.144 . . . . 73.2 109.569 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 87.44 -119.6 5.3 Favored Glycine 0 CA--C 1.53 1.0 0 O-C-N 124.482 1.114 . . . . 41.54 111.038 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.23 142.46 7.21 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.516 0.774 . . . . 74.03 110.236 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.41 -28.52 69.32 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.44 1.087 . . . . 63.13 110.365 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -53.33 96.2 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.481 1.113 . . . . 73.32 109.55 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.404 HD11 ' N ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -45.63 148.41 0.73 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.484 1.115 . . . . 73.03 109.269 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -77.27 -59.29 2.84 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.477 1.111 . . . . 75.43 110.386 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -173.16 -175.58 1.22 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.533 1.146 . . . . 74.24 109.31 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.492 ' CD2' ' OG1' ' A' ' 147' ' ' THR . 0.3 OUTLIER -84.47 -50.87 7.36 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.543 1.152 . . . . 74.44 109.287 -179.945 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.4 ' C ' ' O ' ' A' ' 125' ' ' LEU . 0.7 OUTLIER -40.14 -30.02 0.09 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.557 1.161 . . . . 63.14 109.36 179.987 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.434 ' N ' ' C ' ' A' ' 125' ' ' LEU . 1.0 OUTLIER -57.78 -53.42 58.37 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.474 1.109 . . . . 75.33 109.316 179.919 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.448 ' CB ' HG12 ' A' ' 82' ' ' VAL . . . -67.21 -25.13 65.96 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.573 1.17 . . . . 75.11 109.298 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.438 ' O ' ' CB ' ' A' ' 168' ' ' ASN . 67.2 t -89.99 15.62 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.429 1.08 . . . . 74.54 109.263 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.406 ' O ' ' C ' ' A' ' 131' ' ' GLY . 3.9 m-20 -129.85 165.79 21.3 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.519 1.137 . . . . 74.33 109.276 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . 0.406 ' C ' ' O ' ' A' ' 130' ' ' ASN . . . 37.15 54.43 1.56 Allowed Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.448 1.093 . . . . 74.13 111.027 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 7.8 m -163.33 174.23 12.26 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.484 0.755 . . . . 73.23 110.022 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.675 ' CB ' ' CZ3' ' A' ' 134' ' ' TRP . . . -105.45 -28.12 11.03 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.537 1.148 . . . . 73.42 109.258 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.675 ' CZ3' ' CB ' ' A' ' 133' ' ' ALA . 1.1 m-90 -161.95 178.71 8.64 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.974 -1.121 . . . . 74.13 107.974 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.452 ' OG1' ' HA ' ' A' ' 170' ' ' VAL . 74.8 p -147.64 135.46 21.1 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.464 1.103 . . . . 63.23 110.359 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.436 ' O ' ' O ' ' A' ' 84' ' ' LEU . 6.9 mm -84.18 97.76 5.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 124.49 1.119 . . . . 73.34 109.304 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -77.89 87.41 4.09 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.499 1.125 . . . . 54.44 109.374 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.592 ' O ' ' CD1' ' A' ' 143' ' ' PHE . 2.3 tp -62.07 103.12 0.34 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.514 1.134 . . . . 72.3 109.318 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.411 ' N ' HD11 ' A' ' 139' ' ' LEU . 0.0 OUTLIER -75.25 106.46 6.78 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.435 1.085 . . . . 74.3 109.328 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.503 ' O ' ' CB ' ' A' ' 144' ' ' LEU . 2.5 m -135.24 162.64 31.98 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.344 1.027 . . . . 73.54 110.459 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -63.44 -34.8 78.54 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.507 1.129 . . . . 73.33 110.227 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . 0.407 ' H ' ' ND2' ' A' ' 142' ' ' ASN . 1.9 p30 -89.35 -53.34 4.59 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.569 1.168 . . . . 75.22 109.262 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.592 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 31.2 t80 -53.32 -36.88 61.75 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.528 1.143 . . . . 61.43 110.958 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.503 ' CB ' ' O ' ' A' ' 140' ' ' THR . 2.1 tm? -60.81 -68.15 0.33 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.471 1.107 . . . . 73.12 109.293 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.418 ' N ' HD13 ' A' ' 144' ' ' LEU . 6.8 mmt85 -55.01 -18.97 5.84 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.461 1.101 . . . . 74.24 110.344 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -75.57 -73.12 0.27 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.504 1.128 . . . . 72.33 109.253 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.51 ' CG2' ' N ' ' A' ' 148' ' ' TRP . 1.2 t -65.79 -52.02 54.25 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.502 1.126 . . . . 72.12 110.317 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.51 ' N ' ' CG2' ' A' ' 147' ' ' THR . 22.7 t-105 -43.5 -50.99 6.95 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.578 1.174 . . . . 74.22 107.971 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . 0.404 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 4.6 t -47.31 -45.86 24.74 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.482 1.114 . . . . 75.15 108.329 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.455 ' N ' ' O ' ' A' ' 147' ' ' THR . 23.3 m120 -64.36 -56.66 12.86 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.458 1.099 . . . . 72.1 109.316 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.537 ' CZ ' ' CD2' ' A' ' 157' ' ' LEU . 8.6 m-30 -42.93 -38.05 2.08 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.492 1.12 . . . . 73.53 111.005 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -61.29 -45.02 96.2 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.54 1.15 . . . . 73.15 110.261 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.433 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 1.7 t80 -56.6 -25.68 53.49 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.518 1.136 . . . . 74.11 110.986 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.502 ' CD1' ' O ' ' A' ' 154' ' ' TYR . 20.3 p90 -163.61 125.43 2.43 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.45 1.094 . . . . 75.53 110.982 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' THR . . . . . 0.4 ' O ' ' OD1' ' A' ' 159' ' ' ASN . 6.3 t -70.39 -6.07 32.88 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.505 1.128 . . . . 74.44 110.47 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' SER . . . . . 0.402 ' HA ' ' ND2' ' A' ' 159' ' ' ASN . 1.6 m -39.51 -63.65 0.55 Allowed 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.493 1.121 . . . . 55.31 109.948 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.537 ' CD2' ' CZ ' ' A' ' 151' ' ' PHE . 2.9 tt -64.89 -40.28 94.84 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.514 1.133 . . . . 74.44 109.281 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' MET . . . . . 0.493 ' SD ' ' CZ3' ' A' ' 148' ' ' TRP . 3.4 tpt -58.76 -15.18 11.0 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.494 1.121 . . . . 73.42 111.027 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' ASN . . . . . 0.414 ' HB3' ' NE2' ' A' ' 164' ' ' GLN . 37.7 m-20 -81.59 -44.89 16.63 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.44 1.087 . . . . 72.15 109.339 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.63 -20.63 61.26 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.466 1.104 . . . . 70.02 110.069 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . 0.469 HG21 ' CE ' ' A' ' 158' ' ' MET . 4.4 t -64.21 -18.01 22.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.571 1.17 . . . . 75.2 109.34 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -86.48 10.23 15.85 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.467 1.104 . . . . 74.42 109.3 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.463 ' CZ ' HG22 ' A' ' 192' ' ' ILE . 0.7 OUTLIER 53.29 63.63 2.15 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.54 1.15 . . . . 75.54 110.32 179.97 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . 0.414 ' NE2' ' HB3' ' A' ' 159' ' ' ASN . 19.7 mt-30 -62.35 -174.49 0.06 Allowed 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.552 1.157 . . . . 75.55 110.222 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -99.77 38.26 1.48 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.52 1.138 . . . . 75.25 109.567 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -100.9 162.26 13.03 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.586 1.178 . . . . 72.33 109.284 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' TYR . . . . . 0.527 ' CD1' ' C ' ' A' ' 167' ' ' TYR . 3.2 p90 -66.89 -9.09 34.29 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 124.402 1.064 . . . . 71.31 111.014 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.438 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 0.1 OUTLIER -112.01 130.13 55.97 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.506 1.129 . . . . 75.35 109.32 -179.967 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' SER . . . . . 0.452 ' C ' ' CG1' ' A' ' 170' ' ' VAL . 1.2 m -128.53 172.93 10.7 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.511 1.132 . . . . 74.22 109.997 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.452 ' HA ' ' OG1' ' A' ' 135' ' ' THR . 0.9 OUTLIER -151.95 119.87 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.412 1.07 . . . . 73.13 109.284 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 11.5 mm -111.29 121.0 41.57 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 124.576 1.173 . . . . 72.11 109.308 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . 0.516 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.92 106.9 2.36 Favored 'Trans proline' 0 C--N 1.36 1.139 0 O-C-N 124.479 1.779 . . . . 61.04 110.997 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 173' ' ' MET . . . . . 0.408 ' SD ' ' CG2' ' A' ' 136' ' ' ILE . 4.0 ttt -94.22 153.5 18.03 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.481 1.113 . . . . 74.03 110.989 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 41.8 ttm-85 -114.39 126.28 28.17 Favored Pre-proline 0 C--N 1.326 -0.448 0 O-C-N 124.477 1.11 . . . . 75.23 110.345 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 157.49 42.74 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.443 1.76 . . . . 73.24 111.034 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . 0.476 ' CD2' ' HG3' ' A' ' 197' ' ' GLU . 0.2 OUTLIER -99.58 -50.85 3.93 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.459 1.099 . . . . 62.22 109.289 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -71.74 -22.13 61.66 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.465 1.103 . . . . 72.12 109.321 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 178' ' ' ASN . . . . . 0.449 ' ND2' ' OD1' ' A' ' 89' ' ' ASP . 0.4 OUTLIER -107.67 107.79 60.77 Favored Pre-proline 0 C--N 1.325 -0.484 0 O-C-N 124.474 1.109 . . . . 64.03 109.335 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.96 127.54 10.79 Favored 'Trans proline' 0 C--N 1.36 1.158 0 O-C-N 124.543 1.812 . . . . 64.14 111.047 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . 0.403 HD12 ' CB ' ' A' ' 184' ' ' ARG . 0.4 OUTLIER -141.27 96.66 7.05 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.524 1.14 . . . . 73.24 109.274 179.976 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.02 168.96 23.66 Favored 'Trans proline' 0 C--N 1.36 1.166 0 O-C-N 124.495 1.787 . . . . 74.42 111.021 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . 0.424 ' CB ' ' OE1' ' A' ' 190' ' ' GLN . 0.2 OUTLIER -58.45 -28.42 65.28 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.511 1.132 . . . . 73.45 110.327 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -62.85 -12.74 26.79 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.425 1.078 . . . . 72.45 110.339 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 184' ' ' ARG . . . . . 0.403 ' CB ' HD12 ' A' ' 180' ' ' LEU . 39.4 mmt180 -112.87 -28.26 7.81 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.467 1.104 . . . . 75.24 110.255 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 185' ' ' THR . . . . . . . . . . . . . 31.3 m -80.0 144.13 58.64 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.417 1.073 . . . . 73.13 110.342 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.98 147.45 34.01 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.59 1.837 . . . . 74.43 110.995 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 187' ' ' PHE . . . . . 0.47 ' O ' ' CG2' ' A' ' 191' ' ' THR . 4.4 p90 -63.21 -11.34 20.28 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.489 1.118 . . . . 74.0 111.039 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -87.96 -54.12 4.39 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.545 1.153 . . . . 73.1 109.298 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.468 HD23 ' CG2' ' A' ' 161' ' ' VAL . 24.8 mt -72.61 -19.41 61.47 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.525 1.141 . . . . 74.32 109.333 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 190' ' ' GLN . . . . . 0.484 ' CG ' ' O ' ' A' ' 190' ' ' GLN . 7.4 tt0 -86.54 -0.52 56.28 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.596 1.185 . . . . 71.14 110.295 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 191' ' ' THR . . . . . 0.47 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 69.1 p -130.21 18.59 5.43 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.453 1.095 . . . . 75.0 110.39 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.463 HG22 ' CZ ' ' A' ' 163' ' ' ARG . 3.1 mt -127.79 154.63 38.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.483 1.114 . . . . 73.1 109.269 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -51.52 92.38 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.433 1.083 . . . . 71.32 109.266 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . 0.516 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -90.79 143.54 26.62 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.546 1.153 . . . . 72.13 109.343 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 195' ' ' LEU . . . . . 0.401 ' N ' ' O ' ' A' ' 172' ' ' PRO . 0.2 OUTLIER -76.56 150.0 36.57 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 72.24 109.331 -179.971 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -143.42 132.98 23.58 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.499 1.124 . . . . 72.15 110.271 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . 0.476 ' HG3' ' CD2' ' A' ' 176' ' ' LEU . 0.6 OUTLIER -113.86 -16.81 12.17 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 124.487 1.117 . . . . 62.3 110.248 -179.998 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . 0.468 ' HB3' ' CD2' ' A' ' 176' ' ' LEU . 0.3 OUTLIER -95.71 5.07 52.3 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.436 1.085 . . . . 73.1 110.266 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.92 172.91 6.93 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.523 1.139 . . . . 72.11 110.034 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -85.4 -18.39 33.82 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.468 1.105 . . . . 72.25 110.279 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -104.42 24.05 29.94 Favored Glycine 0 CA--C 1.53 1.024 0 O-C-N 124.464 1.102 . . . . 71.24 111.088 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 202' ' ' PHE . . . . . 0.623 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 0.2 OUTLIER -59.2 -43.01 96.26 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.521 0.777 . . . . 75.11 110.987 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 203' ' ' PRO . . . . . 0.623 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.2 Cg_endo -75.04 -35.55 3.04 Favored 'Trans proline' 0 C--N 1.36 1.158 0 O-C-N 124.566 1.824 . . . . 75.31 111.018 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.92 -57.03 12.48 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.527 1.142 . . . . 71.44 110.433 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 205' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' A' ' 209' ' ' ILE . 3.0 mt-30 -61.92 -48.73 79.15 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.543 1.152 . . . . 73.31 110.357 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 206' ' ' VAL . . . . . 0.51 ' CG2' ' O ' ' A' ' 202' ' ' PHE . 92.7 t -57.25 -29.97 33.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 124.473 1.108 . . . . 73.12 109.284 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -79.42 -41.12 28.37 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.457 1.098 . . . . 74.44 110.266 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -75.45 -68.09 0.6 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.514 1.134 . . . . 73.22 110.311 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 209' ' ' ILE . . . . . 0.557 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 98.0 mt -40.42 -48.03 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.447 1.092 . . . . 74.11 109.261 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 210' ' ' PHE . . . . . 0.557 ' CE1' ' CG2' ' A' ' 209' ' ' ILE . 1.9 m-85 -105.71 75.7 1.15 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.492 1.12 . . . . 72.23 110.981 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 211' ' ' GLN . . . . . 0.489 ' CG ' ' HB ' ' A' ' 214' ' ' VAL . 10.3 pt20 -111.32 141.7 44.52 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.512 1.132 . . . . 70.23 110.277 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.579 ' HA ' ' CD2' ' A' ' 215' ' ' TYR . 16.1 tt0 -53.08 -48.38 67.79 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.448 1.093 . . . . 74.33 110.265 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.4 t -52.58 -18.61 1.82 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.421 1.076 . . . . 73.24 109.969 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.489 ' HB ' ' CG ' ' A' ' 211' ' ' GLN . 2.3 t -97.66 -44.52 12.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 124.534 1.146 . . . . 74.44 109.276 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 215' ' ' TYR . . . . . 0.579 ' CD2' ' HA ' ' A' ' 212' ' ' GLU . 9.5 m-30 -37.39 -32.36 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.452 1.095 . . . . 75.3 110.964 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . 0.513 ' N ' ' CD ' ' A' ' 216' ' ' LYS . 5.6 mmtt -68.51 -54.59 15.87 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.482 1.113 . . . . 73.45 109.324 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 217' ' ' THR . . . . . 0.446 ' N ' ' O ' ' A' ' 214' ' ' VAL . 1.5 m -40.24 -66.41 0.31 Allowed 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.559 1.162 . . . . 70.21 110.46 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -46.76 -59.94 2.72 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.492 1.12 . . . . 74.2 110.272 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 219' ' ' GLN . . . . . 0.471 ' O ' ' N ' ' A' ' 223' ' ' LYS . 28.9 tp60 -41.34 -61.12 1.09 Allowed 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.556 1.16 . . . . 74.44 110.357 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.1 m -46.22 -45.94 17.32 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.528 1.142 . . . . 75.5 110.369 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 221' ' ' ILE . . . . . 0.414 HG23 ' N ' ' A' ' 167' ' ' TYR . 6.5 mt -66.95 -29.59 46.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.46 1.1 . . . . 74.54 109.334 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 222' ' ' TRP . . . . . 0.484 ' CH2' ' OE2' ' A' ' 76' ' ' GLU . 14.3 t90 -81.63 -19.44 41.78 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.574 1.171 . . . . 74.34 108.07 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . 0.471 ' N ' ' O ' ' A' ' 219' ' ' GLN . 0.0 OUTLIER -91.86 -20.06 21.85 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.486 1.116 . . . . 63.33 109.386 179.93 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -89.49 -38.98 13.64 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.526 1.141 . . . . 72.23 110.276 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 7.3 t -55.1 -29.77 58.32 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.53 1.144 . . . . 72.41 110.427 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -72.37 -25.82 61.66 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.465 1.103 . . . . 65.41 110.25 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 227' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.27 -12.8 59.95 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.468 1.105 . . . . 75.12 109.289 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 45.3 mtm -84.62 -40.33 17.6 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.531 1.144 . . . . 73.34 110.997 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 229' ' ' VAL . . . . . 0.412 ' CG2' ' N ' ' A' ' 230' ' ' GLN . 1.3 m -62.69 -44.07 99.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.554 1.159 . . . . 75.42 109.305 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 230' ' ' GLN . . . . . 0.412 ' N ' ' CG2' ' A' ' 229' ' ' VAL . 0.4 OUTLIER -75.69 -37.13 59.77 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.449 1.093 . . . . 73.23 110.299 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 7.3 ttt85 -45.37 -80.34 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.512 1.132 . . . . 74.24 110.276 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -155.23 36.91 0.39 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.49 1.118 . . . . 75.15 110.25 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 233' ' ' PHE . . . . . 0.401 ' O ' ' O ' ' A' ' 229' ' ' VAL . 0.1 OUTLIER -133.01 -174.88 3.6 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.485 1.115 . . . . 74.43 110.934 -179.973 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . 0.451 HG22 ' N ' ' A' ' 235' ' ' ALA . 9.1 mm -102.4 159.84 4.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 O-C-N 124.574 1.171 . . . . 63.12 109.279 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 235' ' ' ALA . . . . . 0.451 ' N ' HG22 ' A' ' 234' ' ' ILE . . . . . . . . 0 C--N 1.326 -0.455 0 O-C-N 124.423 1.077 . . . . 71.25 109.367 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.012 0 N-CA-C 110.993 -0.843 . . . . 70.34 110.993 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.04 -169.85 0.7 Allowed 'Trans proline' 0 C--N 1.36 1.151 0 O-C-N 124.521 1.801 . . . . 74.14 110.997 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -113.54 -65.48 1.18 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.506 1.129 . . . . 62.41 109.265 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -128.18 90.73 0.33 Allowed Glycine 0 CA--C 1.53 1.017 0 O-C-N 124.547 1.155 . . . . 61.23 110.966 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.9 p -114.07 141.74 47.08 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.437 0.728 . . . . 71.03 110.001 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.41 ' HG3' ' N ' ' A' ' 76' ' ' GLU . 19.0 tp10 -44.74 153.88 0.15 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.505 1.128 . . . . 74.11 110.249 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.41 ' N ' ' HG3' ' A' ' 75' ' ' GLU . 1.1 tt0 -118.15 128.13 54.43 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.48 1.113 . . . . 75.04 110.304 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.468 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 6.3 p -133.95 158.96 42.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 O-C-N 124.445 1.09 . . . . 74.11 109.32 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.558 ' CG ' ' O ' ' A' ' 78' ' ' PHE . 28.7 t80 -86.63 22.02 2.02 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.492 1.12 . . . . 73.43 110.937 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.406 ' C ' ' O ' ' A' ' 78' ' ' PHE . 6.6 tp -39.91 151.55 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.519 1.137 . . . . 74.24 109.198 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -91.04 -60.65 1.85 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.535 1.147 . . . . 75.01 109.307 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.596 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -161.44 136.46 7.42 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.424 1.078 . . . . 70.31 110.974 179.966 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.444 ' CG2' ' N ' ' A' ' 83' ' ' ILE . 4.0 p -89.36 167.71 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 O-C-N 124.515 1.135 . . . . 72.41 109.35 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.45 ' CG2' ' HB ' ' A' ' 136' ' ' ILE . 5.2 mp -131.35 96.76 2.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.466 1.104 . . . . 75.12 109.308 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.438 ' HG ' ' CB ' ' A' ' 128' ' ' ALA . 3.1 mt -72.92 118.9 16.43 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.505 1.128 . . . . 73.41 109.296 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.573 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -141.18 174.46 10.51 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.425 1.078 . . . . 75.35 109.529 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -105.14 156.46 18.07 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.493 1.12 . . . . 71.51 109.254 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.71 -14.54 21.62 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.517 1.135 . . . . 75.53 110.317 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -84.52 -46.3 11.74 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.499 1.124 . . . . 75.45 109.316 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.41 ' N ' ' OD2' ' A' ' 89' ' ' ASP . 0.5 OUTLIER -112.1 43.72 1.54 Allowed 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.519 1.137 . . . . 74.22 109.311 179.976 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.573 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -80.09 -22.25 42.41 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.55 1.156 . . . . 72.13 110.418 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -83.36 -27.21 29.83 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.425 1.078 . . . . 72.4 109.241 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -70.78 -55.56 8.3 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.529 1.143 . . . . 74.22 110.363 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.461 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -58.79 -34.74 71.82 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.483 1.114 . . . . 75.41 109.261 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -41.6 62.69 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.532 1.145 . . . . 73.45 109.315 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -51.03 -31.17 17.54 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.479 1.112 . . . . 75.31 110.314 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.458 ' O ' ' N ' ' A' ' 99' ' ' LEU . 2.0 t -82.88 -63.69 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.437 1.085 . . . . 70.33 109.221 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.443 ' N ' HG12 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -41.49 -26.27 0.06 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.473 1.108 . . . . 73.4 110.34 -180.0 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.447 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.5 t-20 -71.68 -49.69 37.4 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.496 1.123 . . . . 71.23 109.347 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.479 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -73.79 -22.88 59.67 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.463 1.102 . . . . 73.22 109.267 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.476 ' CD2' HG23 ' A' ' 206' ' ' VAL . 37.2 mt -63.27 -55.26 26.25 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.528 1.143 . . . . 75.52 109.291 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.67 59.35 1.16 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.459 1.099 . . . . 74.22 110.224 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.4 t70 175.87 -65.99 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.552 1.158 . . . . 74.31 109.254 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -42.77 -55.07 3.8 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.434 1.084 . . . . 63.05 109.25 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.571 ' CE2' HG23 ' A' ' 206' ' ' VAL . 1.9 m-85 -111.92 -20.22 12.09 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.488 1.118 . . . . 74.03 110.976 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.54 45.92 3.6 Favored Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.512 1.133 . . . . 64.23 110.997 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 7.2 mm -88.0 90.45 3.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.517 0.775 . . . . 74.15 109.279 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.48 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -137.7 158.24 72.06 Favored Pre-proline 0 C--N 1.324 -0.507 0 O-C-N 124.496 1.122 . . . . 74.35 109.29 -179.969 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.48 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -74.96 150.3 95.24 Favored 'Cis proline' 0 C--N 1.36 1.14 0 C-N-CA 121.0 -2.5 . . . . 71.41 110.983 -0.046 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -119.69 132.38 9.44 Favored Glycine 0 CA--C 1.531 1.061 0 O-C-N 124.491 1.12 . . . . 74.52 110.885 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.482 ' CD1' ' HA ' ' A' ' 115' ' ' MET . 0.4 OUTLIER -151.41 144.09 16.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.581 0.812 . . . . 72.34 109.255 179.95 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 38.6 pt -97.17 177.02 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 O-C-N 124.528 1.143 . . . . 75.32 109.273 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.459 ' CD1' ' SD ' ' A' ' 115' ' ' MET . 1.8 t80 -76.13 -18.7 59.03 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.555 1.159 . . . . 75.31 110.975 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -95.97 -2.32 47.26 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.556 1.16 . . . . 63.21 109.303 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -111.35 -26.56 9.06 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.458 1.099 . . . . 75.11 110.234 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.482 ' HA ' ' CD1' ' A' ' 110' ' ' ILE . 1.2 ptp -70.88 134.89 85.6 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.532 1.145 . . . . 75.13 110.977 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.96 87.17 1.34 Allowed 'Trans proline' 0 C--N 1.36 1.149 0 O-C-N 124.498 1.788 . . . . 72.15 111.034 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -174.28 121.74 0.28 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.532 1.145 . . . . 75.23 109.566 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 164.68 145.0 4.24 Favored Glycine 0 CA--C 1.53 1.025 0 O-C-N 124.478 1.112 . . . . 71.22 111.036 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 77.3 mtt180 -155.65 -176.81 6.14 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.487 0.757 . . . . 75.42 110.298 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -42.04 -31.67 0.38 Allowed 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.525 1.141 . . . . 64.13 110.331 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . 0.423 ' NE2' ' O ' ' A' ' 122' ' ' LEU . 0.7 OUTLIER -153.31 135.74 15.05 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.502 1.127 . . . . 73.35 109.659 179.978 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.423 ' O ' ' NE2' ' A' ' 121' ' ' HIS . 0.4 OUTLIER -68.44 136.27 53.0 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.495 1.122 . . . . 74.41 109.256 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -73.12 -44.56 60.1 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.486 1.116 . . . . 73.04 110.291 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -176.47 130.03 0.21 Allowed 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.449 1.093 . . . . 65.13 109.31 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.414 ' C ' ' N ' ' A' ' 127' ' ' ASP . 0.9 OUTLIER -58.4 -17.63 21.86 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.531 1.144 . . . . 70.14 109.363 179.993 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.404 ' O ' ' N ' ' A' ' 129' ' ' VAL . 0.7 OUTLIER -41.23 -30.01 0.15 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.502 1.126 . . . . 74.41 109.345 179.928 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.414 ' N ' ' C ' ' A' ' 125' ' ' LEU . 3.8 t0 -44.35 -51.66 8.32 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.484 1.115 . . . . 55.11 109.266 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.438 ' CB ' ' HG ' ' A' ' 84' ' ' LEU . . . -66.12 -34.42 78.01 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.514 1.134 . . . . 75.03 109.288 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.504 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 70.2 t -92.99 30.64 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.501 1.126 . . . . 71.3 109.382 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -131.75 130.47 41.93 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.479 1.112 . . . . 73.1 109.36 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 48.5 72.62 0.43 Allowed Glycine 0 CA--C 1.531 1.063 0 O-C-N 124.488 1.118 . . . . 73.25 110.985 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.3 m -160.71 167.82 26.11 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.578 0.811 . . . . 74.53 110.047 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.654 ' CB ' ' CZ3' ' A' ' 134' ' ' TRP . . . -100.07 -33.89 10.29 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.428 1.08 . . . . 74.34 109.317 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.654 ' CZ3' ' CB ' ' A' ' 133' ' ' ALA . 1.0 OUTLIER -161.87 151.74 16.66 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.608 1.192 . . . . 75.25 107.965 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 47.2 p -120.22 145.37 47.08 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.466 1.104 . . . . 74.13 110.419 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.45 ' HB ' ' CG2' ' A' ' 83' ' ' ILE . 20.6 mm -99.25 131.01 47.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.495 1.122 . . . . 62.54 109.351 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.42 ' N ' HD23 ' A' ' 137' ' ' LEU . 0.4 OUTLIER -124.74 99.65 6.26 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.493 1.121 . . . . 73.11 109.328 -179.973 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.464 ' O ' ' CD1' ' A' ' 143' ' ' PHE . 0.1 OUTLIER -62.22 90.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.425 1.078 . . . . 74.32 109.243 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.34 103.01 0.2 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.527 1.142 . . . . 73.31 109.312 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 6.7 m -130.49 179.95 5.63 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.426 1.079 . . . . 53.24 110.427 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -75.54 -39.55 58.11 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.466 1.104 . . . . 75.23 110.313 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -89.46 -50.85 5.86 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.556 1.16 . . . . 74.15 109.352 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.464 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 52.9 t80 -50.26 -21.24 1.29 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 74.21 110.94 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.499 ' O ' ' CB ' ' A' ' 148' ' ' TRP . 1.8 tm? -64.45 -67.84 0.4 Allowed 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.53 1.143 . . . . 71.14 109.253 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.445 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 0.0 OUTLIER -60.18 -15.29 22.81 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.521 1.138 . . . . 74.41 110.247 -179.957 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -67.5 -64.57 0.83 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.467 1.104 . . . . 72.1 109.277 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.445 ' CG2' ' N ' ' A' ' 148' ' ' TRP . 1.0 OUTLIER -85.43 -48.18 9.25 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.502 1.126 . . . . 73.1 110.41 179.961 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.499 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 26.0 t-105 -42.51 -48.34 5.26 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.577 1.173 . . . . 71.14 108.022 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . 0.445 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 27.0 t -65.14 -44.98 86.87 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.495 1.122 . . . . 53.41 108.242 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.439 ' N ' ' O ' ' A' ' 147' ' ' THR . 0.3 OUTLIER -48.13 -41.28 26.12 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.589 1.18 . . . . 75.33 109.331 -179.978 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.545 ' CE1' HD11 ' A' ' 157' ' ' LEU . 14.4 m-30 -66.99 -35.85 80.86 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.482 1.114 . . . . 73.43 111.01 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -49.25 -46.44 46.13 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.486 1.116 . . . . 61.33 110.332 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -85.33 -15.19 44.09 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.532 1.145 . . . . 61.31 111.04 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -132.9 85.66 2.24 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.501 1.125 . . . . 74.31 111.036 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.58 -14.25 40.47 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 124.526 1.141 . . . . 75.24 110.402 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 23.2 m -53.68 -22.89 9.84 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.471 1.107 . . . . 61.1 109.978 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.545 HD11 ' CE1' ' A' ' 151' ' ' PHE . 0.6 OUTLIER -82.89 -45.89 13.66 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.467 1.105 . . . . 74.5 109.251 -179.95 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' MET . . . . . 0.467 ' HA ' ' CE ' ' A' ' 158' ' ' MET . 26.6 mmt -42.34 -32.74 0.55 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.507 1.129 . . . . 71.51 111.026 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -65.27 -49.77 68.29 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.524 1.14 . . . . 74.3 109.313 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.467 ' CB ' HG22 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -68.66 -29.04 67.43 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.527 1.142 . . . . 62.01 109.994 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . 0.476 ' O ' ' CD1' ' A' ' 192' ' ' ILE . 6.2 t -55.06 -19.49 4.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.543 1.152 . . . . 73.41 109.344 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . 0.468 ' O ' ' N ' ' A' ' 164' ' ' GLN . 6.6 t-20 -91.05 20.84 4.62 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.539 1.149 . . . . 74.45 109.321 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.43 ' C ' ' O ' ' A' ' 162' ' ' ASN . 0.5 OUTLIER 35.6 33.55 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.514 1.133 . . . . 75.53 110.297 -179.956 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . 0.468 ' N ' ' O ' ' A' ' 162' ' ' ASN . 2.6 mt-30 -48.22 176.74 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.49 1.118 . . . . 70.25 110.291 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.41 ' CD2' ' H ' ' A' ' 165' ' ' HIS . 2.9 p80 -93.42 71.96 4.41 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.425 1.078 . . . . 72.32 109.586 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . 0.553 ' HG3' ' CD2' ' A' ' 167' ' ' TYR . 2.2 tppt? -123.13 157.12 33.61 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.551 1.157 . . . . 72.44 109.306 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' TYR . . . . . 0.62 ' CD1' ' N ' ' A' ' 168' ' ' ASN . 45.0 p90 -38.75 -45.94 1.19 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.501 1.126 . . . . 74.42 110.99 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.62 ' N ' ' CD1' ' A' ' 167' ' ' TYR . 1.7 p-10 -99.34 129.92 45.59 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.482 1.114 . . . . 75.32 109.237 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 14.0 m -110.73 158.35 18.75 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.457 1.098 . . . . 61.44 109.968 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.467 HG22 ' CB ' ' A' ' 160' ' ' SER . 42.9 t -116.56 111.35 34.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.481 1.113 . . . . 74.24 109.323 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . 0.401 ' CG1' ' HB3' ' A' ' 134' ' ' TRP . 21.9 mm -122.86 93.75 48.06 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.514 1.134 . . . . 75.13 109.325 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . 0.504 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 17.9 Cg_endo -75.01 107.65 2.53 Favored 'Trans proline' 0 C--N 1.36 1.142 0 O-C-N 124.566 1.824 . . . . 74.14 110.976 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 173' ' ' MET . . . . . 0.455 ' HE2' ' CG2' ' A' ' 96' ' ' VAL . 4.1 ttt -83.65 152.8 24.59 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.475 1.109 . . . . 65.54 110.996 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 25.5 mmm-85 -110.88 118.21 48.77 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.453 1.096 . . . . 71.34 110.32 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 154.96 42.86 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.508 1.794 . . . . 74.14 111.012 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . 0.561 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -95.58 -38.09 10.56 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 124.53 1.144 . . . . 70.43 109.372 179.951 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . 0.44 HD21 ' N ' ' A' ' 177' ' ' ASN . 1.4 m-80 -72.8 -22.38 60.83 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.461 1.101 . . . . 75.11 109.35 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -110.42 108.35 58.44 Favored Pre-proline 0 C--N 1.326 -0.441 0 O-C-N 124.44 1.087 . . . . 61.33 109.275 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.96 124.06 8.37 Favored 'Trans proline' 0 C--N 1.36 1.149 0 O-C-N 124.5 1.789 . . . . 74.34 110.987 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -139.94 96.98 8.09 Favored Pre-proline 0 C--N 1.324 -0.525 0 O-C-N 124.49 1.119 . . . . 74.12 109.354 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.02 155.43 42.82 Favored 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.474 1.776 . . . . 75.34 111.012 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.2 -28.3 39.9 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 124.541 1.151 . . . . 74.41 110.232 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -53.55 -29.33 36.5 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.496 1.122 . . . . 74.32 110.346 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 27.4 mmt180 -99.42 -16.72 18.28 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.492 1.12 . . . . 74.34 110.282 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 185' ' ' THR . . . . . 0.409 ' HA ' ' HD3' ' A' ' 186' ' ' PRO . 20.8 m -80.08 144.02 58.12 Favored Pre-proline 0 C--N 1.325 -0.458 0 O-C-N 124.534 1.146 . . . . 74.13 110.382 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 185' ' ' THR . 18.3 Cg_endo -74.96 155.58 43.12 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.466 1.771 . . . . 75.44 110.974 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 187' ' ' PHE . . . . . 0.509 ' O ' ' CG2' ' A' ' 191' ' ' THR . 7.7 p90 -69.44 -7.09 34.71 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.462 1.101 . . . . 75.1 110.972 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -94.08 -52.88 4.19 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.484 1.115 . . . . 75.24 109.314 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 48.3 mt -68.48 -42.28 78.93 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.494 1.121 . . . . 74.33 109.365 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -64.04 -10.46 22.15 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 124.45 1.094 . . . . 72.33 110.306 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 191' ' ' THR . . . . . 0.509 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 33.5 p -113.4 17.74 18.24 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 124.525 1.141 . . . . 72.3 110.396 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.476 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 4.8 mt -117.57 157.87 18.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.54 1.15 . . . . 62.32 109.334 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 193' ' ' ASN . . . . . 0.407 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 28.7 t30 -78.58 70.33 4.91 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.551 1.157 . . . . 72.1 109.305 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . 0.504 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -61.76 178.21 0.35 Allowed 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.494 1.121 . . . . 72.3 109.267 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 195' ' ' LEU . . . . . 0.414 HD22 ' N ' ' A' ' 206' ' ' VAL . 0.8 OUTLIER -105.88 122.99 47.25 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.465 1.103 . . . . 74.3 109.314 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -102.27 141.82 34.5 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.423 1.077 . . . . 74.23 110.332 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -111.67 -22.27 11.27 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.488 1.118 . . . . 73.11 110.292 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . 0.416 ' N ' HD12 ' A' ' 176' ' ' LEU . 2.4 pp20? -106.2 11.24 31.45 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.548 1.155 . . . . 74.44 110.268 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 32.8 t -94.68 171.5 8.75 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.523 1.139 . . . . 74.11 110.028 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -77.74 -42.16 35.2 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.511 1.132 . . . . 74.52 110.34 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -90.33 16.74 56.81 Favored Glycine 0 CA--C 1.53 1.009 0 O-C-N 124.442 1.089 . . . . 63.34 111.018 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 202' ' ' PHE . . . . . 0.619 ' CD1' ' C ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -48.75 -47.58 71.89 Favored Pre-proline 0 C--N 1.326 -0.454 0 O-C-N 124.532 0.784 . . . . 65.22 111.013 -179.991 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 203' ' ' PRO . . . . . 0.568 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.0 Cg_endo -75.04 -28.11 9.38 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.533 1.807 . . . . 74.23 110.969 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.88 -48.01 80.85 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.412 1.07 . . . . 74.23 110.439 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 205' ' ' GLN . . . . . 0.444 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 9.3 mt-30 -60.89 -61.91 2.24 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.477 1.111 . . . . 74.21 110.299 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 206' ' ' VAL . . . . . 0.574 ' HA ' ' CE2' ' A' ' 210' ' ' PHE . 2.7 p -39.58 -34.05 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 124.547 1.154 . . . . 74.45 109.298 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 207' ' ' GLU . . . . . 0.404 ' N ' ' C ' ' A' ' 205' ' ' GLN . 3.2 mm-40 -75.06 -65.06 0.92 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.486 1.116 . . . . 75.14 110.265 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -49.62 -59.58 3.65 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.567 1.167 . . . . 75.22 110.337 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 209' ' ' ILE . . . . . 0.563 HG23 ' CD1' ' A' ' 210' ' ' PHE . 64.5 mt -50.04 -68.82 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.436 1.085 . . . . 73.44 109.335 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 210' ' ' PHE . . . . . 0.574 ' CE2' ' HA ' ' A' ' 206' ' ' VAL . 0.4 OUTLIER -89.42 66.92 7.57 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.491 1.12 . . . . 73.25 110.999 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 211' ' ' GLN . . . . . 0.406 ' HG3' ' N ' ' A' ' 213' ' ' SER . 0.2 OUTLIER -110.48 148.19 32.58 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.539 1.149 . . . . 61.21 110.261 -179.992 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.425 ' O ' ' HB3' ' A' ' 215' ' ' TYR . 5.8 tt0 -53.75 -52.38 60.38 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.566 1.166 . . . . 72.42 110.285 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 213' ' ' SER . . . . . 0.406 ' N ' ' HG3' ' A' ' 211' ' ' GLN . 0.6 OUTLIER -50.42 -21.3 1.39 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.449 1.093 . . . . 74.43 109.97 -179.993 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 21.7 t -95.21 -37.5 7.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.533 1.145 . . . . 74.43 109.339 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 215' ' ' TYR . . . . . 0.425 ' HB3' ' O ' ' A' ' 212' ' ' GLU . 5.1 t80 -51.7 -47.55 63.87 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.43 1.081 . . . . 74.33 110.967 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 2.8 mtmt -43.17 -55.28 4.01 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.467 1.104 . . . . 65.23 109.259 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 217' ' ' THR . . . . . 0.469 ' CG2' ' CD1' ' A' ' 221' ' ' ILE . 33.9 m -56.11 -66.43 0.43 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.435 1.085 . . . . 73.15 110.392 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 41.5 mm-40 -47.99 -23.53 0.82 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.438 1.086 . . . . 74.44 110.278 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 219' ' ' GLN . . . . . 0.443 ' O ' ' NE2' ' A' ' 219' ' ' GLN . 19.9 tp60 -82.36 -37.76 25.19 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.51 1.131 . . . . 73.2 110.312 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 220' ' ' THR . . . . . 0.414 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 1.2 m -78.57 -21.42 48.67 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.493 1.121 . . . . 65.23 110.343 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 221' ' ' ILE . . . . . 0.469 ' CD1' ' CG2' ' A' ' 217' ' ' THR . 12.7 mt -83.81 -37.17 12.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.477 1.111 . . . . 75.15 109.346 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 222' ' ' TRP . . . . . 0.468 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 27.3 t90 -66.84 -44.44 81.06 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.548 1.155 . . . . 71.24 107.963 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . 0.414 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -68.13 -23.01 64.84 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.516 1.135 . . . . 63.1 109.283 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -87.94 -28.86 21.22 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.399 1.062 . . . . 73.22 110.359 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 225' ' ' THR . . . . . 0.419 ' CG2' ' O ' ' A' ' 222' ' ' TRP . 5.0 t -62.53 -20.13 64.33 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.592 1.182 . . . . 74.45 110.429 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 1.3 mtm180 -79.77 -16.14 56.12 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.507 1.13 . . . . 70.31 110.281 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 227' ' ' ASN . . . . . 0.453 ' O ' ' N ' ' A' ' 231' ' ' ARG . 0.9 OUTLIER -86.34 -56.93 3.21 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.421 1.076 . . . . 75.43 109.325 179.956 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 21.9 ptp -48.87 -40.65 30.48 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.52 1.138 . . . . 74.11 111.033 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 229' ' ' VAL . . . . . . . . . . . . . 7.7 p -66.17 -47.8 83.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 124.455 1.097 . . . . 74.23 109.343 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 230' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -81.79 6.34 15.86 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.541 1.151 . . . . 63.23 110.314 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 231' ' ' ARG . . . . . 0.453 ' N ' ' O ' ' A' ' 227' ' ' ASN . 0.0 OUTLIER -103.92 -67.26 0.9 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.439 1.087 . . . . 64.02 110.322 179.985 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -156.49 44.85 0.41 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.479 1.112 . . . . 73.15 110.324 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -158.8 47.04 0.32 Allowed 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.536 1.147 . . . . 75.41 111.031 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . 0.485 ' CG2' ' N ' ' A' ' 235' ' ' ALA . 1.6 mp -61.73 162.93 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.535 1.147 . . . . 72.4 109.253 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 235' ' ' ALA . . . . . 0.485 ' N ' ' CG2' ' A' ' 234' ' ' ILE . . . . . . . . 0 C--N 1.326 -0.447 0 O-C-N 124.552 1.157 . . . . 71.23 109.234 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.428 ' N ' ' OD1' ' A' ' 126' ' ' ASP . . . . . . . . 0 CA--C 1.529 0.961 0 N-CA-C 111.004 -0.838 . . . . 74.42 111.004 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.95 141.04 26.3 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.459 1.768 . . . . 64.34 110.999 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.456 HD12 ' CB ' ' A' ' 235' ' ' ALA . 0.2 OUTLIER -113.64 -44.02 3.24 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.592 1.183 . . . . 73.11 109.275 -179.986 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -85.34 70.53 3.07 Favored Glycine 0 CA--C 1.53 0.998 0 O-C-N 124.49 1.119 . . . . 54.02 111.01 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.456 ' OG ' ' N ' ' A' ' 75' ' ' GLU . 0.9 OUTLIER -128.47 175.9 8.16 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.526 0.78 . . . . 62.42 110.039 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.456 ' N ' ' OG ' ' A' ' 74' ' ' SER . 10.5 tt0 -38.44 150.28 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.478 1.111 . . . . 74.32 110.335 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -115.98 151.15 36.0 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.566 1.166 . . . . 74.53 110.305 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.591 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 9.0 p -162.73 157.75 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.517 1.136 . . . . 74.31 109.333 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.477 ' CE2' ' OH ' ' A' ' 215' ' ' TYR . 3.3 t80 -87.48 20.73 2.76 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.463 1.102 . . . . 75.23 111.038 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.407 ' C ' ' O ' ' A' ' 78' ' ' PHE . 6.3 tp -39.31 156.84 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.416 1.072 . . . . 74.41 109.286 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.573 ' NZ ' ' CG2' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -104.47 -57.28 2.05 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.516 1.135 . . . . 64.34 109.293 -179.973 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.617 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.1 OUTLIER -161.92 150.7 15.45 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.559 1.162 . . . . 74.42 110.945 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.443 HG21 ' CE ' ' A' ' 115' ' ' MET . 3.9 p -103.13 159.48 4.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.484 1.115 . . . . 75.33 109.331 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.494 HD12 ' CE1' ' A' ' 81' ' ' PHE . 4.2 mp -122.36 88.29 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.439 1.087 . . . . 74.45 109.336 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.517 ' HG ' ' CD1' ' A' ' 112' ' ' PHE . 5.1 mp -70.01 114.88 8.6 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.452 1.095 . . . . 71.2 109.245 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.572 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -131.52 174.79 9.74 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.466 1.104 . . . . 74.12 109.529 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -111.21 157.3 20.25 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.489 1.118 . . . . 75.33 109.322 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.17 -11.27 19.41 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.426 1.079 . . . . 64.54 110.225 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -84.25 -40.28 18.23 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.556 1.16 . . . . 64.43 109.288 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -127.25 41.0 3.6 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.409 1.068 . . . . 73.55 109.303 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.572 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -74.28 -53.61 9.37 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.578 1.174 . . . . 63.23 110.36 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.18 -17.85 21.68 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.476 1.11 . . . . 72.4 109.252 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -78.84 -55.84 4.85 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.521 1.138 . . . . 75.31 110.247 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.491 ' CB ' HD21 ' A' ' 138' ' ' LEU . . . -65.15 -20.24 66.36 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.597 1.185 . . . . 54.15 109.29 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.13 -52.9 5.38 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.482 1.114 . . . . 73.13 109.35 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -43.47 -36.2 1.91 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.445 1.091 . . . . 72.25 110.249 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.464 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 11.0 p -80.34 -55.84 7.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 124.526 1.141 . . . . 73.22 109.296 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.464 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -47.77 -23.43 0.72 Allowed 'General case' 0 C--N 1.323 -0.547 0 O-C-N 124.493 1.12 . . . . 75.21 110.323 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.24 -38.91 55.69 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.494 1.121 . . . . 74.23 109.359 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.46 ' N ' ' O ' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -80.66 -23.13 39.86 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.503 1.127 . . . . 74.45 109.261 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 32.5 mt -62.76 -44.38 96.36 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.475 1.11 . . . . 74.12 109.288 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . 0.481 ' CG ' ' O ' ' A' ' 101' ' ' GLN . 0.0 OUTLIER -85.76 55.44 3.52 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.521 1.138 . . . . 73.53 110.302 -179.985 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -178.18 -63.46 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.513 1.133 . . . . 44.53 109.273 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -43.79 -56.04 4.09 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.481 1.113 . . . . 65.43 109.378 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -109.43 -28.12 9.1 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.496 1.122 . . . . 73.11 110.998 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 101.02 39.52 3.08 Favored Glycine 0 CA--C 1.53 0.982 0 O-C-N 124.561 1.163 . . . . 63.22 111.023 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.573 ' CG2' ' NZ ' ' A' ' 80' ' ' LYS . 8.2 mm -83.37 90.05 2.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 O-C-N 124.5 0.765 . . . . 75.1 109.33 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.487 ' CB ' ' HA ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -142.72 161.82 47.3 Favored Pre-proline 0 C--N 1.325 -0.484 0 O-C-N 124.48 1.112 . . . . 72.32 109.332 179.98 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.487 ' HA ' ' CB ' ' A' ' 107' ' ' LYS . 18.6 Cg_endo -74.98 149.43 93.83 Favored 'Cis proline' 0 C--N 1.36 1.177 0 C-N-CA 120.983 -2.507 . . . . 71.44 111.043 -0.047 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -121.95 131.07 8.29 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.456 1.098 . . . . 75.13 111.039 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -142.76 148.01 20.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 O-C-N 124.513 0.772 . . . . 71.55 109.327 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.41 HD11 ' NE2' ' A' ' 85' ' ' HIS . 32.2 pt -102.09 -177.16 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.477 1.11 . . . . 74.43 109.259 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.517 ' CD1' ' HG ' ' A' ' 84' ' ' LEU . 2.6 t80 -81.81 -23.21 36.65 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.569 1.168 . . . . 74.42 110.973 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -86.71 -5.32 59.16 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.465 1.103 . . . . 53.33 109.329 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -109.44 -26.61 9.89 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.507 1.129 . . . . 74.21 110.273 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.443 ' CE ' HG21 ' A' ' 82' ' ' VAL . 13.0 ttm -41.84 110.69 0.81 Allowed Pre-proline 0 C--N 1.325 -0.482 0 O-C-N 124.456 1.098 . . . . 72.45 110.996 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.04 152.65 40.83 Favored 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.481 1.78 . . . . 75.42 110.985 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.458 ' CG ' ' HA ' ' A' ' 121' ' ' HIS . 7.6 m-70 -124.12 178.26 5.41 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.488 1.118 . . . . 74.34 109.586 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -109.06 -71.66 0.71 Allowed Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.548 1.155 . . . . 72.14 110.97 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 23.4 ttp85 -112.6 -36.65 5.15 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.524 0.779 . . . . 74.15 110.235 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -133.78 145.7 50.03 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.417 1.073 . . . . 73.43 110.328 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . 0.476 ' O ' ' CD2' ' A' ' 121' ' ' HIS . 0.3 OUTLIER -81.58 128.97 34.49 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.536 1.147 . . . . 74.24 109.597 -179.976 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.401 ' CD2' ' C ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -62.64 143.65 57.1 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.543 1.152 . . . . 74.12 109.241 -179.964 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.2 pp0? -129.83 11.45 5.64 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.479 1.112 . . . . 73.33 110.325 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -113.88 139.99 48.73 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.473 1.108 . . . . 63.31 109.335 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.511 HD13 ' CE2' ' A' ' 154' ' ' TYR . 4.0 pp -69.91 -17.52 63.34 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.456 1.097 . . . . 73.31 109.25 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.443 ' O ' ' N ' ' A' ' 129' ' ' VAL . 1.7 t70 -42.22 -65.27 0.48 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.582 1.176 . . . . 72.24 109.298 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -46.49 -40.66 12.81 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.398 1.061 . . . . 74.52 109.326 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.46 ' HB2' ' CD1' ' A' ' 84' ' ' LEU . . . -58.47 -38.96 78.66 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.501 1.126 . . . . 72.43 109.294 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.492 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 77.1 t -90.45 18.41 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.54 1.15 . . . . 75.04 109.35 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -127.55 152.11 48.03 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.535 1.147 . . . . 73.22 109.322 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 47.5 56.17 8.56 Favored Glycine 0 CA--C 1.529 0.954 0 O-C-N 124.522 1.139 . . . . 73.41 111.031 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.9 p -163.76 163.73 23.95 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.473 0.749 . . . . 75.34 109.979 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.56 ' O ' ' CD1' ' A' ' 134' ' ' TRP . . . -103.58 -23.78 13.46 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.451 1.094 . . . . 64.43 109.327 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.584 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 1.6 m-90 -161.79 157.5 24.27 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.026 -1.102 . . . . 74.11 108.026 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 33.8 p -131.15 127.02 37.17 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.464 1.103 . . . . 74.24 110.381 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.485 HG13 ' CG1' ' A' ' 83' ' ' ILE . 4.3 mm -84.32 141.53 14.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.51 1.132 . . . . 74.12 109.301 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 34.0 mt -134.97 110.66 9.24 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.457 1.098 . . . . 75.33 109.268 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.491 HD21 ' CB ' ' A' ' 93' ' ' ALA . 1.1 mm? -63.06 88.58 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.51 1.131 . . . . 61.22 109.27 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.43 100.64 0.11 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.538 1.149 . . . . 71.01 109.304 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.403 ' O ' ' CB ' ' A' ' 144' ' ' LEU . 11.0 m -129.68 -177.55 4.32 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 72.32 110.417 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -79.24 -35.95 40.71 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.485 1.116 . . . . 75.22 110.31 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 17.6 p30 -89.51 -34.49 16.37 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.503 1.127 . . . . 73.33 109.295 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.511 ' CE1' HG21 ' A' ' 147' ' ' THR . 6.6 t80 -71.63 -39.34 70.48 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.566 1.166 . . . . 73.42 111.048 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.53 ' CD1' ' N ' ' A' ' 145' ' ' ARG . 1.1 tm? -51.32 -67.47 0.25 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.47 1.106 . . . . 73.32 109.336 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.53 ' N ' ' CD1' ' A' ' 144' ' ' LEU . 0.0 OUTLIER -54.6 -19.14 5.4 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.56 1.163 . . . . 75.24 110.321 179.946 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -74.66 -43.13 56.81 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.582 1.177 . . . . 74.53 109.311 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.542 ' O ' ' CG ' ' A' ' 151' ' ' PHE . 9.4 p -93.69 -7.57 43.36 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.453 1.096 . . . . 73.51 110.445 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.436 ' N ' ' O ' ' A' ' 144' ' ' LEU . 2.7 t-105 -86.53 -27.08 24.2 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.554 1.159 . . . . 73.41 108.01 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 13.2 t -83.57 -45.16 13.84 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.494 1.121 . . . . 64.34 108.366 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.408 ' ND2' HD21 ' A' ' 125' ' ' LEU . 0.1 OUTLIER -63.27 -42.49 99.15 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.53 1.144 . . . . 72.41 109.35 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.56 ' CE1' ' HB3' ' A' ' 157' ' ' LEU . 5.1 m-30 -62.9 -34.66 77.89 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.542 1.151 . . . . 75.33 111.027 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -55.34 -48.76 73.72 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.515 1.135 . . . . 74.23 110.268 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.485 ' O ' ' CG ' ' A' ' 153' ' ' PHE . 11.5 t80 -86.78 0.28 55.06 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.476 1.11 . . . . 74.22 110.978 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.526 ' CE1' ' HB3' ' A' ' 156' ' ' SER . 0.4 OUTLIER -134.13 86.69 2.3 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.512 1.132 . . . . 74.35 111.003 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -67.26 -16.12 64.09 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.467 1.105 . . . . 71.55 110.412 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' SER . . . . . 0.526 ' HB3' ' CE1' ' A' ' 154' ' ' TYR . 1.8 t -61.85 -22.99 65.98 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.5 1.125 . . . . 72.03 110.004 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.56 ' HB3' ' CE1' ' A' ' 151' ' ' PHE . 2.4 mm? -87.93 -26.35 22.74 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.52 1.137 . . . . 73.21 109.274 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' MET . . . . . 0.509 ' O ' ' CG2' ' A' ' 161' ' ' VAL . 25.2 mmt -66.23 -22.25 66.33 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.563 1.164 . . . . 74.23 111.041 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' ASN . . . . . 0.454 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 9.9 m-20 -93.88 -17.79 22.66 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.486 1.116 . . . . 73.13 109.294 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.447 ' O ' ' N ' ' A' ' 163' ' ' ARG . 69.4 p -81.2 -34.6 32.17 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.485 1.116 . . . . 74.13 110.028 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . 0.509 ' CG2' ' O ' ' A' ' 158' ' ' MET . 1.5 m -51.07 -21.51 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.601 1.188 . . . . 62.3 109.267 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . 0.415 ' O ' ' C ' ' A' ' 163' ' ' ARG . 75.1 m-20 -90.09 25.75 2.06 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.538 1.149 . . . . 70.2 109.297 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 160' ' ' SER . 0.1 OUTLIER 37.91 34.22 0.06 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.478 1.111 . . . . 74.34 110.313 -179.948 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . 0.454 ' NE2' ' O ' ' A' ' 159' ' ' ASN . 9.4 mt-30 -38.7 126.88 1.52 Allowed 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.495 1.122 . . . . 72.32 110.339 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 39.5 m-70 -72.03 68.52 0.69 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.56 1.163 . . . . 73.03 109.654 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . 0.452 ' O ' ' NE2' ' A' ' 218' ' ' GLN . 0.1 OUTLIER -122.54 -174.39 2.9 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.486 1.116 . . . . 73.44 109.281 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' TYR . . . . . 0.749 ' CE1' ' CD1' ' A' ' 222' ' ' TRP . 8.2 t80 -45.56 -39.6 7.72 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.428 1.08 . . . . 74.01 110.992 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -128.17 149.02 50.62 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.569 1.168 . . . . 75.4 109.273 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' SER . . . . . 0.426 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 1.5 t -126.56 168.38 14.36 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.502 1.126 . . . . 74.44 110.034 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 2.0 t -129.52 117.06 41.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 O-C-N 124.557 1.161 . . . . 73.31 109.285 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 17.1 mm -124.25 99.91 36.53 Favored Pre-proline 0 C--N 1.326 -0.441 0 O-C-N 124.446 1.091 . . . . 73.12 109.287 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . 0.514 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.95 106.95 2.37 Favored 'Trans proline' 0 C--N 1.361 1.199 0 O-C-N 124.446 1.761 . . . . 74.11 111.017 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 173' ' ' MET . . . . . 0.402 ' CB ' HG23 ' A' ' 136' ' ' ILE . 3.5 ttt -87.77 152.44 22.12 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.442 1.088 . . . . 75.52 111.017 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 -106.43 123.9 37.39 Favored Pre-proline 0 C--N 1.325 -0.499 0 O-C-N 124.495 1.122 . . . . 74.45 110.293 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 175' ' ' PRO . . . . . 0.468 ' HB3' ' CD1' ' A' ' 138' ' ' LEU . 18.3 Cg_endo -74.94 155.0 43.19 Favored 'Trans proline' 0 C--N 1.36 1.175 0 O-C-N 124.528 1.804 . . . . 72.22 110.974 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . 0.565 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -96.0 -38.0 10.41 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.487 1.117 . . . . 74.25 109.304 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -72.9 -23.92 60.77 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.438 1.086 . . . . 71.04 109.336 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -110.38 110.24 58.12 Favored Pre-proline 0 C--N 1.325 -0.491 0 O-C-N 124.518 1.137 . . . . 74.5 109.313 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.93 115.5 4.31 Favored 'Trans proline' 0 C--N 1.359 1.094 0 O-C-N 124.525 1.802 . . . . 74.12 111.031 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . 0.5 ' CD1' ' OG1' ' A' ' 185' ' ' THR . 0.7 OUTLIER -118.11 96.98 50.41 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.535 1.147 . . . . 75.21 109.331 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.02 169.38 22.76 Favored 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.479 1.778 . . . . 71.31 110.996 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 12.3 ptt180 -70.55 -16.06 62.84 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.49 1.119 . . . . 65.22 110.374 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -78.74 -2.41 39.28 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.556 1.16 . . . . 64.33 110.318 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -128.4 8.04 5.93 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.473 1.108 . . . . 72.35 110.289 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 185' ' ' THR . . . . . 0.5 ' OG1' ' CD1' ' A' ' 180' ' ' LEU . 19.6 m -110.03 143.69 28.49 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.585 1.178 . . . . 74.51 110.371 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 185' ' ' THR . 18.3 Cg_endo -74.95 155.87 43.18 Favored 'Trans proline' 0 C--N 1.36 1.146 0 O-C-N 124.545 1.813 . . . . 64.44 110.983 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 187' ' ' PHE . . . . . 0.503 ' O ' ' CG2' ' A' ' 191' ' ' THR . 28.9 p90 -69.34 -7.38 36.78 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.488 1.118 . . . . 73.52 111.008 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.76 -53.17 4.13 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.449 1.093 . . . . 72.01 109.29 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.465 ' CD2' ' HG3' ' A' ' 172' ' ' PRO . 61.1 mt -68.27 -42.33 79.75 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.484 1.115 . . . . 75.33 109.328 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -63.77 -11.04 23.15 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.563 1.164 . . . . 65.03 110.279 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 191' ' ' THR . . . . . 0.503 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 34.4 p -113.0 -3.9 13.97 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.518 1.136 . . . . 73.51 110.411 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.499 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 7.9 mt -93.18 157.07 3.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 O-C-N 124.406 1.066 . . . . 72.11 109.301 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 193' ' ' ASN . . . . . 0.447 ' ND2' ' O ' ' A' ' 193' ' ' ASN . 25.4 t30 -76.97 56.95 1.27 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.417 1.073 . . . . 63.14 109.31 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . 0.514 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -50.99 163.18 0.21 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.58 1.175 . . . . 63.54 109.364 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 195' ' ' LEU . . . . . 0.471 HD21 ' CD1' ' A' ' 209' ' ' ILE . 0.2 OUTLIER -86.65 127.87 34.96 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 74.43 109.29 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -108.35 128.84 55.11 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.543 1.152 . . . . 72.13 110.345 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . 0.54 ' OE1' ' CD1' ' A' ' 202' ' ' PHE . 5.6 tp10 -109.74 -22.09 12.08 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.482 1.114 . . . . 74.25 110.322 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . 0.432 ' N ' HD13 ' A' ' 176' ' ' LEU . 2.2 pt-20 -94.82 19.12 10.59 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.495 1.122 . . . . 62.14 110.279 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -127.59 146.81 50.41 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.51 1.131 . . . . 62.33 110.001 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 12.6 tpp85 -63.18 -12.16 26.04 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.467 1.104 . . . . 75.14 110.298 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -93.76 16.43 60.82 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.545 1.153 . . . . 60.31 111.007 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 202' ' ' PHE . . . . . 0.701 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 5.3 t80 -67.83 -38.35 14.37 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.533 0.784 . . . . 74.23 110.986 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 203' ' ' PRO . . . . . 0.701 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.5 Cg_endo -74.98 -30.13 7.52 Favored 'Trans proline' 0 C--N 1.361 1.187 0 O-C-N 124.5 1.789 . . . . 62.35 111.073 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -64.08 -65.46 0.68 Allowed 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.521 1.138 . . . . 75.41 110.392 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -51.1 -42.28 60.55 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.423 1.077 . . . . 74.32 110.244 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 206' ' ' VAL . . . . . 0.543 ' CG2' ' O ' ' A' ' 202' ' ' PHE . 55.2 t -58.85 -28.41 37.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.487 1.117 . . . . 72.32 109.331 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -82.88 -47.6 11.66 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.521 1.138 . . . . 64.3 110.27 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -64.25 -64.01 0.99 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.459 1.099 . . . . 73.22 110.278 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 209' ' ' ILE . . . . . 0.549 HG22 ' CD1' ' A' ' 210' ' ' PHE . 54.2 mt -48.35 -53.01 6.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.515 1.135 . . . . 63.44 109.297 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 210' ' ' PHE . . . . . 0.584 ' HA ' ' CH2' ' A' ' 134' ' ' TRP . 0.8 OUTLIER -101.84 66.15 1.03 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.526 1.142 . . . . 75.25 111.016 179.993 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -110.92 146.37 36.69 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.504 1.128 . . . . 75.42 110.271 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.452 ' O ' ' N ' ' A' ' 215' ' ' TYR . 63.9 tt0 -48.86 -55.62 11.13 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.503 1.127 . . . . 63.41 110.275 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -48.24 -24.03 1.06 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.522 1.138 . . . . 75.21 110.011 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 22.6 t -95.86 -29.02 3.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.493 1.121 . . . . 71.43 109.281 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 215' ' ' TYR . . . . . 0.477 ' OH ' ' CE2' ' A' ' 78' ' ' PHE . 12.3 t80 -65.1 -20.26 66.39 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 124.535 1.147 . . . . 72.41 110.922 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . 0.46 ' O ' ' CB ' ' A' ' 220' ' ' THR . 5.9 mmpt? -69.23 -57.3 5.52 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.57 1.169 . . . . 63.55 109.372 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 217' ' ' THR . . . . . 0.468 HG21 ' CD1' ' A' ' 221' ' ' ILE . 1.2 m -47.87 -53.66 15.03 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.505 1.128 . . . . 73.35 110.41 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 218' ' ' GLN . . . . . 0.452 ' NE2' ' O ' ' A' ' 166' ' ' LYS . 94.5 mm-40 -55.78 -66.94 0.34 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.455 1.097 . . . . 73.15 110.325 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 219' ' ' GLN . . . . . 0.456 ' O ' ' NE2' ' A' ' 219' ' ' GLN . 40.2 tp60 -54.57 -18.79 4.83 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.547 1.154 . . . . 71.45 110.304 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 220' ' ' THR . . . . . 0.46 ' CB ' ' O ' ' A' ' 216' ' ' LYS . 2.9 m -83.27 -28.41 29.16 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.565 1.165 . . . . 62.34 110.399 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 221' ' ' ILE . . . . . 0.468 ' CD1' HG21 ' A' ' 217' ' ' THR . 14.0 mt -83.81 -17.66 10.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.453 1.096 . . . . 73.21 109.263 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 222' ' ' TRP . . . . . 0.749 ' CD1' ' CE1' ' A' ' 167' ' ' TYR . 7.9 t90 -89.09 -59.63 2.17 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.957 -1.127 . . . . 75.44 107.957 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.14 -20.45 6.7 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.496 1.123 . . . . 73.42 109.327 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -86.59 -30.3 21.94 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.48 1.113 . . . . 74.13 110.286 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 4.6 t -72.94 -22.8 60.66 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.497 1.123 . . . . 72.13 110.381 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 10.9 mtm180 -75.56 -14.4 60.39 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.502 1.127 . . . . 74.35 110.327 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 227' ' ' ASN . . . . . 0.442 ' O ' ' N ' ' A' ' 231' ' ' ARG . 1.0 OUTLIER -85.12 -59.23 2.39 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.478 1.111 . . . . 71.45 109.238 -179.967 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 20.8 ptp -44.87 -40.52 6.32 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.481 1.113 . . . . 71.15 111.01 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 229' ' ' VAL . . . . . 0.443 ' CG1' ' N ' ' A' ' 230' ' ' GLN . 0.5 OUTLIER -68.38 -45.55 82.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.467 1.104 . . . . 73.44 109.314 179.999 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 230' ' ' GLN . . . . . 0.443 ' N ' ' CG1' ' A' ' 229' ' ' VAL . 0.1 OUTLIER -88.87 18.36 4.87 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.478 1.111 . . . . 74.01 110.292 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 231' ' ' ARG . . . . . 0.442 ' N ' ' O ' ' A' ' 227' ' ' ASN . 14.6 ttt85 -114.91 -50.16 2.78 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 124.59 1.181 . . . . 74.24 110.34 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 41.6 tt0 -176.05 39.19 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.434 1.084 . . . . 71.31 110.238 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 233' ' ' PHE . . . . . 0.401 ' O ' ' O ' ' A' ' 229' ' ' VAL . 0.4 OUTLIER -152.13 179.02 8.86 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.466 1.104 . . . . 75.41 111.014 -179.998 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 23.4 mm -143.63 146.19 21.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.52 1.137 . . . . 73.12 109.294 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 235' ' ' ALA . . . . . 0.456 ' CB ' HD12 ' A' ' 72' ' ' LEU . . . . . . . . 0 C--N 1.325 -0.483 0 O-C-N 124.488 1.118 . . . . 74.25 109.298 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.038 0 N-CA-C 110.982 -0.847 . . . . 71.41 110.982 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.93 141.45 26.88 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.54 1.81 . . . . 72.33 111.079 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.0 -44.33 82.65 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.512 1.133 . . . . 64.41 109.299 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -168.98 112.74 0.49 Allowed Glycine 0 CA--C 1.53 0.985 0 O-C-N 124.5 1.125 . . . . 55.14 111.023 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -150.14 164.39 35.74 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.517 0.774 . . . . 70.2 110.039 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.43 ' CG ' ' N ' ' A' ' 76' ' ' GLU . 27.6 tt0 -60.71 156.69 16.29 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.489 1.118 . . . . 71.13 110.325 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.43 ' N ' ' CG ' ' A' ' 75' ' ' GLU . 0.5 OUTLIER -121.62 149.82 42.62 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.532 1.145 . . . . 71.51 110.336 179.977 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.554 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 5.9 p -161.23 163.87 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.526 1.142 . . . . 74.42 109.272 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.404 ' O ' ' O ' ' A' ' 79' ' ' LEU . 1.5 t80 -87.36 20.92 2.62 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.486 1.116 . . . . 74.21 110.985 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.404 ' O ' ' O ' ' A' ' 78' ' ' PHE . 6.5 tp -41.2 160.9 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.445 1.091 . . . . 75.24 109.341 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.506 ' O ' ' CB ' ' A' ' 133' ' ' ALA . 6.5 ptmt -111.08 -49.58 3.01 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 124.499 1.125 . . . . 75.21 109.308 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.578 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.2 OUTLIER -165.62 136.69 3.82 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.571 1.169 . . . . 74.01 111.04 -179.955 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.458 HG11 ' CB ' ' A' ' 128' ' ' ALA . 8.0 p -91.09 169.25 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.509 1.131 . . . . 71.3 109.293 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.552 ' CD1' ' CZ ' ' A' ' 81' ' ' PHE . 4.7 mp -133.04 96.97 2.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.478 1.111 . . . . 74.24 109.319 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.44 HD21 ' CD1' ' A' ' 112' ' ' PHE . 8.0 mt -69.59 124.15 23.19 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.468 1.105 . . . . 73.21 109.348 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.549 ' CD2' ' HB ' ' A' ' 111' ' ' ILE . 2.8 p80 -146.06 174.72 11.04 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.447 1.092 . . . . 74.05 109.658 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.467 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -131.8 164.65 25.56 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.442 1.089 . . . . 73.32 109.336 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -55.62 -17.29 5.33 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.47 1.106 . . . . 72.34 110.268 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -76.47 -46.53 26.46 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.529 1.143 . . . . 73.04 109.313 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.442 ' OD2' ' ND2' ' A' ' 178' ' ' ASN . 21.8 m-20 -125.35 45.14 2.64 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.492 1.12 . . . . 60.02 109.318 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.516 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.9 OUTLIER -75.05 -37.59 61.65 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 73.23 110.378 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.82 -19.99 43.45 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.467 1.104 . . . . 54.44 109.295 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.42 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -75.46 -59.97 2.51 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.436 1.085 . . . . 74.1 110.24 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.491 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -60.56 -23.17 64.42 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.581 1.176 . . . . 64.21 109.287 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.451 HD23 ' CG ' ' A' ' 97' ' ' GLN . 0.2 OUTLIER -85.8 -41.42 15.07 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.498 1.123 . . . . 73.55 109.279 -179.992 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -53.19 -34.78 58.42 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.496 1.122 . . . . 74.42 110.347 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.472 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 9.5 p -83.19 -56.08 6.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.49 1.119 . . . . 74.24 109.308 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.472 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.1 OUTLIER -47.67 -23.27 0.65 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.466 1.104 . . . . 70.1 110.273 -179.955 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -77.24 -43.33 33.91 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.472 1.108 . . . . 65.25 109.308 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.457 HD22 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -75.53 -22.28 57.22 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.519 1.137 . . . . 72.51 109.321 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.457 ' N ' HD22 ' A' ' 99' ' ' LEU . 73.4 mt -65.02 -49.67 69.25 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.483 1.114 . . . . 74.34 109.326 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -78.7 53.24 1.31 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.527 1.142 . . . . 71.54 110.321 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -176.91 -66.56 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.526 1.141 . . . . 74.33 109.336 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -41.54 -48.53 3.96 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.579 1.175 . . . . 74.31 109.276 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -115.8 -29.96 6.25 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.512 1.132 . . . . 75.41 110.993 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 106.61 35.92 2.73 Favored Glycine 0 CA--C 1.53 0.972 0 O-C-N 124.474 1.109 . . . . 73.44 111.011 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.462 HG21 ' CE ' ' A' ' 80' ' ' LYS . 23.5 mm -75.84 87.77 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.539 0.788 . . . . 74.22 109.3 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.494 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -137.75 158.32 71.87 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.529 1.143 . . . . 75.41 109.292 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.494 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.4 Cg_endo -74.94 158.25 99.1 Favored 'Cis proline' 0 C--N 1.36 1.177 0 C-N-CA 121.023 -2.49 . . . . 70.22 111.038 -0.071 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -114.97 134.25 11.52 Favored Glycine 0 CA--C 1.53 1.005 0 O-C-N 124.524 1.14 . . . . 64.41 111.02 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -154.09 128.26 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.531 0.783 . . . . 71.31 109.277 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.549 ' HB ' ' CD2' ' A' ' 85' ' ' HIS . 44.6 pt -89.68 -171.63 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 124.469 1.105 . . . . 72.43 109.26 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.519 ' CZ ' ' CB ' ' A' ' 122' ' ' LEU . 2.3 t80 -81.33 -40.01 24.26 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.522 1.139 . . . . 74.11 111.037 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -73.97 -4.45 35.27 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.539 1.15 . . . . 72.01 109.261 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -106.69 -26.57 11.27 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.515 1.135 . . . . 74.14 110.298 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.429 ' CE ' HG23 ' A' ' 82' ' ' VAL . 31.9 tpp -44.48 110.88 1.1 Allowed Pre-proline 0 C--N 1.326 -0.443 0 O-C-N 124.386 1.054 . . . . 74.11 110.996 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.9 90.97 1.03 Allowed 'Trans proline' 0 C--N 1.359 1.118 0 O-C-N 124.515 1.797 . . . . 64.11 111.043 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 3.1 p-80 -115.95 -173.07 2.28 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.554 1.159 . . . . 72.23 109.594 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -109.64 -128.2 5.53 Favored Glycine 0 CA--C 1.529 0.949 0 O-C-N 124.483 1.114 . . . . 51.3 111.017 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.4 ' O ' ' C ' ' A' ' 120' ' ' GLN . 4.3 mmm180 -52.48 -69.04 0.12 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.516 0.774 . . . . 75.23 110.318 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.4 ' C ' ' O ' ' A' ' 119' ' ' ARG . 44.6 mt-30 -39.05 136.31 0.82 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.407 1.067 . . . . 72.41 110.302 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . 0.407 ' O ' ' C ' ' A' ' 122' ' ' LEU . 1.3 p-80 -111.71 42.7 1.67 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.521 1.138 . . . . 72.21 109.571 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.519 ' CB ' ' CZ ' ' A' ' 112' ' ' PHE . 0.7 OUTLIER 39.85 53.85 2.59 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.538 1.149 . . . . 74.43 109.302 179.968 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 43.7 tt0 -62.17 -24.55 67.25 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.567 1.167 . . . . 74.02 110.267 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 30.9 m-80 -118.32 128.09 54.33 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.484 1.115 . . . . 74.03 109.289 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.411 ' CD2' ' ND2' ' A' ' 150' ' ' ASN . 0.1 OUTLIER -56.76 -18.58 13.13 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.466 1.104 . . . . 74.25 109.336 179.927 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.444 ' HB3' ' CE2' ' A' ' 154' ' ' TYR . 7.7 p-10 -46.54 -25.96 0.79 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.55 1.156 . . . . 74.44 109.307 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.408 ' N ' ' C ' ' A' ' 125' ' ' LEU . 2.1 t70 -65.27 -55.46 18.27 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.506 1.129 . . . . 73.01 109.27 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.458 ' CB ' HG11 ' A' ' 82' ' ' VAL . . . -61.02 -15.24 29.74 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.479 1.112 . . . . 65.33 109.313 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 89.9 t -86.6 10.53 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.496 1.123 . . . . 72.54 109.258 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 14.5 t30 -127.61 158.97 36.08 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.494 1.121 . . . . 74.21 109.311 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 42.67 55.43 4.64 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 124.489 1.118 . . . . 65.23 111.028 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -162.53 165.54 25.94 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.532 0.784 . . . . 54.12 110.036 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.598 ' O ' ' CD1' ' A' ' 134' ' ' TRP . . . -110.08 -25.49 10.19 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.493 1.121 . . . . 74.13 109.355 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.598 ' CD1' ' O ' ' A' ' 133' ' ' ALA . 4.0 m-90 -158.45 150.61 21.66 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.477 1.111 . . . . 72.23 108.062 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.411 ' OG1' ' HA ' ' A' ' 170' ' ' VAL . 7.0 p -125.94 154.8 42.32 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.529 1.143 . . . . 75.15 110.411 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.455 HG13 ' CG1' ' A' ' 83' ' ' ILE . 15.7 mm -105.42 91.65 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.461 1.1 . . . . 71.31 109.263 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.59 87.08 1.63 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.534 1.146 . . . . 73.41 109.3 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.499 ' O ' ' CD2' ' A' ' 143' ' ' PHE . 1.4 tp -62.1 96.2 0.07 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.495 1.122 . . . . 71.14 109.324 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.98 121.46 19.16 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.496 1.122 . . . . 74.43 109.303 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.483 ' CG2' ' OD1' ' A' ' 178' ' ' ASN . 7.0 m -137.9 -173.64 3.56 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.49 1.119 . . . . 70.32 110.394 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -84.93 -40.62 16.77 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 75.1 110.317 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . 0.409 ' ND2' ' N ' ' A' ' 143' ' ' PHE . 3.8 p-10 -89.67 -49.67 6.52 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.506 1.129 . . . . 73.5 109.32 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.499 ' CD2' ' O ' ' A' ' 138' ' ' LEU . 43.1 t80 -50.39 -28.04 7.42 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.473 1.108 . . . . 73.42 111.008 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -63.68 -67.85 0.39 Allowed 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.488 1.118 . . . . 65.55 109.263 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -48.59 -28.75 3.65 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.535 1.147 . . . . 75.24 110.389 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . 0.541 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 5.3 m-20 -71.48 -71.63 0.26 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.491 1.119 . . . . 71.52 109.35 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.476 HG23 ' CD2' ' A' ' 143' ' ' PHE . 65.7 p -49.08 -55.87 10.83 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.49 1.119 . . . . 72.43 110.404 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.561 ' CZ2' ' HB3' ' A' ' 186' ' ' PRO . 0.0 OUTLIER -46.39 -31.77 2.82 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.545 1.153 . . . . 74.12 108.009 -179.963 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . 0.541 ' CB ' ' O ' ' A' ' 146' ' ' ASP . 1.8 t -57.86 -46.21 85.17 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.546 1.154 . . . . 52.05 108.288 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.475 ' ND2' ' O ' ' A' ' 147' ' ' THR . 0.8 OUTLIER -67.05 -41.6 86.22 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.525 1.14 . . . . 73.41 109.288 -179.996 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.559 ' CZ ' HD12 ' A' ' 157' ' ' LEU . 13.1 m-85 -55.34 -21.75 16.43 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.61 1.194 . . . . 75.43 111.064 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -85.49 -33.01 21.93 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.549 1.156 . . . . 72.52 110.366 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.525 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 2.5 t80 -110.25 21.19 17.02 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.513 1.133 . . . . 64.24 111.035 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.452 ' N ' ' O ' ' A' ' 150' ' ' ASN . 2.3 t80 -163.75 106.0 0.95 Allowed 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.52 1.137 . . . . 75.03 111.011 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 6.3 t -85.92 -10.75 54.72 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.478 1.111 . . . . 72.54 110.456 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 3.1 t -62.55 -23.11 66.82 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.536 1.148 . . . . 75.12 110.007 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.559 HD12 ' CZ ' ' A' ' 151' ' ' PHE . 0.2 OUTLIER -77.11 -37.86 53.33 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.526 1.141 . . . . 70.33 109.302 -179.993 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' MET . . . . . 0.461 ' HA ' ' CE ' ' A' ' 158' ' ' MET . 17.0 mmt -57.0 -35.83 69.67 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.439 1.087 . . . . 73.53 111.0 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' ASN . . . . . 0.448 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 33.9 m-80 -71.23 -38.01 72.0 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.527 1.142 . . . . 75.45 109.342 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 1.3 p -67.19 -35.34 79.43 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.496 1.122 . . . . 75.2 109.995 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . 0.486 ' O ' ' CD1' ' A' ' 192' ' ' ILE . 64.7 t -58.56 -22.92 21.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.474 1.108 . . . . 74.41 109.302 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 68.9 m-20 -83.18 -22.71 33.16 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.459 1.1 . . . . 75.13 109.306 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 54.47 35.16 22.63 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.571 1.169 . . . . 74.41 110.271 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . 0.448 ' NE2' ' O ' ' A' ' 159' ' ' ASN . 0.8 OUTLIER -52.56 -173.5 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.488 1.117 . . . . 74.31 110.316 179.944 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 12.2 p-80 -73.21 66.79 0.9 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.49 1.119 . . . . 73.24 109.622 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.32 160.39 26.8 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.485 1.116 . . . . 75.15 109.308 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' TYR . . . . . 0.516 ' CZ ' ' ND2' ' A' ' 168' ' ' ASN . 4.6 p90 -70.0 -6.12 31.13 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.456 1.098 . . . . 73.41 110.89 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.516 ' ND2' ' CZ ' ' A' ' 167' ' ' TYR . 0.3 OUTLIER -122.81 137.44 54.93 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 124.493 1.12 . . . . 63.21 109.31 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' SER . . . . . 0.414 ' O ' ' HA ' ' A' ' 134' ' ' TRP . 0.7 OUTLIER -143.01 150.79 40.09 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.552 1.158 . . . . 65.01 110.024 179.997 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.411 ' HA ' ' OG1' ' A' ' 135' ' ' THR . 1.0 OUTLIER -126.18 150.5 31.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.474 1.109 . . . . 70.31 109.287 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 12.1 mm -139.65 112.51 7.71 Favored Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 124.532 1.145 . . . . 75.41 109.27 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . 0.466 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -75.0 106.9 2.37 Favored 'Trans proline' 0 C--N 1.36 1.183 0 O-C-N 124.548 1.815 . . . . 70.3 111.034 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 173' ' ' MET . . . . . 0.451 ' CB ' HG21 ' A' ' 136' ' ' ILE . 3.9 ttt -96.39 154.0 17.51 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.501 1.126 . . . . 70.13 110.974 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 57.8 mtm180 -110.66 121.53 40.86 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.476 1.11 . . . . 73.22 110.319 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.97 151.66 39.96 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.458 1.767 . . . . 73.0 111.037 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . 0.603 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -85.15 -43.54 13.75 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.458 1.099 . . . . 74.11 109.318 -179.996 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -71.82 -28.34 63.52 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.496 1.123 . . . . 64.52 109.28 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 178' ' ' ASN . . . . . 0.483 ' OD1' ' CG2' ' A' ' 140' ' ' THR . 2.6 m-80 -110.44 99.63 41.57 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.547 1.155 . . . . 73.35 109.242 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.98 115.09 4.18 Favored 'Trans proline' 0 C--N 1.359 1.122 0 O-C-N 124.512 1.796 . . . . 73.4 110.99 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . 0.47 HD22 ' CB ' ' A' ' 184' ' ' ARG . 0.6 OUTLIER -122.81 96.91 44.71 Favored Pre-proline 0 C--N 1.324 -0.518 0 O-C-N 124.528 1.143 . . . . 74.52 109.325 179.964 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.99 169.13 23.31 Favored 'Trans proline' 0 C--N 1.36 1.159 0 O-C-N 124.502 1.79 . . . . 63.45 111.013 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . 0.428 ' CG ' ' N ' ' A' ' 183' ' ' GLU . 23.1 ptt180 -53.1 -39.34 63.32 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.518 1.136 . . . . 74.0 110.3 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . 0.428 ' N ' ' CG ' ' A' ' 182' ' ' ARG . 5.4 pt-20 -52.01 -36.09 48.9 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.439 1.087 . . . . 73.44 110.375 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 184' ' ' ARG . . . . . 0.47 ' CB ' HD22 ' A' ' 180' ' ' LEU . 35.3 mmt180 -89.58 -18.43 26.58 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.427 1.079 . . . . 75.41 110.278 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 185' ' ' THR . . . . . . . . . . . . . 20.7 m -82.2 143.91 49.61 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.494 1.121 . . . . 73.41 110.361 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . 0.561 ' HB3' ' CZ2' ' A' ' 148' ' ' TRP . 18.4 Cg_endo -74.96 155.15 43.12 Favored 'Trans proline' 0 C--N 1.36 1.134 0 O-C-N 124.5 1.79 . . . . 74.01 111.022 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 187' ' ' PHE . . . . . 0.505 ' O ' ' CG2' ' A' ' 191' ' ' THR . 23.3 p90 -68.93 -7.09 31.76 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.582 1.176 . . . . 73.14 111.006 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.92 -53.11 4.12 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.592 1.182 . . . . 63.23 109.283 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.437 ' CD2' ' HG3' ' A' ' 172' ' ' PRO . 51.7 mt -68.54 -42.36 78.55 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.542 1.151 . . . . 74.45 109.326 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -63.62 -11.36 24.46 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.518 1.136 . . . . 72.34 110.316 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 191' ' ' THR . . . . . 0.505 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 29.1 p -111.81 19.55 17.87 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.48 1.113 . . . . 74.31 110.396 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.486 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 5.3 mt -138.21 139.33 42.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 O-C-N 124.5 1.125 . . . . 74.13 109.306 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 12.5 t30 -47.26 97.06 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.525 1.141 . . . . 73.1 109.315 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . 0.466 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -88.83 141.29 28.62 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.52 1.137 . . . . 63.45 109.31 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 195' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.47 136.09 57.91 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.51 1.131 . . . . 73.43 109.297 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -116.54 129.7 56.33 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.459 1.1 . . . . 71.32 110.349 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . 0.603 ' OE2' ' CD1' ' A' ' 202' ' ' PHE . 41.6 tp10 -113.16 -29.12 7.4 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.493 1.12 . . . . 73.22 110.335 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.1 21.24 6.01 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.521 1.138 . . . . 63.33 110.317 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 1.2 t -128.63 145.4 51.16 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.555 1.16 . . . . 65.03 109.997 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.17 -14.05 44.28 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.475 1.11 . . . . 74.4 110.258 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -92.82 16.22 60.82 Favored Glycine 0 CA--C 1.531 1.04 0 O-C-N 124.542 1.151 . . . . 73.22 111.004 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 202' ' ' PHE . . . . . 0.642 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 0.5 OUTLIER -61.15 -41.67 81.97 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.447 0.733 . . . . 74.02 110.997 -179.996 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 203' ' ' PRO . . . . . 0.642 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.05 -34.71 3.57 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.445 1.76 . . . . 52.1 111.013 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.09 -55.43 31.12 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.495 1.122 . . . . 62.3 110.407 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -65.51 -40.05 92.55 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.495 1.122 . . . . 73.31 110.34 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 206' ' ' VAL . . . . . 0.51 ' CG2' ' O ' ' A' ' 202' ' ' PHE . 72.9 t -64.45 -28.83 45.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.544 1.153 . . . . 74.31 109.239 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -83.07 -38.74 22.1 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.5 1.125 . . . . 72.43 110.305 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 79.3 mtt-85 -74.05 -65.49 0.83 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.545 1.153 . . . . 75.53 110.354 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 209' ' ' ILE . . . . . 0.493 HG21 ' CD1' ' A' ' 210' ' ' PHE . 90.8 mt -46.26 -50.03 5.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 124.447 1.092 . . . . 72.44 109.358 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 210' ' ' PHE . . . . . 0.5 ' HA ' ' CH2' ' A' ' 134' ' ' TRP . 0.9 OUTLIER -100.98 71.82 1.44 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.483 1.114 . . . . 72.43 111.006 179.943 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 211' ' ' GLN . . . . . 0.48 ' CG ' ' HB ' ' A' ' 214' ' ' VAL . 11.1 pt20 -110.9 138.64 47.05 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.49 1.119 . . . . 73.31 110.261 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.422 ' C ' ' N ' ' A' ' 214' ' ' VAL . 6.8 tt0 -51.49 -50.97 58.87 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 63.05 110.339 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.4 t -47.26 -21.55 0.29 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.554 1.159 . . . . 74.0 110.009 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.48 ' HB ' ' CG ' ' A' ' 211' ' ' GLN . 2.0 t -96.95 -43.07 12.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.544 1.153 . . . . 75.22 109.269 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 215' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -46.0 -40.05 9.95 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.526 1.141 . . . . 64.11 111.026 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -54.13 -66.31 0.42 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.491 1.119 . . . . 72.31 109.249 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 2.0 m -46.1 -66.54 0.39 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.51 1.131 . . . . 75.13 110.367 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 218' ' ' GLN . . . . . 0.422 ' O ' ' N ' ' A' ' 221' ' ' ILE . 18.5 mm-40 -39.55 -64.47 0.47 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.561 1.163 . . . . 74.44 110.284 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 219' ' ' GLN . . . . . 0.415 ' O ' ' N ' ' A' ' 223' ' ' LYS . 25.6 tp60 -44.14 -52.42 7.3 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.501 1.126 . . . . 75.12 110.304 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.83 -33.03 47.47 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.549 1.156 . . . . 70.33 110.42 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 221' ' ' ILE . . . . . 0.422 ' N ' ' O ' ' A' ' 218' ' ' GLN . 12.5 mt -74.67 -48.32 34.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.519 1.137 . . . . 71.13 109.299 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 222' ' ' TRP . . . . . 0.554 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 78.3 t90 -67.32 -17.96 64.98 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.032 -1.099 . . . . 73.01 108.032 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 219' ' ' GLN . 0.0 OUTLIER -84.63 -49.42 8.56 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.453 1.096 . . . . 72.5 109.284 -179.994 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -64.06 -35.97 82.47 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 75.53 110.372 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 2.3 t -54.62 -30.4 54.69 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.547 1.155 . . . . 75.23 110.409 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -81.78 -19.05 42.08 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.526 1.142 . . . . 75.24 110.347 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 227' ' ' ASN . . . . . 0.401 ' O ' ' CG ' ' A' ' 231' ' ' ARG . 1.0 OUTLIER -84.65 -42.53 15.26 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.46 1.1 . . . . 73.32 109.305 179.928 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 56.0 mtm -59.55 -41.0 89.08 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 124.576 1.172 . . . . 74.12 110.99 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 229' ' ' VAL . . . . . 0.404 HG12 ' N ' ' A' ' 230' ' ' GLN . 11.3 p -67.69 -51.36 51.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.507 1.129 . . . . 74.33 109.315 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 230' ' ' GLN . . . . . 0.404 ' N ' HG12 ' A' ' 229' ' ' VAL . 2.5 tp60 -71.04 -7.99 50.26 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.503 1.127 . . . . 74.41 110.275 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 231' ' ' ARG . . . . . 0.401 ' CG ' ' O ' ' A' ' 227' ' ' ASN . 9.0 mmm180 -88.66 -88.58 0.15 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.485 1.116 . . . . 75.31 110.255 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -135.61 47.15 2.3 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.469 1.106 . . . . 74.01 110.342 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -158.15 37.59 0.25 Allowed 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.519 1.137 . . . . 74.13 110.949 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 5.0 mm -45.48 139.38 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.495 1.122 . . . . 73.42 109.275 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.446 0 O-C-N 124.413 1.071 . . . . 74.31 109.216 179.993 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.978 0 N-CA-C 111.057 -0.817 . . . . 61.1 111.057 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.468 ' CG ' ' HB3' ' A' ' 74' ' ' SER . 18.1 Cg_endo -74.95 167.43 27.08 Favored 'Trans proline' 0 C--N 1.36 1.156 0 O-C-N 124.475 1.776 . . . . 72.24 111.037 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.08 -64.73 0.88 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.53 1.144 . . . . 64.22 109.309 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -126.19 53.75 0.78 Allowed Glycine 0 CA--C 1.529 0.949 0 O-C-N 124.438 1.086 . . . . 53.51 111.029 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.468 ' HB3' ' CG ' ' A' ' 71' ' ' PRO . 0.2 OUTLIER -135.78 174.37 10.69 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.448 0.734 . . . . 73.22 109.964 -179.922 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -118.07 148.56 42.16 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.553 1.158 . . . . 72.35 110.294 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -125.92 135.19 51.61 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.544 1.152 . . . . 73.44 110.262 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.595 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 2.7 p -142.98 158.02 17.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 O-C-N 124.439 1.087 . . . . 75.31 109.291 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.408 ' CE2' ' HG3' ' A' ' 108' ' ' PRO . 51.3 p90 -89.61 31.33 0.94 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.481 1.113 . . . . 73.41 111.035 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 9.3 tp -40.23 139.1 0.77 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.506 1.129 . . . . 71.4 109.338 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.4 mtpt -76.54 -63.43 1.34 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.492 1.12 . . . . 74.15 109.29 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.601 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.8 OUTLIER -160.81 127.9 4.21 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.562 1.164 . . . . 73.13 110.918 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.456 ' CG1' HG23 ' A' ' 135' ' ' THR . 12.3 p -84.55 169.59 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.549 1.155 . . . . 64.15 109.281 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.563 HD13 ' CZ ' ' A' ' 81' ' ' PHE . 1.7 mp -129.65 94.41 2.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.514 1.134 . . . . 74.12 109.246 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.538 HD23 ' CE2' ' A' ' 112' ' ' PHE . 3.0 mt -71.71 93.64 1.29 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.473 1.108 . . . . 70.44 109.299 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.603 ' CE1' ' OG1' ' A' ' 90' ' ' THR . 0.0 OUTLIER -115.05 174.51 5.94 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.487 1.117 . . . . 74.41 109.602 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -100.68 164.09 12.03 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.564 1.165 . . . . 73.03 109.316 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.47 ' CG ' ' O ' ' A' ' 87' ' ' GLU . 13.4 tt0 -71.23 -5.6 33.28 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.496 1.123 . . . . 71.32 110.3 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -91.06 -45.46 8.68 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.466 1.103 . . . . 64.43 109.296 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.452 ' N ' ' OD1' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -114.7 44.23 1.79 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.48 1.113 . . . . 74.41 109.31 179.954 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.603 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -76.91 -34.69 57.7 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.515 1.134 . . . . 61.23 110.396 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.401 ' N ' HG23 ' A' ' 90' ' ' THR . 1.6 m-20 -75.52 -19.54 59.29 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.493 1.121 . . . . 72.34 109.33 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -78.53 -57.07 3.96 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.444 1.09 . . . . 71.12 110.336 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.477 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -63.13 -16.46 60.11 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 73.14 109.3 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.431 ' O ' ' HG3' ' A' ' 97' ' ' GLN . 0.1 OUTLIER -89.51 -53.75 4.39 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.486 1.116 . . . . 74.23 109.345 179.976 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.426 ' N ' HD11 ' A' ' 94' ' ' LEU . 20.3 tpp180 -44.1 -29.62 0.64 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.5 1.125 . . . . 73.41 110.306 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.47 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 10.6 p -86.13 -56.23 5.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 O-C-N 124.403 1.064 . . . . 74.31 109.286 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.47 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -47.44 -23.74 0.67 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.454 1.096 . . . . 71.54 110.309 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.75 -39.19 57.58 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.515 1.135 . . . . 74.23 109.318 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.542 ' O ' ' CB ' ' A' ' 103' ' ' ASP . 0.0 OUTLIER -83.73 -19.52 35.03 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.505 1.128 . . . . 75.01 109.344 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.403 ' O ' ' HB ' ' A' ' 106' ' ' ILE . 87.7 mt -79.33 -20.17 48.52 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.477 1.111 . . . . 62.45 109.234 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . 0.512 ' O ' ' CD ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -89.47 -11.98 41.45 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.475 1.109 . . . . 73.42 110.247 -179.96 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.468 ' O ' ' C ' ' A' ' 103' ' ' ASP . 29.2 t70 -116.07 -57.21 2.24 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.434 1.084 . . . . 73.15 109.342 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.542 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 7.2 t0 -34.41 -65.68 0.19 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.516 1.135 . . . . 70.13 109.347 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.562 ' CE1' HG12 ' A' ' 206' ' ' VAL . 4.3 m-85 -102.63 -31.88 10.16 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.475 1.109 . . . . 73.14 111.02 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.473 ' O ' ' N ' ' A' ' 107' ' ' LYS . . . 108.57 28.47 4.55 Favored Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.488 1.118 . . . . 62.12 110.987 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.569 HG23 ' CE1' ' A' ' 81' ' ' PHE . 24.1 mm -65.29 73.89 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.479 0.752 . . . . 70.3 109.325 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.512 ' CD ' ' O ' ' A' ' 101' ' ' GLN . 0.8 OUTLIER -127.45 156.34 75.26 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.504 1.127 . . . . 74.03 109.295 -179.936 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.505 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.1 Cg_endo -75.05 132.14 26.57 Favored 'Cis proline' 0 C--N 1.361 1.192 0 C-N-CA 120.98 -2.508 . . . . 74.41 110.991 0.091 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.413 ' N ' ' HA ' ' A' ' 107' ' ' LYS . . . -107.02 117.19 5.23 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.444 1.09 . . . . 74.23 110.959 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -131.38 150.3 34.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 O-C-N 124.484 0.756 . . . . 74.44 109.307 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 45.3 pt -99.2 -175.56 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.499 1.125 . . . . 74.44 109.322 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.538 ' CE2' HD23 ' A' ' 84' ' ' LEU . 0.4 OUTLIER -81.82 -18.7 43.08 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.542 1.151 . . . . 71.32 111.059 179.994 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.87 -3.61 51.51 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.481 1.113 . . . . 74.13 109.266 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -106.82 -24.85 11.93 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.532 1.145 . . . . 71.23 110.321 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.455 ' CE ' HG23 ' A' ' 82' ' ' VAL . 15.0 ttm -55.9 110.97 2.64 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.509 1.13 . . . . 71.44 110.993 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.08 124.5 8.62 Favored 'Trans proline' 0 C--N 1.361 1.188 0 O-C-N 124.497 1.788 . . . . 64.24 110.935 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 30.4 m80 -124.74 176.83 6.33 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.546 1.154 . . . . 75.25 109.685 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -104.74 -157.47 23.43 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.557 1.161 . . . . 45.31 111.054 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 -38.88 -57.46 1.23 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.498 0.763 . . . . 74.13 110.258 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -45.33 158.58 0.07 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.466 1.104 . . . . 73.51 110.295 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -93.15 175.99 6.57 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.465 1.103 . . . . 75.14 109.689 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.475 ' C ' ' CD2' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -107.64 27.01 9.59 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 124.516 1.135 . . . . 74.14 109.309 -179.983 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -63.69 -16.94 62.36 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.521 1.138 . . . . 74.11 110.332 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -78.72 113.19 16.57 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.439 1.087 . . . . 71.04 109.291 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.434 ' C ' ' CD1' ' A' ' 125' ' ' LEU . 0.9 OUTLIER -82.31 -17.29 46.31 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.44 1.088 . . . . 72.24 109.26 -179.987 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -78.85 -14.55 59.18 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.486 1.116 . . . . 73.23 109.322 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -58.15 -52.59 64.91 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.51 1.131 . . . . 54.0 109.309 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.44 ' CB ' ' HG ' ' A' ' 84' ' ' LEU . . . -67.4 -14.52 63.0 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.48 1.112 . . . . 61.41 109.304 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.5 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 52.0 t -87.46 11.67 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.539 1.149 . . . . 71.15 109.25 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -141.09 124.51 16.67 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.556 1.16 . . . . 63.3 109.288 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 90.84 41.57 5.29 Favored Glycine 0 CA--C 1.53 0.987 0 O-C-N 124.608 1.193 . . . . 74.01 111.003 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.77 166.23 24.5 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.491 0.759 . . . . 71.23 110.021 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.572 ' HB1' ' CE3' ' A' ' 134' ' ' TRP . . . -87.58 -56.46 3.34 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.464 1.102 . . . . 73.21 109.296 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.572 ' CE3' ' HB1' ' A' ' 133' ' ' ALA . 1.8 m-90 -131.21 177.23 7.62 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.973 -1.121 . . . . 73.24 107.973 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.456 HG23 ' CG1' ' A' ' 82' ' ' VAL . 25.9 p -152.4 132.62 13.58 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.462 1.101 . . . . 74.34 110.454 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.403 ' HA ' ' O ' ' A' ' 171' ' ' ILE . 1.3 mp -84.32 140.78 15.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.464 1.102 . . . . 75.13 109.274 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.454 HD12 ' CE1' ' A' ' 143' ' ' PHE . 2.8 mm? -126.73 96.71 4.74 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.609 1.193 . . . . 74.11 109.283 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.456 HD22 ' CB ' ' A' ' 85' ' ' HIS . 0.1 OUTLIER -62.65 97.85 0.11 Allowed 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.47 1.106 . . . . 74.15 109.302 179.988 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.437 ' CD2' HG22 ' A' ' 185' ' ' THR . 3.2 tp -66.84 103.72 1.19 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.577 1.173 . . . . 75.51 109.321 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.487 ' CG2' ' OD1' ' A' ' 178' ' ' ASN . 2.7 m -121.39 177.85 5.03 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.482 1.114 . . . . 62.42 110.409 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . 0.431 ' HG3' ' CD2' ' A' ' 180' ' ' LEU . 2.2 mp0 -83.83 -35.9 23.88 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.431 1.082 . . . . 75.52 110.298 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . 0.44 ' OD1' ' N ' ' A' ' 143' ' ' PHE . 15.3 p30 -85.79 -41.92 14.64 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.47 1.106 . . . . 74.34 109.286 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.454 ' CE1' HD12 ' A' ' 137' ' ' LEU . 61.3 t80 -63.67 -21.39 66.36 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.462 1.102 . . . . 75.32 110.974 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.462 ' C ' ' CD1' ' A' ' 144' ' ' LEU . 2.0 tm? -63.88 -67.52 0.42 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.504 1.127 . . . . 72.12 109.337 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 52.6 mmm-85 -56.71 -17.41 8.84 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.558 1.161 . . . . 75.33 110.292 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.19 -66.5 0.72 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.482 1.113 . . . . 75.4 109.296 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.56 ' HB ' ' CZ ' ' A' ' 151' ' ' PHE . 2.5 p -68.29 -53.94 20.93 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.494 1.121 . . . . 73.1 110.376 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 3.6 t-105 -43.31 -41.99 4.28 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.482 1.114 . . . . 73.04 108.025 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . 0.453 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 41.7 t -71.94 -45.43 61.13 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.53 1.144 . . . . 72.33 108.244 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.426 ' N ' ' O ' ' A' ' 147' ' ' THR . 27.9 m120 -52.42 -30.83 31.4 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.427 1.079 . . . . 73.33 109.299 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.694 ' CE1' ' CD1' ' A' ' 157' ' ' LEU . 7.7 m-30 -73.14 -36.11 66.62 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.546 1.153 . . . . 74.1 110.969 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -65.05 -29.95 70.88 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.519 1.137 . . . . 61.44 110.317 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -93.64 -32.05 14.23 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.452 1.095 . . . . 74.41 111.029 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.419 ' CD2' ' HB3' ' A' ' 156' ' ' SER . 1.6 t80 -132.76 97.92 4.18 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.537 1.148 . . . . 75.25 111.037 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 2.9 t -65.64 -10.99 40.86 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.468 1.105 . . . . 75.53 110.409 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' SER . . . . . 0.419 ' HB3' ' CD2' ' A' ' 154' ' ' TYR . 3.4 t -52.02 -36.01 48.67 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.46 1.1 . . . . 74.44 110.042 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.694 ' CD1' ' CE1' ' A' ' 151' ' ' PHE . 1.7 tm? -87.66 -28.92 21.54 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.467 1.105 . . . . 74.31 109.21 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' MET . . . . . 0.54 ' HE3' ' CD2' ' A' ' 151' ' ' PHE . 1.6 tpt -62.85 -16.52 58.93 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.498 1.124 . . . . 74.53 110.992 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -90.63 -10.8 41.96 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.546 1.154 . . . . 74.43 109.311 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.454 ' HB3' ' CG2' ' A' ' 170' ' ' VAL . 0.7 OUTLIER -81.46 -38.57 26.18 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.529 1.143 . . . . 74.13 110.008 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . 0.466 ' O ' ' CD1' ' A' ' 192' ' ' ILE . 4.1 m -59.85 -18.28 15.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.485 1.116 . . . . 71.02 109.317 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . 0.513 ' N ' HD21 ' A' ' 162' ' ' ASN . 1.0 OUTLIER -63.91 -13.16 43.28 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.521 1.138 . . . . 73.15 109.258 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.462 ' CG ' HG22 ' A' ' 192' ' ' ILE . 4.8 mmm180 63.02 39.79 9.81 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.467 1.104 . . . . 63.55 110.344 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -52.51 -174.1 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.553 1.158 . . . . 72.54 110.333 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -127.34 50.7 1.97 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.49 1.119 . . . . 74.33 109.618 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -98.43 -174.37 2.8 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.55 1.156 . . . . 70.02 109.344 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' TYR . . . . . 0.603 ' CD1' ' N ' ' A' ' 168' ' ' ASN . 26.4 p90 -54.81 -42.68 72.15 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.543 1.152 . . . . 72.24 111.024 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.603 ' N ' ' CD1' ' A' ' 167' ' ' TYR . 1.2 p-10 -98.05 134.94 40.44 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.411 1.07 . . . . 73.45 109.272 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 169' ' ' SER . . . . . 0.445 ' N ' ' O ' ' A' ' 133' ' ' ALA . 16.1 m -123.55 146.76 47.87 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.459 1.099 . . . . 72.33 109.968 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.454 ' CG2' ' HB3' ' A' ' 160' ' ' SER . 43.5 t -103.33 137.94 29.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 O-C-N 124.44 1.088 . . . . 75.2 109.314 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . 0.403 ' O ' ' HA ' ' A' ' 136' ' ' ILE . 15.9 mm -141.86 104.99 5.76 Favored Pre-proline 0 C--N 1.325 -0.463 0 O-C-N 124.542 1.151 . . . . 73.21 109.283 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . 0.506 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.3 Cg_endo -74.96 106.2 2.23 Favored 'Trans proline' 0 C--N 1.36 1.167 0 O-C-N 124.478 1.778 . . . . 72.33 111.015 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 4.4 ttt -94.06 154.27 17.71 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.437 1.086 . . . . 73.22 111.034 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -113.66 116.46 45.68 Favored Pre-proline 0 C--N 1.325 -0.475 0 O-C-N 124.533 1.145 . . . . 73.42 110.265 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 153.65 42.0 Favored 'Trans proline' 0 C--N 1.359 1.129 0 O-C-N 124.476 1.777 . . . . 72.32 110.948 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . 0.562 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -91.25 -39.32 12.15 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.508 1.13 . . . . 72.43 109.293 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -72.61 -23.38 60.93 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.509 1.13 . . . . 65.14 109.258 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 178' ' ' ASN . . . . . 0.487 ' OD1' ' CG2' ' A' ' 140' ' ' THR . 1.1 m-80 -110.75 108.21 57.95 Favored Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.493 1.121 . . . . 73.32 109.339 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.96 125.23 9.21 Favored 'Trans proline' 0 C--N 1.36 1.134 0 O-C-N 124.511 1.795 . . . . 63.33 110.971 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . 0.431 ' CD2' ' HG3' ' A' ' 141' ' ' GLU . 1.2 tm? -140.68 97.02 7.41 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.455 1.097 . . . . 73.42 109.327 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.02 153.77 41.94 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.567 1.825 . . . . 70.41 111.004 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.44 -29.06 61.19 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.577 1.173 . . . . 74.23 110.323 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -58.71 -31.62 68.42 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.555 1.159 . . . . 74.2 110.306 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 -99.41 13.24 33.95 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.463 1.102 . . . . 73.01 110.298 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 185' ' ' THR . . . . . 0.437 HG22 ' CD2' ' A' ' 139' ' ' LEU . 46.5 m -106.53 144.13 28.39 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.537 1.148 . . . . 73.01 110.384 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.04 146.04 32.04 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.527 1.804 . . . . 74.23 111.012 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 187' ' ' PHE . . . . . . . . . . . . . 14.0 p90 -62.4 -11.94 18.64 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.475 1.109 . . . . 72.41 110.994 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -87.2 -53.79 4.66 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.586 1.179 . . . . 72.33 109.23 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.415 HD21 ' CG1' ' A' ' 161' ' ' VAL . 22.4 mt -74.19 -17.67 60.87 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.496 1.123 . . . . 74.11 109.267 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 190' ' ' GLN . . . . . 0.48 ' CG ' ' O ' ' A' ' 190' ' ' GLN . 6.8 tt0 -86.41 0.69 53.54 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.443 1.089 . . . . 62.51 110.331 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 191' ' ' THR . . . . . . . . . . . . . 34.1 p -127.87 16.18 6.86 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.488 1.117 . . . . 71.41 110.383 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.466 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 19.1 mt -117.08 152.12 18.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.481 1.113 . . . . 64.01 109.335 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 21.9 t30 -61.73 97.86 0.08 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.478 1.111 . . . . 73.31 109.343 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . 0.506 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -89.39 164.85 14.7 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.465 1.103 . . . . 74.25 109.28 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 195' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.09 126.4 50.25 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.429 1.081 . . . . 71.44 109.368 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -103.54 128.98 50.67 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.503 1.127 . . . . 73.24 110.289 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -106.75 -30.48 8.92 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.499 1.124 . . . . 63.51 110.256 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . 0.433 ' N ' HD11 ' A' ' 176' ' ' LEU . 4.0 pt-20 -92.51 25.24 3.1 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.511 1.132 . . . . 73.21 110.342 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.24 151.28 51.64 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.561 1.163 . . . . 63.41 109.987 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 9.9 tpt85 -67.62 -11.88 59.19 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.461 1.101 . . . . 72.22 110.312 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -93.62 15.37 63.2 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.503 1.127 . . . . 73.11 110.966 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 202' ' ' PHE . . . . . 0.683 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 8.5 t80 -66.29 -38.84 23.27 Favored Pre-proline 0 C--N 1.325 -0.463 0 O-C-N 124.443 0.731 . . . . 64.4 111.046 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 203' ' ' PRO . . . . . 0.683 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -74.95 -42.04 0.58 Allowed 'Trans proline' 0 C--N 1.36 1.162 0 O-C-N 124.556 1.819 . . . . 75.15 110.944 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -48.38 -63.13 1.16 Allowed 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.529 1.143 . . . . 74.4 110.406 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 205' ' ' GLN . . . . . 0.448 ' O ' ' N ' ' A' ' 209' ' ' ILE . 7.7 mt-30 -55.46 -55.48 31.22 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.468 1.105 . . . . 64.04 110.312 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 206' ' ' VAL . . . . . 0.562 HG12 ' CE1' ' A' ' 104' ' ' PHE . 75.4 t -47.24 -31.07 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.541 1.151 . . . . 74.54 109.256 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -81.15 -39.05 26.15 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.515 1.134 . . . . 71.41 110.266 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -77.03 -66.64 0.8 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.475 1.11 . . . . 73.33 110.34 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 209' ' ' ILE . . . . . 0.582 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 92.9 mt -44.53 -47.23 2.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.487 1.117 . . . . 74.44 109.301 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 210' ' ' PHE . . . . . 0.582 ' CE1' ' CG2' ' A' ' 209' ' ' ILE . 0.7 OUTLIER -107.66 66.87 0.67 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.466 1.104 . . . . 75.44 110.985 179.99 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -110.8 146.3 36.64 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.547 1.154 . . . . 73.22 110.318 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.441 ' O ' ' N ' ' A' ' 215' ' ' TYR . 29.6 tt0 -48.85 -55.18 12.4 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.552 1.157 . . . . 73.42 110.351 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.04 -24.6 1.63 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.449 1.093 . . . . 63.34 109.995 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 40.3 t -96.22 -26.45 4.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.585 1.178 . . . . 75.31 109.29 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 215' ' ' TYR . . . . . 0.441 ' N ' ' O ' ' A' ' 212' ' ' GLU . 4.2 t80 -67.46 -34.18 76.66 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.549 1.155 . . . . 73.34 111.021 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . 0.419 ' O ' ' CB ' ' A' ' 220' ' ' THR . 41.3 mmtt -54.32 -59.45 4.66 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.493 1.121 . . . . 74.32 109.255 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 217' ' ' THR . . . . . 0.486 ' CG2' ' CD1' ' A' ' 221' ' ' ILE . 7.6 m -52.78 -66.51 0.37 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.444 1.09 . . . . 73.55 110.406 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -39.74 -65.33 0.4 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.508 1.13 . . . . 73.32 110.271 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -55.51 -30.44 60.69 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.491 1.12 . . . . 65.33 110.249 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 220' ' ' THR . . . . . 0.432 ' N ' ' O ' ' A' ' 217' ' ' THR . 2.1 m -76.63 -20.59 56.54 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.49 1.119 . . . . 71.53 110.393 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 221' ' ' ILE . . . . . 0.486 ' CD1' ' CG2' ' A' ' 217' ' ' THR . 15.2 mt -90.15 -28.46 5.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.523 1.14 . . . . 71.04 109.317 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 222' ' ' TRP . . . . . 0.595 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 23.9 t90 -69.62 -29.22 66.66 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.514 1.134 . . . . 75.43 107.972 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . 0.446 ' HG3' ' N ' ' A' ' 224' ' ' GLU . 0.5 OUTLIER -86.85 -27.91 23.2 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.473 1.108 . . . . 72.03 109.302 -179.976 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . 0.446 ' N ' ' HG3' ' A' ' 223' ' ' LYS . 1.6 mm-40 -80.86 -26.42 36.95 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.5 1.125 . . . . 72.23 110.273 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 225' ' ' THR . . . . . 0.438 ' O ' ' CG1' ' A' ' 229' ' ' VAL . 6.9 t -72.08 -21.9 61.44 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.488 1.117 . . . . 72.11 110.413 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 226' ' ' ARG . . . . . 0.42 ' CG ' ' O ' ' A' ' 222' ' ' TRP . 0.7 OUTLIER -80.58 -8.57 59.64 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.517 1.136 . . . . 74.32 110.261 179.994 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 227' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -91.97 -58.36 2.43 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.492 1.12 . . . . 75.23 109.273 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 1.4 ptp -52.72 -33.88 49.96 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.505 1.128 . . . . 72.22 111.04 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 229' ' ' VAL . . . . . 0.438 ' CG1' ' O ' ' A' ' 225' ' ' THR . 20.4 m -73.38 -53.2 18.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.487 1.117 . . . . 75.23 109.329 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 230' ' ' GLN . . . . . 0.426 ' N ' ' CG2' ' A' ' 229' ' ' VAL . 4.6 tp60 -63.74 -13.23 41.78 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.466 1.103 . . . . 72.01 110.292 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 6.6 mmt180 -90.19 -79.94 0.33 Allowed 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.547 1.154 . . . . 74.31 110.324 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -148.61 59.9 1.07 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.478 1.111 . . . . 72.25 110.353 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -169.25 -177.93 3.02 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.522 1.138 . . . . 63.24 110.989 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 4.8 mm -137.24 140.54 42.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.473 1.108 . . . . 74.43 109.285 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.514 0 O-C-N 124.495 1.122 . . . . 75.23 109.27 -179.965 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.989 0 N-CA-C 110.978 -0.849 . . . . 62.11 110.978 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.99 142.05 27.4 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.451 1.764 . . . . 64.25 110.987 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.56 125.86 31.63 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.456 1.097 . . . . 72.13 109.355 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 37.82 85.46 0.01 OUTLIER Glycine 0 CA--C 1.531 1.039 0 O-C-N 124.475 1.109 . . . . 64.32 111.001 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.45 10.42 15.24 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.543 0.79 . . . . 71.35 109.953 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -159.81 135.04 8.13 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.534 1.146 . . . . 74.52 110.282 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -121.58 129.63 52.99 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.531 1.145 . . . . 62.11 110.34 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.587 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.2 p -129.32 164.26 32.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 O-C-N 124.518 1.136 . . . . 73.41 109.249 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.489 ' CE2' ' OH ' ' A' ' 215' ' ' TYR . 13.7 t80 -88.71 25.41 1.75 Allowed 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.47 1.106 . . . . 75.11 111.019 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.438 HD13 ' CG2' ' A' ' 110' ' ' ILE . 4.7 tp -39.79 158.33 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.474 1.109 . . . . 75.0 109.298 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.557 ' HG3' ' CE1' ' A' ' 215' ' ' TYR . 6.9 ttpt -104.97 -51.86 2.96 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.597 1.185 . . . . 70.35 109.261 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.589 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.4 OUTLIER -165.46 132.69 2.91 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.461 1.101 . . . . 75.11 111.039 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.461 HG12 ' CB ' ' A' ' 128' ' ' ALA . 2.7 p -86.25 166.8 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.489 1.118 . . . . 74.41 109.324 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.464 ' CG1' HG13 ' A' ' 136' ' ' ILE . 5.0 mp -129.64 93.18 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.51 1.132 . . . . 72.03 109.27 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.449 ' HG ' ' CB ' ' A' ' 128' ' ' ALA . 5.0 mt -70.16 116.19 10.23 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.513 1.133 . . . . 73.5 109.396 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.596 ' CE1' ' OG1' ' A' ' 90' ' ' THR . 0.0 OUTLIER -134.15 174.36 10.59 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.492 1.12 . . . . 74.45 109.578 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -113.22 164.4 13.58 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.609 1.193 . . . . 75.13 109.263 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.451 ' CG ' ' O ' ' A' ' 87' ' ' GLU . 16.7 tt0 -68.41 -7.64 33.38 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.584 1.177 . . . . 72.55 110.318 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -89.54 -26.74 20.7 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.522 1.139 . . . . 73.22 109.286 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.502 ' O ' ' CD2' ' A' ' 138' ' ' LEU . 1.3 m-20 -142.56 44.25 1.62 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.526 1.142 . . . . 74.03 109.314 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.596 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -76.82 -33.69 57.95 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.435 1.085 . . . . 73.04 110.385 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -73.89 -41.33 62.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.479 1.112 . . . . 61.4 109.31 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.405 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 4.8 tp10 -58.65 -52.36 66.03 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.566 1.167 . . . . 73.41 110.355 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.47 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -59.25 -25.79 64.35 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.527 1.142 . . . . 74.22 109.296 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.439 ' O ' ' CD2' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -82.26 -34.57 28.7 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.533 1.145 . . . . 75.24 109.321 179.919 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -55.58 -29.6 59.34 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.486 1.116 . . . . 70.5 110.294 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.449 ' C ' ' N ' ' A' ' 98' ' ' ASN . 1.7 t -83.1 -65.1 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.547 1.155 . . . . 75.14 109.33 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.441 ' N ' HG12 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -40.27 -27.69 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.47 1.106 . . . . 74.22 110.29 179.995 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.449 ' N ' ' C ' ' A' ' 96' ' ' VAL . 2.0 t-20 -70.53 -54.57 11.65 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.469 1.106 . . . . 72.24 109.253 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.47 ' C ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -67.74 -22.88 65.21 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.464 1.102 . . . . 71.04 109.334 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.471 ' CD2' HG23 ' A' ' 206' ' ' VAL . 28.5 mt -61.43 -57.96 10.09 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.539 1.149 . . . . 75.13 109.305 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -75.27 59.97 1.06 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.489 1.118 . . . . 74.11 110.341 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.4 t70 177.99 -65.46 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.528 1.143 . . . . 73.41 109.298 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.565 ' OD1' ' CE1' ' A' ' 104' ' ' PHE . 9.2 t70 -47.24 -50.26 21.56 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.484 1.115 . . . . 73.45 109.312 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.565 ' CE1' ' OD1' ' A' ' 103' ' ' ASP . 2.0 m-85 -114.55 -26.51 7.88 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.416 1.073 . . . . 64.24 111.069 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.47 45.92 2.65 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.523 1.139 . . . . 74.15 110.99 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.418 HD12 ' NZ ' ' A' ' 80' ' ' LYS . 4.9 mm -86.91 84.13 2.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.436 0.727 . . . . 73.12 109.379 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.501 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -132.71 156.7 79.79 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.444 1.09 . . . . 74.04 109.271 179.999 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.501 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.95 152.45 98.23 Favored 'Cis proline' 0 C--N 1.36 1.152 0 C-N-CA 120.948 -2.522 . . . . 70.33 111.006 -0.053 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.82 138.34 10.23 Favored Glycine 0 CA--C 1.529 0.921 0 O-C-N 124.531 1.145 . . . . 73.44 111.038 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.438 ' CG2' HD13 ' A' ' 79' ' ' LEU . 1.8 tt -156.01 150.54 10.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.415 0.715 . . . . 74.02 109.338 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.422 ' HB ' ' NE2' ' A' ' 85' ' ' HIS . 9.8 pt -101.35 168.7 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.525 1.141 . . . . 65.54 109.293 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -67.18 -19.8 65.63 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.513 1.133 . . . . 74.44 111.073 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -87.2 -14.29 41.54 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.519 1.137 . . . . 64.13 109.292 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -102.85 -19.11 14.79 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.446 1.091 . . . . 72.14 110.287 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 6.5 ttm -46.56 144.05 3.67 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.512 1.132 . . . . 73.44 111.042 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.94 67.95 5.79 Favored 'Trans proline' 0 C--N 1.359 1.119 0 O-C-N 124.462 1.77 . . . . 71.01 111.0 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 9.3 t-80 -147.69 139.71 24.2 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.53 1.144 . . . . 75.24 109.566 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.54 162.29 33.83 Favored Glycine 0 CA--C 1.531 1.049 0 O-C-N 124.379 1.049 . . . . 73.24 111.0 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -107.0 45.13 1.0 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.631 0.842 . . . . 75.1 110.284 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -82.29 -53.71 5.82 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.469 1.106 . . . . 74.13 110.327 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . 0.463 ' O ' ' CG ' ' A' ' 121' ' ' HIS . 8.1 p-80 -157.11 114.14 3.06 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.472 1.108 . . . . 74.11 109.533 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 6.8 mp -56.69 152.25 12.54 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.496 1.122 . . . . 63.02 109.256 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -123.18 -174.05 2.86 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.509 1.13 . . . . 74.41 110.301 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -42.96 141.75 1.06 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.542 1.151 . . . . 74.12 109.27 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.78 -17.46 38.16 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.551 1.157 . . . . 73.31 109.349 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.423 ' OD2' ' N ' ' A' ' 127' ' ' ASP . 6.9 p-10 -55.99 -21.57 21.92 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.46 1.1 . . . . 72.22 109.321 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.423 ' N ' ' OD2' ' A' ' 126' ' ' ASP . 1.0 OUTLIER -53.97 -52.89 59.28 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.455 1.097 . . . . 72.35 109.275 179.984 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.461 ' CB ' HG12 ' A' ' 82' ' ' VAL . . . -62.94 -26.77 68.98 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.438 1.086 . . . . 74.43 109.323 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.485 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 3.0 t -78.26 -0.56 3.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.51 1.131 . . . . 71.43 109.263 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -126.27 126.02 43.3 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.535 1.147 . . . . 70.03 109.282 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 87.29 49.65 3.89 Favored Glycine 0 CA--C 1.53 0.978 0 O-C-N 124.489 1.118 . . . . 70.04 111.002 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' SER . . . . . 0.403 ' O ' ' O ' ' A' ' 167' ' ' TYR . 0.3 OUTLIER -163.71 177.39 8.73 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.498 0.763 . . . . 72.25 109.988 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.634 ' CB ' ' CZ3' ' A' ' 134' ' ' TRP . . . -104.42 -25.58 12.76 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.519 1.137 . . . . 71.21 109.268 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.634 ' CZ3' ' CB ' ' A' ' 133' ' ' ALA . 4.1 m-90 -160.68 153.67 21.39 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.548 1.155 . . . . 71.53 107.995 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.437 ' CG2' ' HA ' ' A' ' 129' ' ' VAL . 2.0 p -123.03 128.13 49.74 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.484 1.115 . . . . 73.34 110.338 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.464 HG13 ' CG1' ' A' ' 83' ' ' ILE . 23.9 mm -84.19 134.2 27.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.528 1.143 . . . . 74.41 109.296 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 20.0 mt -127.91 97.69 4.89 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.49 1.119 . . . . 75.44 109.307 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.502 ' CD2' ' O ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -62.33 99.3 0.13 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.465 1.103 . . . . 65.22 109.329 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.472 ' CD2' HG23 ' A' ' 185' ' ' THR . 0.2 OUTLIER -70.76 105.05 3.06 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.405 1.066 . . . . 74.22 109.311 -179.977 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.432 ' HB ' ' CB ' ' A' ' 143' ' ' PHE . 13.6 m -132.01 -177.58 4.51 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.498 1.124 . . . . 73.33 110.357 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -81.67 -44.44 17.15 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.511 1.132 . . . . 75.13 110.323 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -82.87 -16.8 46.19 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.536 1.147 . . . . 72.24 109.327 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.432 ' CB ' ' HB ' ' A' ' 140' ' ' THR . 16.2 t80 -90.06 -19.74 24.02 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.491 1.119 . . . . 75.04 110.978 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.473 ' C ' ' CD1' ' A' ' 144' ' ' LEU . 2.0 tm? -61.33 -67.87 0.37 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.537 1.148 . . . . 75.0 109.298 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.45 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 10.9 mmt85 -62.87 -13.29 32.25 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.5 1.125 . . . . 72.21 110.253 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -68.84 -53.98 18.36 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.497 1.123 . . . . 71.14 109.252 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.462 ' HB ' ' CE1' ' A' ' 151' ' ' PHE . 2.7 p -88.66 -50.57 6.17 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.508 1.13 . . . . 65.11 110.348 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.62 ' CH2' ' CB ' ' A' ' 186' ' ' PRO . 3.4 t-105 -44.02 -32.39 1.15 Allowed 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.496 1.122 . . . . 73.44 108.004 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 42.2 t -81.48 -45.48 15.93 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.535 1.147 . . . . 75.44 108.32 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.601 ' O ' ' CD2' ' A' ' 154' ' ' TYR . 50.5 m-20 -62.99 -14.17 44.41 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.559 1.162 . . . . 73.24 109.304 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.561 ' CZ ' ' HG ' ' A' ' 157' ' ' LEU . 3.6 m-30 -80.16 -57.21 3.73 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.461 1.1 . . . . 74.45 110.934 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -47.8 -32.39 5.99 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.466 1.104 . . . . 70.53 110.253 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.446 ' HB3' ' CD1' ' A' ' 154' ' ' TYR . 0.4 OUTLIER -83.97 -37.08 22.71 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.456 1.097 . . . . 72.32 110.994 179.973 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.601 ' CD2' ' O ' ' A' ' 150' ' ' ASN . 1.0 OUTLIER -119.16 70.78 0.84 Allowed 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.44 1.088 . . . . 75.02 111.022 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 11.7 t -43.85 -26.5 0.27 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.544 1.152 . . . . 74.14 110.4 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' SER . . . . . 0.415 ' N ' ' C ' ' A' ' 154' ' ' TYR . 3.0 t -45.07 -44.42 10.27 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.507 1.129 . . . . 70.43 109.99 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.561 ' HG ' ' CZ ' ' A' ' 151' ' ' PHE . 2.2 tp -69.04 -38.62 79.26 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.55 1.156 . . . . 62.44 109.31 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' MET . . . . . 0.508 ' O ' ' CG2' ' A' ' 161' ' ' VAL . 0.0 OUTLIER -62.57 -16.6 57.03 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.455 1.097 . . . . 74.41 110.991 -179.978 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' ASN . . . . . 0.46 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 82.6 m-20 -93.54 -9.66 37.48 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.425 1.078 . . . . 62.1 109.357 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.464 ' OG ' ' CG2' ' A' ' 170' ' ' VAL . 1.2 p -82.49 -24.11 34.34 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.5 1.125 . . . . 71.43 109.965 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . 0.508 ' CG2' ' O ' ' A' ' 158' ' ' MET . 3.6 m -69.38 -15.7 19.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.497 1.123 . . . . 73.24 109.249 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . 0.45 ' CB ' ' OE1' ' A' ' 164' ' ' GLN . 4.6 m120 -65.87 -9.8 32.45 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 75.52 109.326 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.401 ' O ' ' O ' ' A' ' 164' ' ' GLN . 5.3 mmm180 67.87 53.88 0.65 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.471 1.107 . . . . 74.45 110.313 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . 0.679 ' H ' ' NE2' ' A' ' 164' ' ' GLN . 1.8 mp0 -51.26 -176.55 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.503 1.127 . . . . 72.11 110.371 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -134.76 19.69 3.54 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.424 1.078 . . . . 74.11 109.603 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.71 -155.94 0.09 Allowed 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.488 1.117 . . . . 64.4 109.274 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' TYR . . . . . 0.53 ' CD2' ' OD1' ' A' ' 168' ' ' ASN . 55.3 p90 -88.86 37.41 0.84 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.527 1.142 . . . . 75.3 110.944 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.53 ' OD1' ' CD2' ' A' ' 167' ' ' TYR . 9.7 m120 -170.09 122.19 0.67 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.495 1.122 . . . . 73.31 109.333 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 169' ' ' SER . . . . . 0.412 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 2.9 m -114.84 173.84 6.27 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.508 1.13 . . . . 61.14 110.057 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.464 ' CG2' ' OG ' ' A' ' 160' ' ' SER . 51.1 t -128.53 119.94 51.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.516 1.135 . . . . 64.44 109.343 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 35.2 mm -134.18 93.44 19.62 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.485 1.116 . . . . 71.14 109.271 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . 0.492 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.07 107.93 2.6 Favored 'Trans proline' 0 C--N 1.361 1.209 0 O-C-N 124.468 1.773 . . . . 64.1 110.967 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 173' ' ' MET . . . . . 0.404 ' HA ' ' O ' ' A' ' 195' ' ' LEU . 5.0 ttt -80.66 160.09 25.13 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.534 1.146 . . . . 64.03 110.985 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 69.4 mtt180 -116.68 128.44 26.01 Favored Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.513 1.133 . . . . 73.23 110.292 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 152.25 40.63 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.566 1.824 . . . . 74.24 111.013 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . 0.555 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -93.93 -44.54 8.03 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.482 1.114 . . . . 74.41 109.34 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -72.78 -26.8 61.66 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.479 1.112 . . . . 74.22 109.361 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -107.12 103.45 48.06 Favored Pre-proline 0 C--N 1.325 -0.474 0 O-C-N 124.462 1.101 . . . . 74.23 109.311 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 121.33 6.52 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.468 1.772 . . . . 71.33 110.997 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . 0.451 HD13 ' CB ' ' A' ' 184' ' ' ARG . 0.8 OUTLIER -131.22 98.68 18.39 Favored Pre-proline 0 C--N 1.325 -0.481 0 O-C-N 124.532 1.145 . . . . 71.25 109.35 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.01 163.41 35.36 Favored 'Trans proline' 0 C--N 1.359 1.129 0 O-C-N 124.46 1.769 . . . . 63.24 110.983 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.47 -33.95 66.43 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.528 1.142 . . . . 74.14 110.278 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -50.0 -23.23 1.91 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.529 1.143 . . . . 73.5 110.306 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 184' ' ' ARG . . . . . 0.458 ' HD3' ' N ' ' A' ' 184' ' ' ARG . 1.9 mpt_? -105.22 -28.75 10.77 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.526 1.141 . . . . 74.24 110.309 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 185' ' ' THR . . . . . 0.472 HG23 ' CD2' ' A' ' 139' ' ' LEU . 17.7 m -71.2 143.84 88.92 Favored Pre-proline 0 C--N 1.325 -0.481 0 O-C-N 124.522 1.139 . . . . 73.15 110.44 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . 0.62 ' CB ' ' CH2' ' A' ' 148' ' ' TRP . 18.2 Cg_endo -75.03 155.88 42.83 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.446 1.761 . . . . 62.54 110.994 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 187' ' ' PHE . . . . . 0.512 ' O ' ' CG2' ' A' ' 191' ' ' THR . 36.3 p90 -69.79 -6.62 33.49 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.509 1.131 . . . . 71.53 111.038 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -94.61 -53.09 4.02 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.592 1.182 . . . . 72.25 109.263 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.436 ' CD2' ' HG3' ' A' ' 172' ' ' PRO . 40.3 mt -68.49 -42.29 78.84 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.496 1.123 . . . . 70.11 109.278 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -64.38 -10.12 22.56 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.498 1.124 . . . . 73.34 110.321 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 191' ' ' THR . . . . . 0.512 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 25.5 p -112.64 12.49 19.78 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.435 1.084 . . . . 73.34 110.44 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.441 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 3.1 mt -115.92 154.11 17.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.491 1.12 . . . . 71.12 109.309 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 193' ' ' ASN . . . . . 0.412 ' N ' HG22 ' A' ' 192' ' ' ILE . 2.4 m-20 -65.39 76.28 0.06 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.508 1.13 . . . . 72.44 109.303 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . 0.492 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -70.78 161.91 30.08 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.533 1.145 . . . . 72.15 109.336 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 195' ' ' LEU . . . . . 0.404 ' O ' ' HA ' ' A' ' 173' ' ' MET . 0.2 OUTLIER -96.57 128.91 43.95 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.561 1.163 . . . . 72.11 109.271 -179.981 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -118.28 136.71 53.53 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.449 1.093 . . . . 74.01 110.313 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . 0.507 ' HA ' ' CD1' ' A' ' 202' ' ' PHE . 0.7 OUTLIER -103.22 -37.34 7.73 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.434 1.084 . . . . 75.42 110.308 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . 0.471 ' HG3' ' CG ' ' A' ' 176' ' ' LEU . 3.4 mt-10 -80.19 -15.2 57.56 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 124.48 1.112 . . . . 73.35 110.313 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 7.5 t -68.21 159.57 30.9 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.527 1.142 . . . . 71.43 109.941 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -66.67 -48.37 69.55 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.477 1.11 . . . . 74.02 110.289 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -89.62 29.49 6.23 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.547 1.155 . . . . 75.04 110.994 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 202' ' ' PHE . . . . . 0.615 ' CD1' ' C ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -52.33 -47.36 93.01 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.487 0.757 . . . . 73.21 111.032 179.968 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 203' ' ' PRO . . . . . 0.585 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.2 Cg_endo -75.06 -27.48 9.88 Favored 'Trans proline' 0 C--N 1.36 1.143 0 O-C-N 124.432 1.754 . . . . 74.42 110.955 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -59.26 -53.9 52.99 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.49 1.118 . . . . 75.41 110.412 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 205' ' ' GLN . . . . . 0.407 ' O ' ' C ' ' A' ' 206' ' ' VAL . 13.3 mt-30 -56.02 -64.03 0.99 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.512 1.132 . . . . 70.5 110.274 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 206' ' ' VAL . . . . . 0.585 ' CG1' ' HA ' ' A' ' 203' ' ' PRO . 3.0 p -39.75 -40.43 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.442 1.089 . . . . 74.2 109.255 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.83 -63.96 0.96 Allowed 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.521 1.138 . . . . 74.14 110.227 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -54.68 -64.09 0.95 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.498 1.124 . . . . 73.33 110.305 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 209' ' ' ILE . . . . . 0.498 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 3.7 mt -42.44 -60.64 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.506 1.128 . . . . 71.34 109.336 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 210' ' ' PHE . . . . . 0.582 ' CE2' ' HA ' ' A' ' 206' ' ' VAL . 0.4 OUTLIER -101.05 70.09 1.33 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.524 1.14 . . . . 61.41 110.989 179.981 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.71 143.53 41.06 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.492 1.12 . . . . 74.24 110.331 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 215' ' ' TYR . 19.1 tt0 -49.03 -55.15 12.89 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.513 1.133 . . . . 74.24 110.322 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -46.38 -25.19 0.6 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.411 1.069 . . . . 71.41 109.966 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 8.6 t -94.81 -32.92 4.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.484 1.115 . . . . 74.02 109.341 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 215' ' ' TYR . . . . . 0.557 ' CE1' ' HG3' ' A' ' 80' ' ' LYS . 29.9 t80 -61.25 -19.65 61.94 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.552 1.158 . . . . 73.44 110.975 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 3.7 mmmt -62.5 -66.13 0.59 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.523 1.139 . . . . 64.01 109.33 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 217' ' ' THR . . . . . 0.413 HG22 ' CD1' ' A' ' 221' ' ' ILE . 1.9 m -48.93 -64.31 0.84 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.501 1.126 . . . . 70.24 110.379 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -43.02 -63.64 0.77 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.478 1.111 . . . . 74.14 110.279 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 219' ' ' GLN . . . . . 0.446 ' O ' ' NE2' ' A' ' 219' ' ' GLN . 25.2 tp60 -50.41 -29.92 11.27 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.467 1.104 . . . . 71.52 110.29 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -79.27 -29.77 42.71 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.531 1.144 . . . . 72.42 110.417 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 221' ' ' ILE . . . . . 0.413 ' CD1' HG22 ' A' ' 217' ' ' THR . 14.1 mt -76.83 -27.66 16.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.593 1.183 . . . . 75.23 109.301 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 222' ' ' TRP . . . . . 0.587 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 23.0 t90 -77.94 -55.3 5.42 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.564 1.165 . . . . 73.25 108.002 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -20.91 22.86 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.518 1.136 . . . . 71.4 109.34 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 81.5 mt-10 -86.58 -46.19 10.36 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.559 1.162 . . . . 70.24 110.352 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 4.3 t -53.42 -19.78 3.91 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.501 1.126 . . . . 73.53 110.402 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 226' ' ' ARG . . . . . 0.409 ' CG ' ' O ' ' A' ' 222' ' ' TRP . 0.1 OUTLIER -78.13 -31.74 50.0 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.418 1.073 . . . . 64.24 110.322 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 227' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -66.61 -44.07 83.09 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.481 1.113 . . . . 72.13 109.273 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 228' ' ' MET . . . . . 0.462 ' O ' ' N ' ' A' ' 232' ' ' GLN . 26.6 mtt -56.48 -72.01 0.08 Allowed 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.552 1.158 . . . . 72.51 110.968 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 229' ' ' VAL . . . . . 0.455 ' O ' ' C ' ' A' ' 230' ' ' GLN . 5.1 m -40.81 -47.02 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.534 1.146 . . . . 75.31 109.308 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 230' ' ' GLN . . . . . 0.455 ' C ' ' O ' ' A' ' 229' ' ' VAL . 0.0 OUTLIER -33.97 -72.4 0.05 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.456 1.097 . . . . 72.14 110.27 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -134.04 51.57 2.12 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.476 1.11 . . . . 70.05 110.281 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 232' ' ' GLN . . . . . 0.462 ' N ' ' O ' ' A' ' 228' ' ' MET . 53.3 mt-30 -155.44 -41.44 0.08 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.474 1.109 . . . . 63.51 110.346 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 233' ' ' PHE . . . . . 0.409 ' C ' ' HA ' ' A' ' 229' ' ' VAL . 0.5 OUTLIER -136.15 53.1 1.95 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.539 1.149 . . . . 73.24 111.052 179.977 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 3.6 tt -50.48 157.39 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.485 1.115 . . . . 75.44 109.311 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.439 0 O-C-N 124.467 1.104 . . . . 74.55 109.318 179.992 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.954 0 N-CA-C 110.956 -0.858 . . . . 61.34 110.956 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 150.6 38.41 Favored 'Trans proline' 0 C--N 1.361 1.199 0 O-C-N 124.509 1.794 . . . . 73.15 111.04 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.431 ' C ' ' CD1' ' A' ' 72' ' ' LEU . 0.3 OUTLIER -67.96 -48.15 66.64 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.441 1.088 . . . . 72.21 109.305 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -117.45 70.56 0.3 Allowed Glycine 0 CA--C 1.53 1.022 0 O-C-N 124.461 1.1 . . . . 74.14 111.037 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.1 p -69.93 169.81 12.48 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.469 0.747 . . . . 75.41 109.959 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -56.6 121.14 9.03 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.444 1.09 . . . . 75.45 110.305 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -114.23 132.96 55.94 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.499 1.124 . . . . 71.44 110.317 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 2.8 p -134.59 151.83 32.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.419 1.074 . . . . 74.53 109.321 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -89.19 31.09 0.9 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.563 1.164 . . . . 73.2 111.032 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 24.6 tp -39.73 147.12 0.09 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.488 1.117 . . . . 64.15 109.28 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.44 ' CD ' ' O ' ' A' ' 107' ' ' LYS . 0.5 OUTLIER -89.82 -62.74 1.4 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.555 1.16 . . . . 75.11 109.321 179.945 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.575 ' O ' ' CD1' ' A' ' 81' ' ' PHE . 0.9 OUTLIER -165.5 129.94 2.37 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.568 1.168 . . . . 64.41 110.992 179.953 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.469 ' CG1' HG23 ' A' ' 135' ' ' THR . 11.0 p -85.37 166.9 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.48 1.112 . . . . 75.05 109.298 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.531 ' CD1' ' CZ ' ' A' ' 81' ' ' PHE . 1.7 mp -128.26 92.76 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.482 1.114 . . . . 74.41 109.311 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.577 ' CD2' ' CZ ' ' A' ' 112' ' ' PHE . 3.3 mt -70.53 98.93 1.54 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.556 1.16 . . . . 72.34 109.216 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.557 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -120.32 174.4 6.54 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.448 1.093 . . . . 73.21 109.639 179.895 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -111.84 164.22 13.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.473 1.108 . . . . 73.22 109.263 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.442 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 14.4 tt0 -68.27 -8.78 42.36 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.488 1.118 . . . . 65.04 110.267 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -80.37 -38.45 30.39 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.516 1.135 . . . . 72.51 109.344 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.416 ' OD2' ' ND2' ' A' ' 178' ' ' ASN . 0.0 OUTLIER -137.7 44.23 2.22 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.482 1.114 . . . . 75.51 109.349 -179.961 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.557 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -77.62 -30.09 52.15 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.465 1.103 . . . . 75.22 110.403 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.78 -25.53 61.2 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.555 1.159 . . . . 64.32 109.291 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.484 ' CG ' ' ND2' ' A' ' 177' ' ' ASN . 0.2 OUTLIER -76.62 -58.4 3.31 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.476 1.11 . . . . 73.04 110.277 -179.976 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.479 ' CB ' ' HB3' ' A' ' 85' ' ' HIS . . . -54.88 -19.56 6.87 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.479 1.112 . . . . 74.13 109.353 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.437 ' CD2' ' C ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -89.8 -50.07 6.26 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.501 1.125 . . . . 74.13 109.234 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.419 ' N ' HD12 ' A' ' 94' ' ' LEU . 38.4 tpt85 -46.8 -31.48 3.05 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.53 1.144 . . . . 75.13 110.326 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.465 ' O ' ' N ' ' A' ' 99' ' ' LEU . 10.9 p -83.16 -55.85 6.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.525 1.141 . . . . 75.31 109.284 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.463 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -47.61 -24.08 0.81 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.497 1.123 . . . . 72.2 110.315 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.403 ' O ' ' HG3' ' A' ' 101' ' ' GLN . 0.9 OUTLIER -75.48 -38.56 59.47 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.464 1.102 . . . . 63.14 109.345 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.537 ' O ' ' CB ' ' A' ' 103' ' ' ASP . 0.0 OUTLIER -84.63 -19.3 33.16 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.418 1.074 . . . . 74.51 109.353 179.951 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.409 ' O ' ' HB ' ' A' ' 106' ' ' ILE . 90.3 mt -79.76 -20.22 46.84 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.465 1.103 . . . . 75.01 109.243 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . 0.536 ' O ' ' HD3' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -88.98 -11.93 42.92 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.523 1.14 . . . . 73.15 110.324 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.467 ' O ' ' C ' ' A' ' 103' ' ' ASP . 30.6 t70 -116.2 -57.15 2.24 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.426 1.078 . . . . 74.14 109.304 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.537 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 51.5 t0 -34.78 -64.78 0.24 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.528 1.142 . . . . 72.23 109.321 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.581 ' CE1' HG13 ' A' ' 206' ' ' VAL . 4.4 m-85 -104.08 -32.31 9.25 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.508 1.13 . . . . 73.34 110.959 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.482 ' O ' ' N ' ' A' ' 107' ' ' LYS . . . 109.51 27.08 4.85 Favored Glycine 0 CA--C 1.529 0.939 0 O-C-N 124.581 1.175 . . . . 61.35 110.974 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.561 HG21 ' CE1' ' A' ' 81' ' ' PHE . 28.4 mm -63.98 75.63 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.408 0.711 . . . . 74.44 109.358 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.536 ' HD3' ' O ' ' A' ' 101' ' ' GLN . 0.3 OUTLIER -129.07 157.14 76.84 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.493 1.121 . . . . 74.32 109.317 -179.927 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.495 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.4 Cg_endo -75.04 132.0 26.11 Favored 'Cis proline' 0 C--N 1.36 1.166 0 C-N-CA 120.953 -2.52 . . . . 72.15 110.983 0.02 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.422 ' N ' ' HA ' ' A' ' 107' ' ' LYS . . . -105.17 116.67 5.33 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.54 1.15 . . . . 75.32 111.009 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -129.69 148.26 33.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.503 0.766 . . . . 75.35 109.332 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.405 HD11 ' NE2' ' A' ' 85' ' ' HIS . 41.8 pt -98.73 -175.76 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.515 1.134 . . . . 63.24 109.328 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.577 ' CZ ' ' CD2' ' A' ' 84' ' ' LEU . 0.6 OUTLIER -82.14 -18.55 42.49 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.526 1.141 . . . . 74.04 110.93 -179.986 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -94.49 -3.08 50.62 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.559 1.162 . . . . 73.05 109.352 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -104.65 -26.63 12.24 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.501 1.126 . . . . 74.32 110.317 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.454 ' CE ' HG23 ' A' ' 82' ' ' VAL . 4.8 ttm -48.28 141.14 9.09 Favored Pre-proline 0 C--N 1.326 -0.444 0 O-C-N 124.511 1.132 . . . . 74.01 110.984 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.94 -66.61 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.191 0 O-C-N 124.562 1.822 . . . . 72.43 111.071 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 37.2 t-80 -41.61 160.99 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.543 1.152 . . . . 73.22 109.574 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 82.99 63.41 1.74 Allowed Glycine 0 CA--C 1.531 1.059 0 O-C-N 124.546 1.154 . . . . 74.11 111.004 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 4.3 tmm_? -60.6 -39.97 90.11 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.536 0.786 . . . . 75.34 110.302 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -103.29 -66.78 0.92 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.525 1.141 . . . . 75.32 110.331 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . 0.502 ' CG ' ' N ' ' A' ' 122' ' ' LEU . 3.0 t-80 -171.0 164.38 7.53 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.428 1.08 . . . . 74.34 109.634 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.502 ' N ' ' CG ' ' A' ' 121' ' ' HIS . 0.0 OUTLIER -148.25 143.14 26.78 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.438 1.086 . . . . 74.12 109.347 179.984 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 16.4 pm0 -121.96 8.5 9.89 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.505 1.128 . . . . 74.51 110.26 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 34.4 m-20 -89.38 105.24 17.67 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.519 1.137 . . . . 73.23 109.287 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.514 ' CD2' ' ND2' ' A' ' 150' ' ' ASN . 1.6 mm? -58.52 -32.31 68.72 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 124.535 1.147 . . . . 75.34 109.318 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.478 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 7.6 t70 -54.96 -19.74 7.43 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.537 1.148 . . . . 75.45 109.271 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.433 ' OD2' ' CD2' ' A' ' 122' ' ' LEU . 51.2 m-20 -59.25 -70.32 0.16 Allowed 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.517 1.136 . . . . 75.15 109.308 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.454 ' HB3' ' CD1' ' A' ' 84' ' ' LEU . . . -74.66 -17.48 60.68 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.534 1.147 . . . . 75.44 109.304 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.482 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 86.9 t -93.07 30.8 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.456 1.098 . . . . 74.31 109.302 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.478 ' CB ' ' O ' ' A' ' 126' ' ' ASP . 23.5 t30 -147.47 133.37 19.1 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.445 1.091 . . . . 73.01 109.244 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 71.82 55.51 7.27 Favored Glycine 0 CA--C 1.53 1.005 0 O-C-N 124.474 1.109 . . . . 64.12 111.018 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.46 173.8 12.68 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.444 0.732 . . . . 70.44 109.992 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.611 ' CB ' ' CZ3' ' A' ' 134' ' ' TRP . . . -101.73 -30.76 11.13 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.487 1.117 . . . . 75.44 109.287 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.611 ' CZ3' ' CB ' ' A' ' 133' ' ' ALA . 2.5 m-90 -158.86 177.15 11.47 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.953 -1.129 . . . . 75.15 107.953 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.469 HG23 ' CG1' ' A' ' 82' ' ' VAL . 25.3 p -151.45 124.02 8.43 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.479 1.112 . . . . 54.42 110.435 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.465 ' O ' ' CD2' ' A' ' 137' ' ' LEU . 1.1 mp -84.09 140.66 15.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 O-C-N 124.533 1.146 . . . . 64.41 109.304 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.465 ' CD2' ' O ' ' A' ' 136' ' ' ILE . 9.0 mt -131.17 100.66 5.28 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.577 1.173 . . . . 72.03 109.26 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.455 HD23 ' CB ' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -62.67 107.21 0.91 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.533 1.145 . . . . 74.23 109.31 179.985 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.432 HD21 ' CB ' ' A' ' 172' ' ' PRO . 0.5 OUTLIER -68.91 108.63 3.56 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.495 1.122 . . . . 73.33 109.241 -179.977 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.482 ' CG2' ' OD1' ' A' ' 178' ' ' ASN . 2.8 m -123.87 162.06 24.06 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.431 1.082 . . . . 74.42 110.395 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -62.37 -37.81 87.13 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.534 1.146 . . . . 75.14 110.248 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . 0.445 ' ND2' ' N ' ' A' ' 143' ' ' PHE . 2.3 p-10 -89.67 -52.9 4.77 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.519 1.137 . . . . 75.4 109.279 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.469 ' CB ' ' HB ' ' A' ' 140' ' ' THR . 49.7 t80 -49.13 -24.5 1.68 Allowed 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.534 1.147 . . . . 74.43 111.02 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.413 ' O ' ' N ' ' A' ' 148' ' ' TRP . 2.2 tm? -58.16 -68.37 0.26 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.514 1.134 . . . . 74.55 109.26 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.43 ' CD ' ' C ' ' A' ' 145' ' ' ARG . 0.6 OUTLIER -57.64 -16.67 11.24 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.46 1.1 . . . . 74.35 110.298 -179.984 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -75.17 -38.12 60.98 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.485 1.115 . . . . 74.12 109.324 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.541 ' O ' ' CG ' ' A' ' 151' ' ' PHE . 2.3 p -101.14 -7.61 23.0 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.437 1.086 . . . . 72.31 110.449 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.422 ' HA ' ' CE3' ' A' ' 148' ' ' TRP . 1.0 OUTLIER -94.68 -25.14 16.85 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.959 -1.126 . . . . 74.15 107.959 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 42.7 t -88.57 -45.46 9.87 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.502 1.126 . . . . 65.23 108.253 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.514 ' ND2' ' CD2' ' A' ' 125' ' ' LEU . 0.1 OUTLIER -61.83 -54.2 45.46 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.441 1.088 . . . . 62.11 109.316 -179.954 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.541 ' CG ' ' O ' ' A' ' 147' ' ' THR . 4.9 m-30 -53.41 -52.88 57.95 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.507 1.129 . . . . 71.3 110.95 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -39.39 -48.69 1.95 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.518 1.137 . . . . 72.33 110.334 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -81.33 -28.23 34.62 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.372 1.045 . . . . 70.03 111.03 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.431 ' N ' ' O ' ' A' ' 151' ' ' PHE . 4.5 m-85 -113.6 86.57 2.42 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 124.464 1.103 . . . . 75.31 111.035 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' THR . . . . . 0.413 ' O ' ' N ' ' A' ' 158' ' ' MET . 1.1 t -61.25 -14.14 23.85 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.481 1.113 . . . . 72.05 110.36 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 12.5 t -46.64 -34.56 5.15 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.464 1.103 . . . . 72.04 109.993 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.44 -29.32 20.27 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.403 1.064 . . . . 73.43 109.267 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' MET . . . . . 0.46 ' HA ' ' CE ' ' A' ' 158' ' ' MET . 23.1 mmt -62.07 -24.25 66.99 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.491 1.12 . . . . 75.32 110.984 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' ASN . . . . . 0.45 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 24.8 p30 -92.92 -19.37 21.71 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.466 1.104 . . . . 64.23 109.289 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.43 ' N ' ' OD1' ' A' ' 159' ' ' ASN . 1.4 m -81.29 -34.31 32.07 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.522 1.139 . . . . 72.31 110.017 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . 0.504 ' O ' ' CD1' ' A' ' 192' ' ' ILE . 7.6 m -60.65 -17.98 16.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.584 1.177 . . . . 75.34 109.346 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . 0.429 ' CB ' ' HG3' ' A' ' 164' ' ' GLN . 49.3 m-20 -66.94 -10.37 48.39 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.53 1.144 . . . . 75.43 109.299 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 21.6 mtp180 65.06 18.67 11.58 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.442 1.089 . . . . 75.15 110.285 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 159' ' ' ASN . 28.4 mt-30 -45.94 171.82 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.511 1.132 . . . . 74.44 110.291 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 15.7 p80 -86.14 59.24 5.52 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.467 1.104 . . . . 73.53 109.579 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . 0.551 ' HG3' ' CD1' ' A' ' 167' ' ' TYR . 0.8 OUTLIER -107.96 144.06 35.77 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.493 1.121 . . . . 71.44 109.284 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' TYR . . . . . 0.593 ' CE2' ' OD1' ' A' ' 168' ' ' ASN . 16.2 p90 -38.42 -47.59 1.27 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.462 1.101 . . . . 70.52 110.932 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.593 ' OD1' ' CE2' ' A' ' 167' ' ' TYR . 2.0 p-10 -92.67 132.09 37.2 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.533 1.146 . . . . 75.51 109.235 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 169' ' ' SER . . . . . 0.485 ' HB3' ' CD1' ' A' ' 134' ' ' TRP . 13.9 t -124.04 145.13 49.43 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.45 1.093 . . . . 71.24 110.003 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.431 ' CG1' HD11 ' A' ' 137' ' ' LEU . 4.8 t -106.21 123.72 61.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.518 1.136 . . . . 73.41 109.292 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.6 mp -131.37 109.61 14.95 Favored Pre-proline 0 C--N 1.325 -0.474 0 O-C-N 124.452 1.095 . . . . 72.13 109.309 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . 0.511 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.99 110.68 3.16 Favored 'Trans proline' 0 C--N 1.36 1.16 0 O-C-N 124.49 1.784 . . . . 75.41 111.035 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 4.0 ttt -94.83 156.66 16.27 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.455 1.097 . . . . 74.42 110.973 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 17.0 mmt85 -111.9 118.85 45.72 Favored Pre-proline 0 C--N 1.325 -0.458 0 O-C-N 124.528 1.142 . . . . 71.54 110.256 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.95 152.03 40.5 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.502 1.791 . . . . 73.32 110.997 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . 0.609 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.1 OUTLIER -85.26 -44.13 13.14 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.536 1.147 . . . . 71.15 109.353 179.946 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . 0.484 ' ND2' ' CG ' ' A' ' 92' ' ' GLU . 4.9 p30 -71.14 -28.05 64.0 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.524 1.14 . . . . 64.32 109.259 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 178' ' ' ASN . . . . . 0.482 ' OD1' ' CG2' ' A' ' 140' ' ' THR . 1.4 m-80 -110.79 98.58 38.51 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.48 1.113 . . . . 72.22 109.27 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.97 116.36 4.57 Favored 'Trans proline' 0 C--N 1.36 1.133 0 O-C-N 124.556 1.819 . . . . 74.21 111.012 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . 0.466 HD23 ' CB ' ' A' ' 184' ' ' ARG . 0.5 OUTLIER -127.57 96.45 32.92 Favored Pre-proline 0 C--N 1.325 -0.48 0 O-C-N 124.5 1.125 . . . . 75.2 109.312 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.97 171.67 17.87 Favored 'Trans proline' 0 C--N 1.36 1.162 0 O-C-N 124.509 1.794 . . . . 75.21 111.031 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 -60.04 -23.69 63.94 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.48 1.113 . . . . 71.23 110.346 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -68.85 -15.49 63.51 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.443 1.089 . . . . 75.05 110.31 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 184' ' ' ARG . . . . . 0.466 ' CB ' HD23 ' A' ' 180' ' ' LEU . 35.0 mmt180 -111.1 -28.45 8.29 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.462 1.101 . . . . 73.01 110.36 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 185' ' ' THR . . . . . . . . . . . . . 54.1 m -72.86 143.72 84.68 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.407 1.067 . . . . 74.31 110.413 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . 0.44 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -75.01 148.39 35.18 Favored 'Trans proline' 0 C--N 1.36 1.17 0 O-C-N 124.503 1.791 . . . . 72.33 110.977 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 187' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -60.85 -12.4 10.83 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.453 1.096 . . . . 74.3 111.05 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -88.56 -53.93 4.41 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.474 1.109 . . . . 73.33 109.391 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.478 ' HB3' ' CB ' ' A' ' 172' ' ' PRO . 37.1 mt -74.4 -14.91 60.92 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.51 1.131 . . . . 64.43 109.321 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -85.66 -11.4 53.91 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.56 1.163 . . . . 75.33 110.31 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 191' ' ' THR . . . . . . . . . . . . . 21.9 p -113.87 1.47 14.77 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.556 1.16 . . . . 64.11 110.385 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.504 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 3.1 mt -99.37 163.74 2.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.465 1.103 . . . . 73.33 109.299 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 193' ' ' ASN . . . . . 0.49 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 13.5 t-20 -66.65 73.41 0.09 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.539 1.149 . . . . 73.34 109.306 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . 0.511 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -66.69 143.66 56.83 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.592 1.182 . . . . 63.41 109.293 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 195' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.66 129.98 34.77 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.529 1.143 . . . . 72.24 109.266 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -104.88 117.4 33.95 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.531 1.145 . . . . 71.2 110.336 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -101.82 -33.23 9.89 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.533 1.146 . . . . 72.34 110.285 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . 0.469 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -90.0 23.04 2.93 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.527 1.142 . . . . 74.04 110.303 -179.979 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -128.57 147.34 50.7 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.492 1.12 . . . . 75.35 110.009 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.81 -19.5 65.88 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.459 1.099 . . . . 71.43 110.264 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -89.13 21.27 28.71 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 124.448 1.093 . . . . 64.5 110.988 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 202' ' ' PHE . . . . . 0.686 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 5.6 t80 -65.21 -39.32 34.75 Favored Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.509 0.77 . . . . 75.44 110.977 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 203' ' ' PRO . . . . . 0.686 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.05 -38.71 1.45 Allowed 'Trans proline' 0 C--N 1.359 1.116 0 O-C-N 124.505 1.792 . . . . 72.53 110.956 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -50.9 -59.9 3.65 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.483 1.114 . . . . 75.2 110.387 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -59.02 -47.55 84.8 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.484 1.115 . . . . 73.13 110.313 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 206' ' ' VAL . . . . . 0.581 HG13 ' CE1' ' A' ' 104' ' ' PHE . 82.6 t -57.27 -29.69 33.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.463 1.102 . . . . 71.41 109.257 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.08 -35.75 49.02 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.521 1.138 . . . . 74.42 110.365 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 64.8 mtt-85 -81.26 -68.23 0.71 Allowed 'General case' 0 C--N 1.327 -0.412 0 O-C-N 124.459 1.1 . . . . 73.51 110.299 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 209' ' ' ILE . . . . . 0.63 ' CG2' ' CE1' ' A' ' 210' ' ' PHE . 73.3 mt -41.47 -43.32 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.527 1.142 . . . . 64.44 109.313 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 210' ' ' PHE . . . . . 0.63 ' CE1' ' CG2' ' A' ' 209' ' ' ILE . 1.5 m-85 -112.02 66.89 0.64 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.538 1.148 . . . . 73.33 110.962 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -110.65 147.39 34.39 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.537 1.148 . . . . 75.22 110.286 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.449 ' O ' ' N ' ' A' ' 215' ' ' TYR . 27.9 tt0 -49.14 -55.52 12.07 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.537 1.148 . . . . 72.42 110.274 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -48.38 -23.93 1.08 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.437 1.086 . . . . 65.41 109.976 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 13.4 t -95.9 -29.31 3.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.449 1.093 . . . . 74.52 109.28 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 215' ' ' TYR . . . . . 0.449 ' N ' ' O ' ' A' ' 212' ' ' GLU . 17.2 t80 -63.78 -33.89 76.67 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.619 1.199 . . . . 74.13 111.059 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 51.3 mmtt -57.33 -66.32 0.48 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.548 1.155 . . . . 72.43 109.253 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 217' ' ' THR . . . . . 0.517 ' CG2' ' CD1' ' A' ' 221' ' ' ILE . 17.3 m -45.3 -66.56 0.38 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.497 1.123 . . . . 64.01 110.378 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 218' ' ' GLN . . . . . 0.521 ' NE2' ' CD1' ' A' ' 221' ' ' ILE . 2.1 mp0 -42.01 -45.7 3.94 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.473 1.108 . . . . 74.33 110.32 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 219' ' ' GLN . . . . . 0.444 ' O ' ' NE2' ' A' ' 219' ' ' GLN . 18.9 tp60 -62.85 -39.41 94.31 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.504 1.127 . . . . 75.42 110.315 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 220' ' ' THR . . . . . 0.46 ' O ' ' CG ' ' A' ' 224' ' ' GLU . 1.0 OUTLIER -77.66 -17.71 57.44 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.57 1.169 . . . . 74.22 110.418 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 221' ' ' ILE . . . . . 0.521 ' CD1' ' NE2' ' A' ' 218' ' ' GLN . 35.2 mt -83.64 -40.28 15.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.477 1.111 . . . . 64.41 109.301 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 222' ' ' TRP . . . . . 0.496 ' O ' ' CG2' ' A' ' 225' ' ' THR . 27.7 t90 -64.11 -54.98 25.35 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.546 1.153 . . . . 75.12 108.042 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -20.23 52.64 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.485 1.116 . . . . 73.04 109.318 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . 0.46 ' CG ' ' O ' ' A' ' 220' ' ' THR . 79.6 mt-10 -91.97 -26.41 18.41 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.543 1.152 . . . . 74.31 110.302 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 225' ' ' THR . . . . . 0.496 ' CG2' ' O ' ' A' ' 222' ' ' TRP . 5.9 t -63.25 -21.22 66.1 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.542 1.151 . . . . 72.43 110.467 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -76.92 -17.06 59.17 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.428 1.08 . . . . 71.23 110.253 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 227' ' ' ASN . . . . . 0.403 ' O ' ' N ' ' A' ' 231' ' ' ARG . 1.0 OUTLIER -86.81 -42.83 12.97 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.456 1.097 . . . . 74.42 109.295 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 10.7 mtt -58.16 -40.59 81.78 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.518 1.136 . . . . 64.32 110.998 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 229' ' ' VAL . . . . . . . . . . . . . 11.4 p -67.25 -49.44 72.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.504 1.127 . . . . 74.12 109.293 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 230' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -74.76 -4.6 38.51 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.473 1.108 . . . . 73.42 110.29 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 231' ' ' ARG . . . . . 0.403 ' N ' ' O ' ' A' ' 227' ' ' ASN . 16.8 tpp85 -90.99 -81.68 0.31 Allowed 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.472 1.108 . . . . 64.23 110.302 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -143.22 41.84 1.51 Allowed 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.498 1.124 . . . . 73.33 110.267 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -151.25 41.49 0.73 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.46 1.1 . . . . 75.31 111.022 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 5.1 mm -46.66 142.78 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.47 1.106 . . . . 75.02 109.295 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.482 0 O-C-N 124.431 1.082 . . . . 72.15 109.286 179.977 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.958 0 N-CA-C 111.009 -0.837 . . . . 54.42 111.009 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.03 141.28 26.36 Favored 'Trans proline' 0 C--N 1.361 1.221 0 O-C-N 124.457 1.767 . . . . 73.43 110.928 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -48.7 -72.28 0.05 Allowed 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.535 1.147 . . . . 72.2 109.278 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -136.35 106.41 0.56 Allowed Glycine 0 CA--C 1.53 0.981 0 O-C-N 124.486 1.116 . . . . 72.24 111.011 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 87.3 p -134.53 165.62 24.77 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.513 0.772 . . . . 72.34 110.043 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -72.49 154.04 41.05 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.416 1.073 . . . . 75.32 110.313 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.18 141.41 39.96 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.514 1.134 . . . . 74.43 110.312 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.516 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 6.4 p -149.56 157.42 6.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.424 1.078 . . . . 73.55 109.312 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.413 ' O ' ' C ' ' A' ' 79' ' ' LEU . 26.8 m-85 -87.95 23.5 2.04 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.531 1.144 . . . . 74.25 111.034 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.413 ' C ' ' O ' ' A' ' 78' ' ' PHE . 12.5 tp -39.63 155.26 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.52 1.137 . . . . 73.23 109.278 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.739 ' NZ ' ' H ' ' A' ' 107' ' ' LYS . 27.4 ttpt -100.49 -60.61 1.49 Allowed 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.497 1.123 . . . . 75.12 109.312 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.706 ' CZ ' ' CD1' ' A' ' 83' ' ' ILE . 0.2 OUTLIER -156.99 132.83 9.48 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.487 1.117 . . . . 71.13 111.038 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.471 HG23 ' CE ' ' A' ' 115' ' ' MET . 7.2 p -96.8 168.47 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.528 1.142 . . . . 74.04 109.368 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.706 ' CD1' ' CZ ' ' A' ' 81' ' ' PHE . 4.2 mp -130.67 101.32 5.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.529 1.143 . . . . 64.14 109.326 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.456 ' CD1' ' HB2' ' A' ' 128' ' ' ALA . 3.7 mp -75.73 124.28 27.01 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.504 1.127 . . . . 75.25 109.317 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.562 ' CD2' ' HA ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -146.27 174.4 11.37 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.455 1.097 . . . . 72.3 109.614 -179.99 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.44 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -115.82 164.3 14.59 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.508 1.13 . . . . 71.43 109.338 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -57.45 -17.28 12.41 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.532 1.145 . . . . 72.13 110.255 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -78.56 -45.56 21.51 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.536 1.148 . . . . 74.41 109.31 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.449 ' OD2' ' N ' ' A' ' 89' ' ' ASP . 0.9 OUTLIER -121.63 44.14 2.64 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.452 1.095 . . . . 73.42 109.269 -179.973 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.562 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -77.63 -48.24 17.32 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.493 1.12 . . . . 73.42 110.371 -179.958 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -67.84 -19.45 65.05 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.471 1.107 . . . . 63.41 109.332 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.03 -56.93 5.67 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.458 1.099 . . . . 72.43 110.298 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.487 ' CB ' ' CG2' ' A' ' 83' ' ' ILE . . . -68.4 -22.77 64.61 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.527 1.142 . . . . 72.14 109.268 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.5 ' O ' ' CD2' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -82.68 -34.06 27.51 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.552 1.157 . . . . 71.44 109.378 179.927 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -67.3 -34.56 77.63 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.466 1.104 . . . . 73.24 110.274 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.472 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 8.5 p -81.44 -55.29 8.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.554 1.159 . . . . 75.43 109.267 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.472 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -49.5 -20.95 0.82 Allowed 'General case' 0 C--N 1.326 -0.419 0 O-C-N 124.476 1.11 . . . . 74.14 110.35 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.493 ' O ' ' CG ' ' A' ' 101' ' ' GLN . 0.8 OUTLIER -78.94 -36.08 42.24 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.481 1.113 . . . . 74.3 109.287 -179.93 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.551 ' O ' ' CB ' ' A' ' 103' ' ' ASP . 0.0 OUTLIER -85.82 -20.0 29.82 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.52 1.137 . . . . 75.12 109.326 179.965 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.424 ' O ' ' N ' ' A' ' 106' ' ' ILE . 56.7 mt -78.98 -21.99 46.26 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.509 1.131 . . . . 72.24 109.323 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . 0.493 ' CG ' ' O ' ' A' ' 98' ' ' ASN . 0.2 OUTLIER -82.58 -15.15 53.3 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.497 1.123 . . . . 75.32 110.302 -179.99 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.494 ' O ' ' C ' ' A' ' 103' ' ' ASP . 13.3 t70 -116.09 -58.01 2.15 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.548 1.155 . . . . 62.35 109.284 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.551 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 28.1 t0 -32.31 -66.81 0.12 Allowed 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.478 1.111 . . . . 63.41 109.265 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.555 ' CE1' HG11 ' A' ' 206' ' ' VAL . 5.2 m-85 -102.12 -29.66 11.61 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.448 1.093 . . . . 72.03 110.98 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 107' ' ' LYS . . . 109.59 16.67 10.64 Favored Glycine 0 CA--C 1.531 1.054 0 O-C-N 124.526 1.141 . . . . 74.43 110.982 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.573 HG22 ' CE1' ' A' ' 81' ' ' PHE . 36.8 mm -54.45 85.78 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.488 0.757 . . . . 64.44 109.259 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.739 ' H ' ' NZ ' ' A' ' 80' ' ' LYS . 4.5 mtmp? -138.57 154.91 73.72 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.48 1.113 . . . . 71.1 109.292 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.514 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.5 Cg_endo -74.99 128.87 17.23 Favored 'Cis proline' 0 C--N 1.36 1.155 0 C-N-CA 121.041 -2.483 . . . . 73.12 111.034 -0.053 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.486 ' N ' ' HA ' ' A' ' 107' ' ' LYS . . . -105.93 122.91 7.29 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.597 1.186 . . . . 63.12 111.023 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 8.0 tt -144.74 157.38 14.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 O-C-N 124.469 0.746 . . . . 75.03 109.282 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.446 ' CD1' ' NE2' ' A' ' 85' ' ' HIS . 28.7 pt -93.66 -178.54 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.533 1.145 . . . . 73.25 109.373 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.691 ' CE1' ' CB ' ' A' ' 128' ' ' ALA . 0.9 OUTLIER -82.03 -22.76 36.28 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.458 1.099 . . . . 71.4 110.993 179.988 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -88.07 -3.36 58.9 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.499 1.124 . . . . 55.14 109.311 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -107.45 -26.03 11.14 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.53 1.144 . . . . 73.14 110.335 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.471 ' CE ' HG23 ' A' ' 82' ' ' VAL . 3.8 ttm -45.64 138.54 5.22 Favored Pre-proline 0 C--N 1.325 -0.457 0 O-C-N 124.496 1.123 . . . . 73.32 111.046 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.85 118.75 5.4 Favored 'Trans proline' 0 C--N 1.359 1.116 0 O-C-N 124.515 1.797 . . . . 74.11 111.046 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 12.2 m-70 -40.41 158.84 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.5 1.125 . . . . 73.23 109.61 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -166.96 -64.46 0.03 OUTLIER Glycine 0 CA--C 1.529 0.956 0 O-C-N 124.477 1.111 . . . . 74.14 110.997 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -79.75 178.34 8.24 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.446 0.733 . . . . 73.54 110.333 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.422 ' CD ' ' N ' ' A' ' 121' ' ' HIS . 0.9 OUTLIER -61.35 -78.42 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.485 1.116 . . . . 70.35 110.253 -179.926 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . 0.499 ' CG ' ' O ' ' A' ' 121' ' ' HIS . 0.8 OUTLIER -83.18 87.92 6.92 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.495 1.122 . . . . 72.15 109.551 -179.984 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.453 HD22 ' CG ' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -56.3 169.69 0.41 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.484 1.115 . . . . 74.14 109.316 179.939 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.576 ' HA ' ' CE2' ' A' ' 112' ' ' PHE . 31.3 mt-30 57.17 54.71 6.57 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.505 1.128 . . . . 73.12 110.356 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.403 ' O ' ' C ' ' A' ' 125' ' ' LEU . 13.5 t-20 -108.57 127.57 54.06 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.525 1.141 . . . . 71.14 109.32 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.403 ' C ' ' O ' ' A' ' 124' ' ' ASN . 1.0 OUTLIER -40.03 -57.93 1.54 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.539 1.149 . . . . 74.33 109.298 179.979 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -42.67 -61.47 1.23 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.515 1.135 . . . . 73.23 109.32 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.443 ' O ' ' N ' ' A' ' 130' ' ' ASN . 6.5 m-20 -45.89 -63.23 1.02 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.5 1.125 . . . . 75.04 109.246 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.691 ' CB ' ' CE1' ' A' ' 112' ' ' PHE . . . -50.86 -26.79 6.24 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.498 1.124 . . . . 63.11 109.299 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.457 ' CG1' ' O ' ' A' ' 129' ' ' VAL . 99.1 t -94.08 30.87 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.525 1.141 . . . . 74.53 109.253 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.443 ' N ' ' O ' ' A' ' 127' ' ' ASP . 11.2 t-20 -152.55 145.28 24.3 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.547 1.154 . . . . 73.21 109.306 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 64.99 38.51 95.56 Favored Glycine 0 CA--C 1.53 0.997 0 O-C-N 124.423 1.077 . . . . 64.5 111.05 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 50.7 m -151.36 178.79 8.92 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.549 0.793 . . . . 75.4 110.02 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.565 ' HB1' ' CE3' ' A' ' 134' ' ' TRP . . . -112.45 -42.09 3.74 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.573 1.171 . . . . 72.01 109.291 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.575 ' CZ2' ' HA ' ' A' ' 210' ' ' PHE . 14.6 m-90 -141.14 160.76 39.4 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.543 1.152 . . . . 65.22 107.933 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.448 HG21 ' CG1' ' A' ' 82' ' ' VAL . 1.7 p -145.28 125.54 13.84 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.456 1.098 . . . . 74.24 110.317 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.468 ' CG2' HG21 ' A' ' 83' ' ' ILE . 0.8 OUTLIER -84.42 134.89 25.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.488 1.117 . . . . 74.5 109.28 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -117.92 96.81 5.52 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.502 1.127 . . . . 73.44 109.334 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.6 ' O ' ' CD1' ' A' ' 143' ' ' PHE . 0.2 OUTLIER -62.64 104.84 0.57 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.498 1.124 . . . . 74.13 109.274 179.999 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 18.9 mt -78.22 111.56 14.29 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.54 1.15 . . . . 72.33 109.33 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.484 ' O ' ' CB ' ' A' ' 144' ' ' LEU . 9.6 m -139.67 159.46 42.11 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.505 1.128 . . . . 73.04 110.444 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -56.08 -36.51 68.19 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.47 1.106 . . . . 65.1 110.264 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -88.4 -52.04 5.41 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.501 1.126 . . . . 71.55 109.294 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.6 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 10.9 t80 -57.46 -19.8 26.42 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.521 1.138 . . . . 75.14 110.983 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.582 ' CD1' ' CZ ' ' A' ' 145' ' ' ARG . 3.0 tm? -84.93 -52.64 5.86 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.582 1.176 . . . . 72.14 109.333 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.582 ' CZ ' ' CD1' ' A' ' 144' ' ' LEU . 0.0 OUTLIER -55.85 -27.09 49.96 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.436 1.085 . . . . 75.03 110.32 179.967 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -79.13 -63.0 1.52 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.494 1.121 . . . . 74.14 109.279 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.512 HG23 ' CE1' ' A' ' 143' ' ' PHE . 25.5 p -56.9 -61.59 2.34 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.531 1.144 . . . . 72.22 110.33 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 1.4 t-105 -44.52 -41.95 6.82 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.009 -1.108 . . . . 73.23 108.009 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . 0.423 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 7.1 t -63.48 -45.55 90.23 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.484 1.115 . . . . 73.45 108.278 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' A' ' 147' ' ' THR . 0.8 OUTLIER -57.32 -61.68 2.31 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.539 1.149 . . . . 62.44 109.274 -179.915 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.659 ' CE1' ' CD1' ' A' ' 157' ' ' LEU . 8.5 m-30 -39.65 -39.24 0.72 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.524 1.14 . . . . 74.5 110.935 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -56.75 -46.77 81.21 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.511 1.132 . . . . 63.42 110.278 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.491 ' O ' ' CG ' ' A' ' 153' ' ' PHE . 66.8 t80 -99.9 7.55 44.8 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.459 1.1 . . . . 65.33 111.015 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.449 ' N ' ' O ' ' A' ' 150' ' ' ASN . 0.3 OUTLIER -145.92 81.63 1.6 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.509 1.13 . . . . 73.33 111.023 179.953 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 3.9 t -72.1 -5.31 34.45 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.407 1.067 . . . . 72.53 110.409 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' SER . . . . . 0.438 ' HB3' ' CE1' ' A' ' 154' ' ' TYR . 1.1 t -67.42 -31.56 71.85 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.53 1.143 . . . . 64.44 110.022 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.659 ' CD1' ' CE1' ' A' ' 151' ' ' PHE . 3.4 tm? -79.31 -41.82 27.14 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.539 1.149 . . . . 74.3 109.333 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' MET . . . . . . . . . . . . . 13.8 tpp -51.63 -21.98 3.02 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.526 1.141 . . . . 75.23 111.05 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' ASN . . . . . 0.444 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 1.9 m-80 -67.18 -37.39 83.63 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.467 1.105 . . . . 74.03 109.293 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' SER . . . . . 0.418 ' CB ' HG23 ' A' ' 170' ' ' VAL . 0.8 OUTLIER -77.28 -27.56 53.14 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.523 1.139 . . . . 72.43 109.986 179.975 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . 0.401 ' O ' ' NE ' ' A' ' 163' ' ' ARG . 3.5 t -62.44 -18.1 19.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.56 1.163 . . . . 74.31 109.364 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -74.42 -4.39 36.29 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 124.552 1.158 . . . . 63.44 109.296 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.515 ' NH2' ' CD2' ' A' ' 189' ' ' LEU . 5.2 mmt180 58.51 30.97 20.48 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.494 1.121 . . . . 73.32 110.208 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . 0.444 ' NE2' ' O ' ' A' ' 159' ' ' ASN . 22.6 mt-30 -52.45 -174.64 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.483 1.114 . . . . 73.34 110.264 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -110.53 73.13 0.81 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.536 1.147 . . . . 72.4 109.58 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . 0.409 ' C ' ' N ' ' A' ' 168' ' ' ASN . 0.0 OUTLIER -111.8 163.75 13.83 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.496 1.123 . . . . 72.03 109.329 -179.993 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -42.62 -25.91 0.1 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.467 1.105 . . . . 74.41 111.033 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' ASN . . . . . 0.409 ' N ' ' C ' ' A' ' 166' ' ' LYS . 1.5 p-10 -119.3 156.17 30.49 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.54 1.15 . . . . 74.12 109.318 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 169' ' ' SER . . . . . 0.401 ' N ' ' O ' ' A' ' 133' ' ' ALA . 1.2 m -131.54 143.5 50.42 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.577 1.173 . . . . 73.05 109.97 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.464 ' O ' ' CD1' ' A' ' 171' ' ' ILE . 5.1 t -102.91 131.63 50.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.467 1.104 . . . . 73.52 109.333 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . 0.464 ' CD1' ' O ' ' A' ' 170' ' ' VAL . 1.2 mp -140.03 111.09 7.25 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.561 1.163 . . . . 73.0 109.287 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 172' ' ' PRO . . . . . 0.509 ' O ' ' CB ' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.08 106.74 2.33 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.45 1.763 . . . . 73.52 110.983 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 3.1 ttt -90.47 151.83 21.21 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.467 1.105 . . . . 64.32 111.048 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 4.7 tpp85 -110.18 122.04 39.92 Favored Pre-proline 0 C--N 1.324 -0.512 0 O-C-N 124.509 1.131 . . . . 73.04 110.279 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 175' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.04 160.91 39.47 Favored 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.477 1.777 . . . . 73.34 110.992 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . 0.554 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -100.62 -40.55 7.34 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.579 1.175 . . . . 74.11 109.316 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -73.0 -23.6 60.66 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.466 1.104 . . . . 70.44 109.275 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 178' ' ' ASN . . . . . 0.447 ' ND2' ' OD2' ' A' ' 89' ' ' ASP . 2.1 m-80 -110.41 106.7 58.13 Favored Pre-proline 0 C--N 1.325 -0.467 0 O-C-N 124.534 1.146 . . . . 74.32 109.273 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.97 115.12 4.19 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.497 1.788 . . . . 74.41 111.013 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . 0.49 ' CD1' ' OG1' ' A' ' 185' ' ' THR . 1.1 tm? -126.94 96.97 33.45 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 124.454 1.096 . . . . 75.2 109.306 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 165.37 31.42 Favored 'Trans proline' 0 C--N 1.36 1.14 0 O-C-N 124.548 1.815 . . . . 61.41 110.969 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 3.7 ptt180 -55.8 -39.35 71.18 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.474 1.109 . . . . 72.34 110.308 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -55.72 -18.22 7.68 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.481 1.113 . . . . 75.15 110.277 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 184' ' ' ARG . . . . . 0.416 ' CB ' HD23 ' A' ' 180' ' ' LEU . 14.2 mmt180 -104.14 -18.06 14.66 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.488 1.118 . . . . 74.44 110.218 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 185' ' ' THR . . . . . 0.49 ' OG1' ' CD1' ' A' ' 180' ' ' LEU . 42.1 m -91.38 143.99 29.04 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.426 1.079 . . . . 75.51 110.381 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 186' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 185' ' ' THR . 18.4 Cg_endo -75.06 149.0 35.81 Favored 'Trans proline' 0 C--N 1.362 1.239 0 O-C-N 124.453 1.765 . . . . 64.41 110.993 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 187' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -62.82 -11.51 18.48 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.492 1.12 . . . . 61.52 110.994 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -88.57 -53.98 4.39 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.5 1.125 . . . . 74.31 109.36 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.515 ' CD2' ' NH2' ' A' ' 163' ' ' ARG . 40.4 mt -73.04 -18.17 61.36 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.538 1.149 . . . . 74.14 109.299 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 190' ' ' GLN . . . . . 0.473 ' CG ' ' O ' ' A' ' 190' ' ' GLN . 6.9 tt0 -86.0 -1.07 56.99 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.504 1.127 . . . . 62.12 110.289 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 191' ' ' THR . . . . . . . . . . . . . 41.2 p -128.12 22.66 6.13 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.492 1.12 . . . . 75.42 110.411 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.433 ' O ' ' N ' ' A' ' 194' ' ' ALA . 4.2 mt -124.58 157.63 32.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.483 1.115 . . . . 74.42 109.296 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -61.79 82.8 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.513 1.133 . . . . 64.34 109.288 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 194' ' ' ALA . . . . . 0.509 ' CB ' ' O ' ' A' ' 172' ' ' PRO . . . -82.5 152.05 26.22 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.59 1.181 . . . . 71.54 109.29 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 195' ' ' LEU . . . . . 0.457 ' CD2' ' CD1' ' A' ' 209' ' ' ILE . 0.2 OUTLIER -83.86 137.66 33.57 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.475 1.109 . . . . 74.34 109.3 179.979 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -121.47 123.2 41.48 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.514 1.134 . . . . 72.55 110.274 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . 0.498 ' CG ' ' CD2' ' A' ' 176' ' ' LEU . 9.5 tp10 -97.27 -29.61 13.45 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.476 1.11 . . . . 74.52 110.33 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 198' ' ' GLU . . . . . 0.429 ' N ' HD11 ' A' ' 176' ' ' LEU . 4.4 pt-20 -95.19 23.08 6.04 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.436 1.085 . . . . 73.22 110.305 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 2.0 t -122.91 134.37 54.36 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.581 1.176 . . . . 75.52 110.017 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 20.4 ttt180 -54.88 -18.56 5.06 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.497 1.123 . . . . 74.23 110.355 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -91.42 18.77 50.92 Favored Glycine 0 CA--C 1.529 0.964 0 O-C-N 124.504 1.128 . . . . 72.22 111.01 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 202' ' ' PHE . . . . . 0.685 ' N ' ' CD ' ' A' ' 203' ' ' PRO . 7.3 t80 -65.67 -39.43 32.13 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.429 0.723 . . . . 71.31 110.989 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 203' ' ' PRO . . . . . 0.685 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -74.98 -38.67 1.5 Allowed 'Trans proline' 0 C--N 1.361 1.209 0 O-C-N 124.509 1.794 . . . . 74.12 111.012 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -51.61 -62.66 1.49 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.511 1.132 . . . . 74.24 110.415 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 205' ' ' GLN . . . . . 0.454 ' O ' ' N ' ' A' ' 208' ' ' ARG . 7.2 mt-30 -55.63 -58.02 9.54 Favored 'General case' 0 C--N 1.323 -0.549 0 O-C-N 124.476 1.11 . . . . 63.21 110.298 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 206' ' ' VAL . . . . . 0.555 HG11 ' CE1' ' A' ' 104' ' ' PHE . 72.2 t -42.69 -31.2 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.44 1.088 . . . . 71.05 109.318 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -83.03 -41.32 18.8 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.491 1.119 . . . . 71.22 110.323 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . 0.454 ' N ' ' O ' ' A' ' 205' ' ' GLN . 51.1 mtt180 -71.43 -63.23 1.16 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.45 1.094 . . . . 73.11 110.269 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 209' ' ' ILE . . . . . 0.552 ' O ' ' CE2' ' A' ' 134' ' ' TRP . 39.6 mt -48.33 -50.14 12.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.456 1.098 . . . . 75.05 109.287 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 210' ' ' PHE . . . . . 0.575 ' HA ' ' CZ2' ' A' ' 134' ' ' TRP . 0.5 OUTLIER -102.77 65.06 0.89 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.515 1.134 . . . . 75.12 111.004 -179.977 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -110.9 144.8 39.39 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 124.519 1.137 . . . . 61.34 110.286 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.448 ' O ' ' N ' ' A' ' 215' ' ' TYR . 21.6 tt0 -48.84 -54.98 12.98 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.542 1.151 . . . . 74.45 110.286 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 3.4 t -48.34 -25.12 1.44 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.522 1.139 . . . . 72.24 109.983 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 43.2 t -96.28 -27.07 4.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.52 1.137 . . . . 72.04 109.298 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 215' ' ' TYR . . . . . 0.448 ' N ' ' O ' ' A' ' 212' ' ' GLU . 13.5 t80 -67.42 -36.62 81.61 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.484 1.115 . . . . 72.5 110.94 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 14.9 mmtt -52.03 -50.71 60.9 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.498 1.124 . . . . 73.4 109.321 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 18.8 m -58.17 -65.24 0.68 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.484 1.115 . . . . 73.21 110.407 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.12 -22.17 10.4 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.5 1.125 . . . . 73.12 110.316 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 219' ' ' GLN . . . . . 0.42 ' N ' ' O ' ' A' ' 215' ' ' TYR . 47.6 tp60 -84.35 -30.17 25.68 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.482 1.114 . . . . 74.32 110.236 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 220' ' ' THR . . . . . 0.491 ' O ' ' CG ' ' A' ' 224' ' ' GLU . 1.0 OUTLIER -86.64 -22.64 26.05 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.536 1.147 . . . . 73.45 110.379 -179.981 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 221' ' ' ILE . . . . . . . . . . . . . 42.6 mt -74.22 -53.97 15.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 O-C-N 124.424 1.077 . . . . 75.45 109.303 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 222' ' ' TRP . . . . . 0.516 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 14.4 t90 -63.26 -52.03 63.73 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.937 -1.134 . . . . 73.33 107.937 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.98 -20.93 10.23 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.553 1.158 . . . . 74.34 109.335 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 224' ' ' GLU . . . . . 0.491 ' CG ' ' O ' ' A' ' 220' ' ' THR . 8.2 mm-40 -93.26 -29.14 15.83 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.49 1.119 . . . . 73.01 110.267 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 225' ' ' THR . . . . . 0.481 HG23 ' CD1' ' A' ' 222' ' ' TRP . 2.4 t -63.06 -27.54 69.47 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.474 1.109 . . . . 72.24 110.425 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 226' ' ' ARG . . . . . 0.419 ' N ' HG21 ' A' ' 225' ' ' THR . 1.2 mtm180 -73.2 -22.24 60.5 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.533 1.146 . . . . 71.52 110.342 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 227' ' ' ASN . . . . . 0.433 ' O ' ' CD ' ' A' ' 231' ' ' ARG . 0.9 OUTLIER -79.9 -12.95 59.7 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.444 1.09 . . . . 74.25 109.257 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 228' ' ' MET . . . . . 0.427 ' CE ' ' HA ' ' A' ' 225' ' ' THR . 43.5 mtm -85.83 -41.8 14.7 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.453 1.095 . . . . 73.24 110.963 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 229' ' ' VAL . . . . . 0.426 ' O ' ' O ' ' A' ' 233' ' ' PHE . 1.3 m -61.28 -44.95 99.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.451 1.095 . . . . 70.2 109.293 -179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 230' ' ' GLN . . . . . 0.425 ' N ' ' CG2' ' A' ' 229' ' ' VAL . 0.0 OUTLIER -72.0 -46.39 57.41 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.501 1.125 . . . . 73.13 110.327 179.968 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 231' ' ' ARG . . . . . 0.433 ' CD ' ' O ' ' A' ' 227' ' ' ASN . 0.0 OUTLIER -42.4 -85.17 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.486 1.116 . . . . 74.42 110.362 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -152.14 59.85 0.84 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.502 1.126 . . . . 70.43 110.28 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 233' ' ' PHE . . . . . 0.498 ' O ' ' CG1' ' A' ' 234' ' ' ILE . 0.5 OUTLIER -155.85 171.62 19.74 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.544 1.152 . . . . 75.45 110.952 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 234' ' ' ILE . . . . . 0.498 ' CG1' ' O ' ' A' ' 233' ' ' PHE . 9.4 mt -157.21 151.97 7.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.506 1.129 . . . . 60.32 109.328 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.521 0 O-C-N 124.458 1.098 . . . . 75.23 109.35 179.968 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.3 p . . . . . 0 N--CA 1.453 -0.305 0 N-CA-C 109.239 -0.652 . . . . 72.409999999999997 109.239 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.41 ' O ' ' CD2' ' A' ' 78' ' ' PHE . 52.1 p90 -89.23 34.63 0.8 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.547 1.154 . . . . 72.239999999999995 110.981 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.849 HD23 ' N ' ' A' ' 80' ' ' LYS . 4.4 tt -39.99 150.9 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.54 1.15 . . . . 74.329999999999998 109.322 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.849 ' N ' HD23 ' A' ' 79' ' ' LEU . 5.0 mtpt -72.2 -60.68 2.11 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.544 1.153 . . . . 74.310000000000002 109.257 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.66 ' CE1' HD11 ' A' ' 83' ' ' ILE . 0.1 OUTLIER -167.22 152.15 7.23 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.491 1.12 . . . . 73.230000000000004 111.011 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.711 HG11 ' HA ' ' A' ' 128' ' ' ALA . 4.5 p -100.86 163.39 3.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.487 1.117 . . . . 64.140000000000001 109.307 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.791 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.3 mp -125.63 98.6 5.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.515 1.134 . . . . 71.019999999999996 109.316 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 84' ' ' LEU . 4.8 mt -73.11 115.59 12.61 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.52 1.137 . . . . 74.230000000000004 109.304 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.724 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -138.87 174.48 10.48 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.535 1.147 . . . . 70.140000000000001 109.596 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.649 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -109.52 164.04 12.88 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.461 1.101 . . . . 60.450000000000003 109.248 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 87' ' ' GLU . 15.9 tt0 -67.53 -9.57 43.7 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.555 1.159 . . . . 74.109999999999999 110.343 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -84.02 -44.96 13.61 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.431 1.082 . . . . 65.299999999999997 109.254 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -120.85 43.67 2.71 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.473 1.108 . . . . 71.349999999999994 109.299 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.609 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -77.08 -22.6 52.58 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.478 1.111 . . . . 70.200000000000003 110.383 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -82.06 -28.08 32.61 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.568 1.168 . . . . 73.129999999999995 109.357 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -71.14 -56.32 6.34 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.494 1.121 . . . . 72.239999999999995 110.303 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.981 ' HB2' HD22 ' A' ' 138' ' ' LEU . . . -56.04 -33.83 65.33 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.499 1.124 . . . . 73.340000000000003 109.306 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.919 ' HB2' HD13 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -74.05 -45.63 48.32 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.491 1.12 . . . . 72.409999999999997 109.364 179.945 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.747 ' N ' HD13 ' A' ' 94' ' ' LEU . 10.3 tpt180 -48.29 -29.76 4.17 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.52 1.137 . . . . 74.099999999999994 110.308 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.814 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.2 t -81.87 -65.41 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.477 1.111 . . . . 60.399999999999999 109.339 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.476 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -40.11 -27.23 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.547 1.154 . . . . 64.25 110.379 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.452 ' N ' ' O ' ' A' ' 96' ' ' VAL . 1.3 t-20 -71.35 -53.06 15.45 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.483 1.114 . . . . 75.230000000000004 109.362 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.836 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -70.72 -21.73 62.51 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.539 1.149 . . . . 74.140000000000001 109.279 179.947 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.836 ' N ' HD23 ' A' ' 99' ' ' LEU . 22.8 mt -63.72 -51.32 65.51 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.483 1.114 . . . . 74.510000000000005 109.261 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -81.24 51.74 1.67 Allowed 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.494 1.122 . . . . 64.0 110.254 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -171.06 -66.28 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.492 1.12 . . . . 73.129999999999995 109.314 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -47.93 -47.88 32.16 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.417 1.073 . . . . 71.319999999999993 109.249 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 1.032 ' CE2' HG11 ' A' ' 206' ' ' VAL . 1.1 m-85 -115.94 -30.17 6.13 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.445 1.09 . . . . 62.539999999999999 110.982 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.67 45.18 2.75 Favored Glycine 0 CA--C 1.53 1.024 0 O-C-N 124.442 1.089 . . . . 72.25 111.029 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 9.8 mm -85.47 78.69 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.578 0.81 . . . . 70.340000000000003 109.311 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.531 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -124.16 156.02 67.03 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.519 1.137 . . . . 75.409999999999997 109.259 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.531 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.98 156.64 99.9 Favored 'Cis proline' 0 C--N 1.36 1.167 0 C-N-CA 120.945 -2.523 . . . . 74.209999999999994 111.023 -0.123 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -133.27 124.21 3.65 Favored Glycine 0 CA--C 1.531 1.047 0 O-C-N 124.452 1.095 . . . . 74.010000000000005 110.992 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.706 HG22 HD11 ' A' ' 79' ' ' LEU . 1.7 tt -142.32 149.57 19.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.492 0.76 . . . . 74.340000000000003 109.314 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ILE . . . . . 0.919 HD13 ' HB2' ' A' ' 94' ' ' LEU . 33.6 pt -99.61 163.49 2.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.472 1.107 . . . . 63.530000000000001 109.299 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -63.31 -19.09 64.29 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.508 1.13 . . . . 64.109999999999999 110.981 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -89.53 -8.13 53.44 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.519 1.137 . . . . 74.200000000000003 109.284 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -107.04 -20.09 13.42 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.571 1.169 . . . . 72.129999999999995 110.256 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.417 ' HE1' ' CG2' ' A' ' 82' ' ' VAL . 20.9 ttm -60.21 110.83 3.18 Favored Pre-proline 0 C--N 1.325 -0.5 0 O-C-N 124.441 1.088 . . . . 74.239999999999995 110.973 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 C--N 1.36 1.167 0 O-C-N 124.471 1.774 . . . . 42.399999999999999 111.03 179.988 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.695 HD13 ' HG ' ' A' ' 157' ' ' LEU . 4.2 pp . . . . . 0 N--CA 1.454 -0.273 0 N-CA-C 109.268 -0.641 . . . . 61.43 109.268 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.403 ' O ' ' N ' ' A' ' 129' ' ' VAL . 6.1 p-10 -74.5 -41.2 61.1 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.521 1.138 . . . . 72.549999999999997 109.267 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -47.05 -48.41 22.36 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.439 1.087 . . . . 71.200000000000003 109.265 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.711 ' HA ' HG11 ' A' ' 82' ' ' VAL . . . -59.56 -34.48 72.74 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.484 1.115 . . . . 74.010000000000005 109.332 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.732 ' O ' HG12 ' A' ' 129' ' ' VAL . 68.8 t -92.84 30.8 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 O-C-N 124.507 1.129 . . . . 72.430000000000007 109.279 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -133.0 139.27 47.16 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.473 1.108 . . . . 73.540000000000006 109.286 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' GLY . . . . . 0.501 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 37.87 76.7 0.07 OUTLIER Glycine 0 CA--C 1.53 1.03 0 O-C-N 124.537 1.148 . . . . 52.030000000000001 110.982 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' SER . . . . . 0.4 ' O ' ' O ' ' A' ' 167' ' ' TYR . 0.6 OUTLIER -163.64 -175.46 4.17 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.499 0.764 . . . . 64.099999999999994 109.98 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.744 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -110.46 -41.36 4.37 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.566 1.166 . . . . 55.009999999999998 109.292 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.744 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 0.4 OUTLIER -154.54 165.86 35.12 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 107.969 -1.123 . . . . 72.340000000000003 107.969 -179.967 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 135' ' ' THR . . . . . 0.622 HG22 HG12 ' A' ' 82' ' ' VAL . 3.2 p -133.35 129.21 37.16 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.542 1.151 . . . . 74.319999999999993 110.399 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.791 ' HB ' HG23 ' A' ' 83' ' ' ILE . 11.4 mm -84.56 121.87 37.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.506 1.129 . . . . 75.549999999999997 109.288 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.538 HD23 ' C ' ' A' ' 136' ' ' ILE . 6.7 mt -108.29 87.81 2.58 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.479 1.112 . . . . 75.329999999999998 109.311 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.981 HD22 ' HB2' ' A' ' 93' ' ' ALA . 3.5 tp -62.27 88.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.5 1.125 . . . . 44.409999999999997 109.268 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.529 HD13 HG23 ' A' ' 185' ' ' THR . 19.3 mt -61.48 113.7 2.82 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.441 1.088 . . . . 63.200000000000003 109.343 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 140' ' ' THR . . . . . 0.595 HG23 ' ND2' ' A' ' 178' ' ' ASN . 5.7 m -140.32 154.4 46.77 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.525 1.14 . . . . 44.299999999999997 110.412 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 11.2 mp0 -47.34 -39.95 16.11 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.478 1.111 . . . . 51.119999999999997 110.332 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' ASN . . . . . 0.412 ' ND2' ' N ' ' A' ' 143' ' ' PHE . 2.4 p-10 -89.89 -53.6 4.42 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.53 1.144 . . . . 74.209999999999994 109.294 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.649 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 37.3 t80 -48.95 -21.49 0.67 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.486 1.116 . . . . 74.109999999999999 111.038 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.511 ' O ' ' CB ' ' A' ' 148' ' ' TRP . 3.0 tm? -78.49 -67.64 0.72 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.547 1.154 . . . . 74.230000000000004 109.303 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.461 ' CD ' ' N ' ' A' ' 145' ' ' ARG . 0.1 OUTLIER -55.52 -17.48 5.44 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.457 1.098 . . . . 73.519999999999996 110.362 179.934 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -70.19 -73.15 0.17 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.5 1.125 . . . . 72.400000000000006 109.297 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.477 HG23 ' CZ ' ' A' ' 151' ' ' PHE . 0.9 OUTLIER -72.61 -48.11 42.38 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.503 1.127 . . . . 61.219999999999999 110.443 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.541 ' CE3' ' CD2' ' A' ' 151' ' ' PHE . 15.5 t-105 -44.39 -40.26 5.28 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.49 1.118 . . . . 71.409999999999997 108.001 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 149' ' ' CYS . . . . . 0.451 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 15.9 t -66.28 -45.74 79.41 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.483 1.114 . . . . 73.140000000000001 108.274 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 150' ' ' ASN . . . . . 0.468 ' N ' ' O ' ' A' ' 147' ' ' THR . 6.8 t-20 -54.07 -53.92 46.54 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.47 1.106 . . . . 65.340000000000003 109.291 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 1.083 ' CE1' HD12 ' A' ' 157' ' ' LEU . 9.8 m-30 -38.2 -60.26 0.79 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.502 1.126 . . . . 71.209999999999994 111.029 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -45.75 -38.54 7.13 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.474 1.109 . . . . 72.510000000000005 110.291 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.45 ' N ' ' O ' ' A' ' 150' ' ' ASN . 51.8 t80 -82.26 -23.91 35.05 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.435 1.084 . . . . 71.299999999999997 110.989 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.555 ' CD2' ' HB2' ' A' ' 156' ' ' SER . 1.2 t80 -144.57 107.45 4.48 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.472 1.107 . . . . 74.209999999999994 110.949 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.1 t -73.18 -6.26 44.68 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.444 1.09 . . . . 64.109999999999999 110.431 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 156' ' ' SER . . . . . 0.555 ' HB2' ' CD2' ' A' ' 154' ' ' TYR . 22.0 m -51.29 -52.55 44.15 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.434 1.083 . . . . 41.299999999999997 110.01 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 1.083 HD12 ' CE1' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -66.96 -40.26 87.45 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.49 1.119 . . . . 74.239999999999995 109.244 -179.96 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 158' ' ' MET . . . . . 0.632 ' CE ' HG21 ' A' ' 161' ' ' VAL . 2.1 mmt -53.24 -19.55 3.27 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.418 1.074 . . . . 61.130000000000003 110.994 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -75.18 -42.23 56.32 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.474 1.108 . . . . 74.230000000000004 109.326 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 160' ' ' SER . . . . . 0.775 ' O ' HG21 ' A' ' 170' ' ' VAL . 0.3 OUTLIER -64.54 -13.47 52.76 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.51 1.131 . . . . 73.510000000000005 110.023 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 161' ' ' VAL . . . . . 0.638 ' CG1' ' HB1' ' A' ' 188' ' ' ALA . 89.0 t -74.85 -15.96 16.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.508 1.13 . . . . 74.340000000000003 109.311 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 162' ' ' ASN . . . . . 0.932 ' HB3' HE22 ' A' ' 164' ' ' GLN . 0.6 OUTLIER -79.14 2.83 19.5 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.506 1.129 . . . . 73.340000000000003 109.286 -179.965 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.452 ' HD3' ' CG2' ' A' ' 192' ' ' ILE . 14.8 mmm-85 60.37 64.97 1.13 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.42 1.075 . . . . 73.310000000000002 110.29 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 164' ' ' GLN . . . . . 0.932 HE22 ' HB3' ' A' ' 162' ' ' ASN . 1.4 mp0 -65.68 129.15 38.75 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.478 1.112 . . . . 73.239999999999995 110.271 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 165' ' ' HIS . . . . . 0.417 ' O ' ' O ' ' A' ' 166' ' ' LYS . 13.3 m-70 -74.03 -3.91 32.17 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.507 1.129 . . . . 74.209999999999994 109.624 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.417 ' O ' ' O ' ' A' ' 165' ' ' HIS . 5.6 mptt -49.64 178.79 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.501 1.125 . . . . 63.350000000000001 109.334 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 167' ' ' TYR . . . . . 0.743 ' CE2' ' ND2' ' A' ' 168' ' ' ASN . 29.6 p90 -48.22 -47.66 35.52 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.452 1.095 . . . . 72.329999999999998 111.014 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 168' ' ' ASN . . . . . 0.743 ' ND2' ' CE2' ' A' ' 167' ' ' TYR . 9.4 p30 -89.5 146.23 24.76 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.468 1.105 . . . . 70.409999999999997 109.345 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 8.3 t -128.11 169.02 14.56 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.505 1.128 . . . . 72.530000000000001 109.991 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.793 ' C ' HD12 ' A' ' 171' ' ' ILE . 12.7 t -123.0 111.59 30.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 O-C-N 124.463 1.102 . . . . 40.350000000000001 109.336 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.793 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -126.32 97.24 34.72 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.538 1.149 . . . . 73.439999999999998 109.269 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 172' ' ' PRO . . . . . 0.804 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.3 Cg_endo -75.0 106.92 2.37 Favored 'Trans proline' 0 C--N 1.36 1.141 0 O-C-N 124.507 1.793 . . . . 65.420000000000002 110.986 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 173' ' ' MET . . . . . 0.814 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.9 ttt -78.54 156.36 29.26 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.485 1.116 . . . . 73.319999999999993 110.997 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 174' ' ' ARG . . . . . 0.479 ' NH2' ' NH2' ' A' ' 182' ' ' ARG . 59.5 mtt85 -110.13 124.32 33.75 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.545 1.153 . . . . 70.519999999999996 110.327 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 175' ' ' PRO . . . . . 0.719 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -74.95 156.11 43.21 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.505 1.792 . . . . 64.310000000000002 111.008 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 176' ' ' LEU . . . . . 0.892 HD21 ' CD ' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -104.17 -47.0 4.28 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.478 1.111 . . . . 75.319999999999993 109.248 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -72.77 -21.46 61.0 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.496 1.123 . . . . 72.230000000000004 109.314 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 178' ' ' ASN . . . . . 0.595 ' ND2' HG23 ' A' ' 140' ' ' THR . 5.5 t-20 -107.0 109.11 62.93 Favored Pre-proline 0 C--N 1.324 -0.528 0 O-C-N 124.576 1.173 . . . . 74.549999999999997 109.265 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.06 115.34 4.25 Favored 'Trans proline' 0 C--N 1.359 1.11 0 O-C-N 124.518 1.799 . . . . 63.409999999999997 111.007 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.505 ' HA ' HD22 ' A' ' 180' ' ' LEU . 0.6 OUTLIER -138.02 96.9 10.08 Favored Pre-proline 0 C--N 1.326 -0.453 0 O-C-N 124.491 1.119 . . . . 74.239999999999995 109.237 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.97 166.97 28.09 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.461 1.769 . . . . 74.230000000000004 110.969 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 182' ' ' ARG . . . . . 0.479 ' NH2' ' NH2' ' A' ' 174' ' ' ARG . 0.1 OUTLIER -56.98 -31.41 65.01 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.579 1.174 . . . . 74.010000000000005 110.34 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -57.15 -17.0 9.09 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.473 1.108 . . . . 70.530000000000001 110.317 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 184' ' ' ARG . . . . . 0.467 ' HB2' HD13 ' A' ' 180' ' ' LEU . 23.3 mmt85 -109.24 -14.18 14.52 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.49 1.119 . . . . 73.439999999999998 110.299 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 185' ' ' THR . . . . . 0.529 HG23 HD13 ' A' ' 139' ' ' LEU . 86.3 m -89.94 143.19 29.64 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.487 1.117 . . . . 71.239999999999995 110.395 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 186' ' ' PRO . . . . . 0.689 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.5 Cg_endo -74.95 144.54 30.57 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.52 1.8 . . . . 74.450000000000003 110.989 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 187' ' ' PHE . . . . . 0.629 ' O ' HG23 ' A' ' 191' ' ' THR . 22.5 p90 -60.84 -13.0 12.69 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.411 1.069 . . . . 62.109999999999999 110.981 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 188' ' ' ALA . . . . . 0.721 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -86.25 -54.6 4.35 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.553 1.158 . . . . 34.219999999999999 109.26 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.689 HD12 ' CG ' ' A' ' 186' ' ' PRO . 20.2 mt -74.14 -15.46 61.03 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.448 1.092 . . . . 63.210000000000001 109.299 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -84.75 -23.56 29.2 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.468 1.105 . . . . 72.120000000000005 110.248 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 191' ' ' THR . . . . . 0.629 HG23 ' O ' ' A' ' 187' ' ' PHE . 39.8 p -101.9 21.19 15.06 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 124.571 1.169 . . . . 64.319999999999993 110.403 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.721 HD12 ' O ' ' A' ' 188' ' ' ALA . 19.9 mt -124.64 154.69 32.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.492 1.12 . . . . 73.409999999999997 109.248 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -63.76 98.04 0.18 Allowed 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.517 1.136 . . . . 73.530000000000001 109.375 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 194' ' ' ALA . . . . . 0.804 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -92.39 151.77 20.08 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.585 1.178 . . . . 54.409999999999997 109.323 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 195' ' ' LEU . . . . . 0.734 HD23 ' CD1' ' A' ' 209' ' ' ILE . 0.3 OUTLIER -86.8 147.56 25.77 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.495 1.122 . . . . 71.530000000000001 109.316 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 196' ' ' GLU . . . . . 0.485 ' N ' HD13 ' A' ' 195' ' ' LEU . 25.0 mt-10 -143.77 141.02 30.22 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.478 1.111 . . . . 71.439999999999998 110.321 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.892 ' CD ' HD21 ' A' ' 176' ' ' LEU . 2.1 pt-20 -113.19 -17.47 12.35 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.494 1.121 . . . . 71.409999999999997 110.296 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 198' ' ' GLU . . . . . 0.561 ' HB3' HD12 ' A' ' 176' ' ' LEU . 0.0 OUTLIER -92.32 2.58 56.55 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 124.472 1.107 . . . . 62.43 110.363 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 36.3 t -99.16 165.32 11.77 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.499 1.124 . . . . 74.209999999999994 109.959 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 14.8 mtm180 -75.85 -27.48 57.85 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.525 1.141 . . . . 74.439999999999998 110.35 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -95.86 20.28 50.6 Favored Glycine 0 CA--C 1.528 0.892 0 O-C-N 124.537 1.148 . . . . 74.349999999999994 111.029 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 202' ' ' PHE . . . . . 0.781 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.1 OUTLIER -58.21 -43.22 98.1 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.45 0.736 . . . . 72.150000000000006 110.932 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 203' ' ' PRO . . . . . 0.627 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.5 Cg_endo -74.98 -30.32 7.32 Favored 'Trans proline' 0 C--N 1.359 1.108 0 O-C-N 124.529 1.805 . . . . 73.450000000000003 110.984 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.04 -65.56 0.67 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.53 1.144 . . . . 71.340000000000003 110.352 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -52.05 -39.4 59.58 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.481 1.113 . . . . 74.140000000000001 110.28 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 206' ' ' VAL . . . . . 1.032 HG11 ' CE2' ' A' ' 104' ' ' PHE . 47.3 t -60.84 -28.3 42.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.557 1.161 . . . . 52.329999999999998 109.308 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -83.06 -50.32 8.63 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.474 1.109 . . . . 70.310000000000002 110.241 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 208' ' ' ARG . . . . . 0.428 ' N ' ' HD2' ' A' ' 208' ' ' ARG . 9.5 mpt_? -61.18 -64.07 1.08 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.466 1.104 . . . . 70.439999999999998 110.261 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 209' ' ' ILE . . . . . 0.797 HG22 ' CD1' ' A' ' 210' ' ' PHE . 44.9 mt -47.07 -56.44 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 124.501 1.126 . . . . 72.340000000000003 109.263 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 210' ' ' PHE . . . . . 0.797 ' CD1' HG22 ' A' ' 209' ' ' ILE . 2.4 m-85 -101.2 67.58 1.18 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.598 1.186 . . . . 74.329999999999998 110.962 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 211' ' ' GLN . . . . . 0.419 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -110.7 145.33 38.19 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.485 1.115 . . . . 72.219999999999999 110.311 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 212' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' A' ' 215' ' ' TYR . 34.0 tt0 -49.45 -55.07 14.45 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.511 1.132 . . . . 75.420000000000002 110.326 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.94 -23.83 0.88 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.463 1.102 . . . . 65.319999999999993 109.918 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.419 HG23 ' HG2' ' A' ' 211' ' ' GLN . 20.0 t -95.66 -30.56 4.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 O-C-N 124.527 1.142 . . . . 74.439999999999998 109.322 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 215' ' ' TYR . . . . . 0.455 ' N ' ' O ' ' A' ' 212' ' ' GLU . 6.6 t80 -62.12 -25.11 67.55 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.467 1.104 . . . . 75.329999999999998 110.965 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 216' ' ' LYS . . . . . 0.413 ' O ' ' N ' ' A' ' 219' ' ' GLN . 3.9 mmtp -73.73 -61.65 1.77 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.504 1.128 . . . . 52.109999999999999 109.303 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 217' ' ' THR . . . . . 0.754 HG22 HD11 ' A' ' 221' ' ' ILE . 71.4 m -46.93 -48.54 21.39 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.487 1.117 . . . . 72.510000000000005 110.383 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -64.54 -25.08 67.83 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.469 1.106 . . . . 75.319999999999993 110.284 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 219' ' ' GLN . . . . . 0.413 ' N ' ' O ' ' A' ' 216' ' ' LYS . 4.7 tp-100 -83.64 -28.85 28.14 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.494 1.121 . . . . 74.129999999999995 110.256 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 220' ' ' THR . . . . . 0.459 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 3.0 m -85.11 -28.35 25.64 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.568 1.167 . . . . 75.340000000000003 110.426 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 221' ' ' ILE . . . . . 0.754 HD11 HG22 ' A' ' 217' ' ' THR . 46.2 mt -76.54 -32.76 21.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.473 1.108 . . . . 71.340000000000003 109.28 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 222' ' ' TRP . . . . . 0.501 ' CD1' ' HA2' ' A' ' 131' ' ' GLY . 18.2 t90 -74.29 -58.33 3.37 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.523 1.139 . . . . 61.420000000000002 107.989 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 223' ' ' LYS . . . . . 0.459 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -51.26 -22.63 2.84 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.551 1.157 . . . . 70.140000000000001 109.325 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 . . . . . 0 C--N 1.325 -0.47 0 O-C-N 124.528 1.142 . . . . 71.299999999999997 110.3 179.986 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.412 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.4 p . . . . . 0 N--CA 1.453 -0.282 0 N-CA-C 109.285 -0.635 . . . . 65.109999999999999 109.285 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.532 ' O ' ' CD2' ' A' ' 78' ' ' PHE . 10.1 p90 -89.61 28.27 1.34 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.55 1.157 . . . . 70.400000000000006 110.977 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.415 ' C ' ' O ' ' A' ' 78' ' ' PHE . 4.3 tp -39.52 140.59 0.46 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.537 1.148 . . . . 74.049999999999997 109.268 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.488 ' CD ' ' O ' ' A' ' 107' ' ' LYS . 3.2 mtpt -75.99 -64.25 1.13 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.495 1.122 . . . . 72.109999999999999 109.26 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.815 ' CE1' HD11 ' A' ' 83' ' ' ILE . 0.1 OUTLIER -161.54 149.33 15.03 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.457 1.098 . . . . 70.319999999999993 111.001 -179.959 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 1.026 ' CG1' HG22 ' A' ' 135' ' ' THR . 7.7 p -97.81 169.62 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 O-C-N 124.441 1.088 . . . . 70.340000000000003 109.292 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.826 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.0 mp -132.63 92.2 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.49 1.119 . . . . 74.420000000000002 109.267 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.809 HD11 ' CB ' ' A' ' 128' ' ' ALA . 8.2 mt -70.17 117.81 12.2 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.49 1.119 . . . . 64.299999999999997 109.28 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.769 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -140.35 174.6 10.35 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.513 1.133 . . . . 64.439999999999998 109.583 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.772 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -102.78 164.36 11.68 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.52 1.138 . . . . 53.130000000000003 109.235 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.453 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 21.9 tt0 -69.78 -6.78 34.48 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.586 1.179 . . . . 74.109999999999999 110.262 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -89.9 -46.07 8.8 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.435 1.085 . . . . 71.150000000000006 109.252 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -114.57 44.12 1.79 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.409 1.068 . . . . 62.219999999999999 109.28 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.595 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -78.85 -22.99 45.26 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.512 1.132 . . . . 73.040000000000006 110.432 179.948 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -82.51 -30.2 29.97 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.459 1.099 . . . . 71.239999999999995 109.356 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.411 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -70.22 -57.54 4.78 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.478 1.111 . . . . 75.209999999999994 110.226 -179.958 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 1.035 ' HB2' ' CD2' ' A' ' 138' ' ' LEU . . . -55.19 -35.24 64.62 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.508 1.13 . . . . 43.0 109.298 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.853 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -72.4 -44.32 62.65 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.526 1.141 . . . . 33.32 109.335 179.953 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.687 ' N ' HD13 ' A' ' 94' ' ' LEU . 15.2 tpp180 -48.3 -29.49 3.93 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.479 1.112 . . . . 72.019999999999996 110.303 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.595 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.1 t -81.02 -64.62 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.497 1.123 . . . . 73.409999999999997 109.282 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.481 ' HA ' HD12 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -41.04 -26.21 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.512 1.132 . . . . 72.519999999999996 110.309 -179.968 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.458 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.1 t-20 -72.4 -58.09 3.67 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.449 1.093 . . . . 63.450000000000003 109.333 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.849 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -64.92 -22.28 66.97 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.503 1.127 . . . . 73.209999999999994 109.265 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.849 ' N ' HD23 ' A' ' 99' ' ' LEU . 22.2 mt -62.99 -57.3 11.18 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.481 1.113 . . . . 72.349999999999994 109.301 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.46 58.44 1.01 Allowed 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.47 1.106 . . . . 62.25 110.318 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -178.66 -62.99 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.496 1.123 . . . . 74.099999999999994 109.36 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.416 ' HB3' ' CD2' ' A' ' 104' ' ' PHE . 19.9 t0 -51.86 -49.77 62.26 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 62.130000000000003 109.303 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.506 ' CE2' HG11 ' A' ' 206' ' ' VAL . 0.9 OUTLIER -114.47 -26.54 7.9 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.565 1.165 . . . . 74.019999999999996 111.018 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.436 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 93.54 45.63 3.41 Favored Glycine 0 CA--C 1.529 0.957 0 O-C-N 124.476 1.11 . . . . 63.329999999999998 111.017 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 12.1 mm -84.42 69.34 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.442 0.731 . . . . 51.399999999999999 109.252 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.538 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -115.58 156.35 46.21 Favored Pre-proline 0 C--N 1.325 -0.499 0 O-C-N 124.483 1.114 . . . . 73.530000000000001 109.296 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.538 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.5 Cg_endo -74.92 157.96 99.27 Favored 'Cis proline' 0 C--N 1.36 1.181 0 C-N-CA 121.077 -2.468 . . . . 74.450000000000003 110.957 0.073 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -122.86 133.01 8.9 Favored Glycine 0 CA--C 1.532 1.096 0 O-C-N 124.535 1.147 . . . . 41.219999999999999 110.986 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -154.64 135.02 4.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.534 0.785 . . . . 62.310000000000002 109.354 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ILE . . . . . 0.793 HD13 ' HB2' ' A' ' 94' ' ' LEU . 38.2 pt -91.07 176.46 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.449 1.093 . . . . 73.209999999999994 109.292 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.709 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 2.2 t80 -78.71 -19.2 52.96 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.503 1.127 . . . . 74.510000000000005 110.995 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -90.08 -3.59 57.85 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.521 1.138 . . . . 55.0 109.279 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -110.49 -26.41 9.52 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.515 1.134 . . . . 64.120000000000005 110.239 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 6.1 ttm -38.55 111.1 0.6 Allowed Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.525 1.141 . . . . 73.530000000000001 110.991 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 C--N 1.36 1.153 0 O-C-N 124.533 1.807 . . . . 73.209999999999994 111.004 179.988 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.842 HD22 HD12 ' A' ' 157' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.332 0 N-CA-C 109.299 -0.63 . . . . 64.219999999999999 109.299 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.482 ' N ' HD12 ' A' ' 125' ' ' LEU . 7.8 t0 -45.31 -59.23 2.77 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.509 1.13 . . . . 61.200000000000003 109.321 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -44.65 -39.25 4.9 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.536 1.147 . . . . 54.549999999999997 109.285 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.809 ' CB ' HD11 ' A' ' 84' ' ' LEU . . . -50.38 -50.49 51.31 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.504 1.128 . . . . 52.109999999999999 109.297 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.507 ' O ' ' CB ' ' A' ' 168' ' ' ASN . 34.6 m -92.48 31.16 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.438 1.086 . . . . 64.030000000000001 109.218 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -114.08 149.18 35.9 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.492 1.12 . . . . 72.310000000000002 109.254 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 39.66 70.03 0.38 Allowed Glycine 0 CA--C 1.531 1.063 0 O-C-N 124.54 1.15 . . . . 63.020000000000003 110.983 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -163.6 179.77 6.98 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.545 0.791 . . . . 65.430000000000007 110.063 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.764 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -102.49 -43.06 5.75 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.526 1.141 . . . . 73.519999999999996 109.279 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.764 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 0.7 OUTLIER -154.99 169.89 23.03 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.534 1.146 . . . . 73.319999999999993 108.05 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 135' ' ' THR . . . . . 1.026 HG22 ' CG1' ' A' ' 82' ' ' VAL . 1.2 p -137.99 158.32 44.57 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 65.049999999999997 110.374 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.826 ' HB ' HG23 ' A' ' 83' ' ' ILE . 10.5 mm -110.98 142.26 23.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.53 1.144 . . . . 52.030000000000001 109.257 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.802 HD13 ' O ' ' A' ' 136' ' ' ILE . 0.5 OUTLIER -134.69 96.46 3.56 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.462 1.101 . . . . 73.019999999999996 109.31 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 1.035 ' CD2' ' HB2' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.43 96.72 0.08 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.547 1.154 . . . . 73.239999999999995 109.278 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.725 HD11 HD13 ' A' ' 189' ' ' LEU . 0.2 OUTLIER -61.23 102.81 0.24 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.468 1.105 . . . . 52.32 109.291 -179.971 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 140' ' ' THR . . . . . 0.443 ' O ' ' N ' ' A' ' 144' ' ' LEU . 2.6 m -130.47 155.59 46.19 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.446 1.091 . . . . 63.210000000000001 110.397 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -64.42 -36.39 84.0 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.546 1.154 . . . . 63.549999999999997 110.313 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -84.1 -25.93 29.35 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.469 1.106 . . . . 72.200000000000003 109.366 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.772 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 52.9 t80 -85.67 -19.93 30.17 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.479 1.112 . . . . 60.229999999999997 111.06 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.707 HD13 ' C ' ' A' ' 144' ' ' LEU . 2.0 tm? -66.23 -67.23 0.46 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.495 1.122 . . . . 64.239999999999995 109.299 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.45 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 22.4 mmt180 -55.17 -19.69 8.49 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.481 1.113 . . . . 73.129999999999995 110.355 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -71.96 -67.2 0.55 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.475 1.11 . . . . 74.030000000000001 109.318 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.478 HG21 ' CE1' ' A' ' 143' ' ' PHE . 3.1 p -66.84 -54.62 20.54 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.542 1.151 . . . . 75.120000000000005 110.4 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.519 ' CZ3' ' HE3' ' A' ' 158' ' ' MET . 3.3 t-105 -43.08 -36.54 1.67 Allowed 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.518 1.136 . . . . 75.109999999999999 108.029 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 149' ' ' CYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 43.7 t -78.64 -45.33 21.77 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.61 1.194 . . . . 74.120000000000005 108.354 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 150' ' ' ASN . . . . . 0.453 ' N ' ' O ' ' A' ' 147' ' ' THR . 0.1 OUTLIER -56.51 -21.83 28.7 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.432 1.082 . . . . 72.5 109.319 179.946 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.771 ' HE1' HD13 ' A' ' 157' ' ' LEU . 10.7 m-30 -77.06 -51.78 10.46 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.558 1.161 . . . . 75.140000000000001 111.027 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 38.6 tt0 -42.46 -40.9 2.74 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.475 1.109 . . . . 71.109999999999999 110.3 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -88.81 -23.63 22.8 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.465 1.103 . . . . 74.450000000000003 110.924 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.564 ' CE2' ' HB2' ' A' ' 156' ' ' SER . 6.8 t80 -135.17 87.91 2.37 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.481 1.113 . . . . 71.400000000000006 111.116 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.84 -4.65 29.19 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.525 1.141 . . . . 75.420000000000002 110.416 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 156' ' ' SER . . . . . 0.564 ' HB2' ' CE2' ' A' ' 154' ' ' TYR . 0.7 OUTLIER -54.68 -34.39 62.23 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.521 1.138 . . . . 65.340000000000003 109.994 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.842 HD12 HD22 ' A' ' 125' ' ' LEU . 0.9 OUTLIER -83.06 -31.43 27.37 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.49 1.119 . . . . 74.040000000000006 109.242 -179.967 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 158' ' ' MET . . . . . 0.9 ' O ' HG22 ' A' ' 161' ' ' VAL . 3.5 mmt -58.94 -37.42 76.68 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.493 1.121 . . . . 72.200000000000003 110.956 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -84.11 -9.62 58.44 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.453 1.095 . . . . 72.439999999999998 109.359 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 160' ' ' SER . . . . . 0.921 ' HB3' HG21 ' A' ' 170' ' ' VAL . 0.3 OUTLIER -82.8 -31.37 28.21 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.43 1.082 . . . . 73.409999999999997 110.037 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 161' ' ' VAL . . . . . 0.9 HG22 ' O ' ' A' ' 158' ' ' MET . 29.8 m -62.18 -18.04 19.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 124.45 1.094 . . . . 61.399999999999999 109.248 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 42.0 m-20 -78.8 0.59 26.37 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.558 1.161 . . . . 62.350000000000001 109.234 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.724 ' NE ' HG23 ' A' ' 192' ' ' ILE . 0.0 OUTLIER 50.55 49.96 19.8 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.478 1.111 . . . . 43.310000000000002 110.281 179.974 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -50.63 -177.98 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.497 1.123 . . . . 65.519999999999996 110.312 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 22.1 p80 -93.26 39.58 1.05 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.548 1.155 . . . . 64.109999999999999 109.572 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.562 ' C ' HG21 ' A' ' 221' ' ' ILE . 2.7 tptt -94.71 179.33 5.29 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.536 1.147 . . . . 74.0 109.317 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 167' ' ' TYR . . . . . . . . . . . . . 24.4 p90 -84.95 44.27 1.06 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.489 1.118 . . . . 72.019999999999996 110.979 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 168' ' ' ASN . . . . . 0.507 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 19.5 p30 -170.51 142.31 2.06 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 62.340000000000003 109.352 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.481 ' O ' ' N ' ' A' ' 135' ' ' THR . 1.4 t -128.14 128.4 44.77 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.555 1.159 . . . . 54.43 109.982 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.921 HG21 ' HB3' ' A' ' 160' ' ' SER . 8.9 t -95.59 107.18 19.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.507 1.129 . . . . 71.310000000000002 109.319 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.662 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -121.48 106.31 37.92 Favored Pre-proline 0 C--N 1.324 -0.512 0 O-C-N 124.511 1.132 . . . . 71.540000000000006 109.338 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 172' ' ' PRO . . . . . 0.884 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -74.98 116.24 4.53 Favored 'Trans proline' 0 C--N 1.359 1.118 0 O-C-N 124.52 1.8 . . . . 60.140000000000001 111.016 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 173' ' ' MET . . . . . 0.667 ' CE ' HD12 ' A' ' 195' ' ' LEU . 3.6 ttt -92.46 152.46 19.67 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.492 1.12 . . . . 74.109999999999999 110.997 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 174' ' ' ARG . . . . . 0.44 ' N ' ' HG2' ' A' ' 173' ' ' MET . 3.6 tpp180 -104.78 116.81 60.27 Favored Pre-proline 0 C--N 1.325 -0.47 0 O-C-N 124.52 1.138 . . . . 61.350000000000001 110.301 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 175' ' ' PRO . . . . . 0.469 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.1 Cg_endo -75.05 153.85 41.84 Favored 'Trans proline' 0 C--N 1.36 1.183 0 O-C-N 124.47 1.774 . . . . 72.200000000000003 110.999 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 176' ' ' LEU . . . . . 0.901 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -87.31 -43.79 11.9 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.463 1.102 . . . . 43.539999999999999 109.307 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -71.81 -27.21 62.77 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.51 1.131 . . . . 74.239999999999995 109.284 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 178' ' ' ASN . . . . . 0.469 ' CB ' ' HG2' ' A' ' 175' ' ' PRO . 7.1 m-80 -110.85 97.86 35.63 Favored Pre-proline 0 C--N 1.326 -0.445 0 O-C-N 124.435 1.085 . . . . 61.130000000000003 109.307 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.95 121.38 6.56 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.562 1.822 . . . . 74.400000000000006 111.081 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.519 HD13 ' HB2' ' A' ' 184' ' ' ARG . 0.4 OUTLIER -128.9 96.49 29.15 Favored Pre-proline 0 C--N 1.324 -0.527 0 O-C-N 124.575 1.172 . . . . 64.420000000000002 109.327 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.04 171.54 18.12 Favored 'Trans proline' 0 C--N 1.359 1.124 0 O-C-N 124.554 1.818 . . . . 73.049999999999997 110.971 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 7.6 ptp85 -59.66 -23.41 63.03 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.531 1.145 . . . . 71.439999999999998 110.278 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 183' ' ' GLU . . . . . 0.414 ' HG2' ' N ' ' A' ' 184' ' ' ARG . 2.7 pt-20 -70.05 -29.23 66.2 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.459 1.099 . . . . 60.350000000000001 110.337 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 184' ' ' ARG . . . . . 0.519 ' HB2' HD13 ' A' ' 180' ' ' LEU . 27.7 mmt180 -95.41 -18.74 20.47 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.542 1.151 . . . . 74.019999999999996 110.31 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 185' ' ' THR . . . . . 0.499 HG22 ' HD2' ' A' ' 186' ' ' PRO . 19.9 m -80.9 143.95 54.5 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.516 1.135 . . . . 75.329999999999998 110.381 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 186' ' ' PRO . . . . . 0.737 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.1 Cg_endo -75.08 155.61 42.55 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.475 1.776 . . . . 72.209999999999994 110.927 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 187' ' ' PHE . . . . . 0.503 ' O ' ' CG2' ' A' ' 191' ' ' THR . 9.2 p90 -69.4 -7.1 34.62 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.513 1.133 . . . . 72.299999999999997 111.04 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 188' ' ' ALA . . . . . 0.627 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -93.97 -53.14 4.11 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.523 1.139 . . . . 74.030000000000001 109.3 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.863 HD22 ' HG3' ' A' ' 172' ' ' PRO . 53.2 mt -68.3 -42.4 79.52 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.424 1.078 . . . . 74.209999999999994 109.281 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 190' ' ' GLN . . . . . 0.411 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 6.9 pt20 -63.82 -10.96 23.12 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.512 1.132 . . . . 74.219999999999999 110.327 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 191' ' ' THR . . . . . 0.503 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 36.2 p -113.6 18.31 17.66 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.429 1.08 . . . . 75.030000000000001 110.393 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.738 HD13 ' O ' ' A' ' 161' ' ' VAL . 4.9 mt -136.37 142.46 38.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.462 1.101 . . . . 73.0 109.265 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -48.23 124.31 7.64 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.515 1.135 . . . . 70.540000000000006 109.319 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 194' ' ' ALA . . . . . 0.884 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -121.09 155.05 35.28 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.463 1.102 . . . . 70.230000000000004 109.311 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 195' ' ' LEU . . . . . 0.707 HD23 HD12 ' A' ' 209' ' ' ILE . 0.3 OUTLIER -82.27 134.22 35.27 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.538 1.149 . . . . 74.209999999999994 109.278 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 196' ' ' GLU . . . . . 0.412 ' O ' ' HA ' ' A' ' 202' ' ' PHE . 31.0 mt-10 -112.72 131.47 55.65 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.455 1.097 . . . . 72.409999999999997 110.259 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.901 ' HG3' HD21 ' A' ' 176' ' ' LEU . 3.8 tp10 -113.42 -25.37 8.83 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.491 1.119 . . . . 61.439999999999998 110.369 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -96.98 3.95 51.77 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.515 1.135 . . . . 54.219999999999999 110.299 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 19.5 t -97.26 174.27 6.8 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.545 1.153 . . . . 64.019999999999996 109.966 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -83.47 -32.89 25.77 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.54 1.15 . . . . 75.120000000000005 110.253 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -87.71 19.34 33.67 Favored Glycine 0 CA--C 1.529 0.941 0 O-C-N 124.568 1.167 . . . . 71.420000000000002 111.034 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 202' ' ' PHE . . . . . 0.819 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.1 OUTLIER -56.8 -43.42 99.36 Favored Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.454 0.738 . . . . 72.420000000000002 110.98 -179.971 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 203' ' ' PRO . . . . . 0.615 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.0 Cg_endo -75.02 -28.91 8.73 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.486 1.782 . . . . 63.210000000000001 110.964 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 204' ' ' THR . . . . . 0.402 HG22 ' N ' ' A' ' 205' ' ' GLN . 0.9 OUTLIER -64.69 -65.1 0.72 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.449 1.093 . . . . 60.340000000000003 110.405 179.987 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 205' ' ' GLN . . . . . 0.402 ' N ' HG22 ' A' ' 204' ' ' THR . 5.8 mt-30 -50.38 -44.31 54.78 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.458 1.099 . . . . 61.409999999999997 110.318 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 206' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 202' ' ' PHE . 72.5 t -56.2 -29.44 27.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.453 1.096 . . . . 70.519999999999996 109.363 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -82.8 -51.54 7.57 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.517 1.136 . . . . 52.020000000000003 110.297 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 208' ' ' ARG . . . . . 0.42 ' N ' ' HD2' ' A' ' 208' ' ' ARG . 11.6 mpt_? -58.21 -62.52 1.77 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.543 1.152 . . . . 73.230000000000004 110.377 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 209' ' ' ILE . . . . . 0.707 HD12 HD23 ' A' ' 195' ' ' LEU . 84.6 mt -49.85 -51.29 16.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.516 1.135 . . . . 72.420000000000002 109.306 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 210' ' ' PHE . . . . . 0.685 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.2 m-85 -101.49 61.71 0.92 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.494 1.121 . . . . 73.230000000000004 111.016 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 211' ' ' GLN . . . . . 0.544 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -110.94 145.85 37.62 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.507 1.13 . . . . 73.019999999999996 110.334 180.0 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 212' ' ' GLU . . . . . 0.452 ' O ' ' N ' ' A' ' 215' ' ' TYR . 32.4 tt0 -49.43 -55.02 14.55 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.506 1.129 . . . . 73.420000000000002 110.306 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.04 -23.59 1.24 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.495 1.122 . . . . 74.450000000000003 110.083 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.544 HG23 ' HG2' ' A' ' 211' ' ' GLN . 38.9 t -96.22 -27.49 4.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.538 1.149 . . . . 70.519999999999996 109.321 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 215' ' ' TYR . . . . . 0.452 ' N ' ' O ' ' A' ' 212' ' ' GLU . 3.4 t80 -63.87 -28.72 70.04 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.495 1.122 . . . . 74.209999999999994 111.01 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 216' ' ' LYS . . . . . 0.439 ' O ' ' N ' ' A' ' 220' ' ' THR . 64.2 mmtt -60.0 -65.28 0.71 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.547 1.154 . . . . 73.510000000000005 109.352 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 217' ' ' THR . . . . . 0.797 HG22 HD11 ' A' ' 221' ' ' ILE . 34.7 m -40.58 -62.94 0.7 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.546 1.154 . . . . 73.430000000000007 110.398 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 218' ' ' GLN . . . . . 0.533 ' HA ' HD12 ' A' ' 221' ' ' ILE . 93.4 mm-40 -50.15 -63.31 1.15 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.52 1.137 . . . . 70.239999999999995 110.342 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -52.99 -20.2 3.24 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.561 1.163 . . . . 74.120000000000005 110.274 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 220' ' ' THR . . . . . 0.439 ' N ' ' O ' ' A' ' 216' ' ' LYS . 0.9 OUTLIER -87.49 -29.69 21.18 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.476 1.11 . . . . 74.439999999999998 110.435 -179.939 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 221' ' ' ILE . . . . . 0.797 HD11 HG22 ' A' ' 217' ' ' THR . 10.0 mt -78.86 -35.24 17.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.485 1.116 . . . . 71.109999999999999 109.305 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 222' ' ' TRP . . . . . 0.412 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 25.1 t90 -69.91 -55.0 10.86 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.492 1.12 . . . . 74.049999999999997 108.047 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -22.03 55.9 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.467 1.104 . . . . 75.239999999999995 109.356 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 224' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 220' ' ' THR . 67.9 mt-10 . . . . . 0 C--N 1.325 -0.485 0 O-C-N 124.539 1.149 . . . . 55.020000000000003 110.354 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.512 HG22 ' N ' ' A' ' 78' ' ' PHE . 3.3 p . . . . . 0 N--CA 1.453 -0.29 0 N-CA-C 109.334 -0.617 . . . . 65.129999999999995 109.334 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.512 ' N ' HG22 ' A' ' 77' ' ' VAL . 2.3 t80 -88.87 24.29 2.1 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.535 1.147 . . . . 74.200000000000003 111.046 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.794 HD11 HG22 ' A' ' 110' ' ' ILE . 3.6 tp -40.35 159.33 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.464 1.102 . . . . 75.329999999999998 109.302 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.657 ' HD3' HG22 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -106.24 -49.42 3.36 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.47 1.106 . . . . 73.239999999999995 109.292 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.597 ' CD1' ' O ' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -167.07 132.26 2.07 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.513 1.133 . . . . 74.540000000000006 110.968 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.52 ' CG2' ' CE ' ' A' ' 115' ' ' MET . 3.1 p -90.14 158.17 2.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.487 1.117 . . . . 42.520000000000003 109.293 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.767 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.0 mp -113.56 94.58 3.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 O-C-N 124.46 1.1 . . . . 52.32 109.276 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.06 HD11 ' HB3' ' A' ' 128' ' ' ALA . 5.0 mt -70.25 118.03 12.56 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.523 1.14 . . . . 72.400000000000006 109.362 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.6 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -136.62 173.74 11.38 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.532 1.145 . . . . 53.329999999999998 109.566 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -111.19 163.66 13.68 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.458 1.099 . . . . 72.109999999999999 109.291 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.415 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 10.3 tt0 -65.46 -10.7 36.45 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.562 1.164 . . . . 72.010000000000005 110.36 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -85.38 -44.89 12.39 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.501 1.126 . . . . 62.420000000000002 109.311 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.447 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.6 OUTLIER -119.31 43.3 2.64 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.525 1.14 . . . . 73.349999999999994 109.364 179.945 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.457 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -71.84 -42.92 66.36 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.51 1.131 . . . . 71.340000000000003 110.358 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -64.49 -40.23 95.28 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.46 1.1 . . . . 62.229999999999997 109.277 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.408 ' CD ' ' C ' ' A' ' 92' ' ' GLU . 0.5 OUTLIER -53.28 -69.72 0.11 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.527 1.142 . . . . 75.239999999999995 110.298 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.699 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -43.03 -32.14 0.63 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.565 1.166 . . . . 51.530000000000001 109.329 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.659 ' HG ' HD13 ' A' ' 111' ' ' ILE . 0.8 OUTLIER -67.5 -57.25 6.84 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.468 1.105 . . . . 52.530000000000001 109.27 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.11 -35.25 0.54 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.594 1.183 . . . . 73.019999999999996 110.355 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.653 HG21 ' HE1' ' A' ' 173' ' ' MET . 0.9 OUTLIER -79.31 -65.82 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 O-C-N 124.466 1.104 . . . . 64.510000000000005 109.307 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.814 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -42.21 -24.78 0.06 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.515 1.135 . . . . 74.040000000000006 110.329 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.448 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.2 OUTLIER -74.32 -59.06 2.9 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.561 1.163 . . . . 74.019999999999996 109.306 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.873 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -62.47 -22.58 66.34 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.421 1.076 . . . . 63.509999999999998 109.271 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.873 ' N ' HD23 ' A' ' 99' ' ' LEU . 39.0 mt -73.65 -39.21 64.64 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.533 1.146 . . . . 55.299999999999997 109.311 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLN . . . . . 0.464 ' HB2' ' CD ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -87.84 46.77 1.42 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.579 1.174 . . . . 63.5 110.318 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -175.8 -60.39 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.543 1.152 . . . . 51.100000000000001 109.253 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.509 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 49.0 t0 -40.45 -63.17 0.67 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.541 1.15 . . . . 73.150000000000006 109.324 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.939 ' CE2' HG11 ' A' ' 206' ' ' VAL . 4.9 m-85 -103.02 -14.62 16.38 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.465 1.103 . . . . 73.430000000000007 111.017 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.82 39.23 7.14 Favored Glycine 0 CA--C 1.53 1.009 0 O-C-N 124.514 1.134 . . . . 61.020000000000003 110.952 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.657 HG22 ' HD3' ' A' ' 80' ' ' LYS . 11.0 mm -75.57 72.21 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 O-C-N 124.516 0.774 . . . . 63.130000000000003 109.349 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.55 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -118.38 151.79 49.99 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.476 1.11 . . . . 74.040000000000006 109.363 179.996 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.55 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.0 147.46 89.33 Favored 'Cis proline' 0 C--N 1.36 1.169 0 C-N-CA 121.01 -2.496 . . . . 73.420000000000002 110.977 0.023 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -124.34 135.04 9.4 Favored Glycine 0 CA--C 1.531 1.068 0 O-C-N 124.431 1.082 . . . . 72.109999999999999 110.942 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.794 HG22 HD11 ' A' ' 79' ' ' LEU . 9.9 tt -156.94 153.94 6.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.499 0.764 . . . . 75.340000000000003 109.332 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ILE . . . . . 0.814 HG23 ' HG2' ' A' ' 97' ' ' GLN . 8.7 pt -95.98 -177.06 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.549 1.156 . . . . 65.430000000000007 109.319 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.606 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 5.4 t80 -80.92 -19.08 45.06 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.54 1.15 . . . . 62.43 110.959 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.441 ' HB2' ' HE1' ' A' ' 85' ' ' HIS . . . -91.6 -12.87 33.05 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.496 1.122 . . . . 42.140000000000001 109.294 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.419 ' C ' HD11 ' A' ' 110' ' ' ILE . 37.6 mm-40 -97.62 -24.53 15.49 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.475 1.109 . . . . 72.219999999999999 110.324 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.52 ' CE ' ' CG2' ' A' ' 82' ' ' VAL . 7.4 ttm -46.03 143.93 3.2 Favored Pre-proline 0 C--N 1.324 -0.511 0 O-C-N 124.421 1.076 . . . . 62.119999999999997 111.007 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.473 ' HD2' ' CG ' ' A' ' 115' ' ' MET . 18.0 Cg_endo . . . . . 0 C--N 1.36 1.157 0 O-C-N 124.527 1.804 . . . . 70.030000000000001 110.95 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.54 HD12 ' N ' ' A' ' 126' ' ' ASP . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.331 0 N-CA-C 109.323 -0.621 . . . . 60.420000000000002 109.323 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.54 ' N ' HD12 ' A' ' 125' ' ' LEU . 3.9 p-10 -67.86 -15.36 63.58 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.462 1.101 . . . . 71.439999999999998 109.284 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.407 ' O ' ' ND2' ' A' ' 130' ' ' ASN . 66.7 m-20 -62.3 -27.6 69.15 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.536 1.148 . . . . 74.150000000000006 109.402 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 1.06 ' HB3' HD11 ' A' ' 84' ' ' LEU . . . -93.14 -13.12 28.85 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.495 1.122 . . . . 75.239999999999995 109.352 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.728 ' O ' HG12 ' A' ' 129' ' ' VAL . 71.1 t -92.86 30.44 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 124.593 1.183 . . . . 74.049999999999997 109.247 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ASN . . . . . 0.407 ' ND2' ' O ' ' A' ' 127' ' ' ASP . 28.3 p30 -135.81 151.18 49.81 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.553 1.158 . . . . 74.530000000000001 109.306 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 42.87 64.53 1.64 Allowed Glycine 0 CA--C 1.53 0.972 0 O-C-N 124.582 1.176 . . . . 64.129999999999995 111.005 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -163.61 -174.29 3.64 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.48 0.753 . . . . 54.329999999999998 109.96 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.608 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -113.71 -35.91 5.04 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.539 1.149 . . . . 71.439999999999998 109.302 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.687 ' HB3' HD13 ' A' ' 171' ' ' ILE . 0.6 OUTLIER -159.07 163.58 36.15 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.556 1.16 . . . . 73.5 108.039 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 28.4 p -131.42 135.47 47.19 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.532 1.145 . . . . 64.25 110.383 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.767 ' HB ' HG23 ' A' ' 83' ' ' ILE . 36.4 mm -84.31 136.99 21.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.485 1.116 . . . . 64.030000000000001 109.314 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.717 HD23 ' O ' ' A' ' 136' ' ' ILE . 21.2 mt -129.7 99.08 5.01 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.582 1.176 . . . . 51.219999999999999 109.338 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.699 HD21 ' HB2' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.26 88.19 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.573 1.171 . . . . 64.409999999999997 109.295 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 18.6 mt -56.93 99.19 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.495 1.122 . . . . 71.439999999999998 109.322 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' THR . . . . . 0.612 HG23 ' OD1' ' A' ' 178' ' ' ASN . 10.1 m -124.03 177.31 5.86 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.531 1.144 . . . . 72.439999999999998 110.458 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' GLU . . . . . 0.567 ' H ' HG22 ' A' ' 140' ' ' THR . 18.9 mt-10 -80.32 -33.7 37.31 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.435 1.085 . . . . 74.25 110.23 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -89.58 -20.84 23.26 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.492 1.12 . . . . 60.340000000000003 109.334 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.478 ' CZ ' HG21 ' A' ' 147' ' ' THR . 19.6 t80 -89.8 -46.34 8.65 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.554 1.159 . . . . 71.400000000000006 111.078 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.761 HD13 ' C ' ' A' ' 144' ' ' LEU . 1.5 tm? -46.88 -61.08 2.02 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.469 1.106 . . . . 71.450000000000003 109.242 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 9.9 mmt85 -60.59 -20.69 61.28 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.488 1.117 . . . . 72.409999999999997 110.27 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -71.89 -66.43 0.64 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.568 1.167 . . . . 71.219999999999999 109.26 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.478 HG21 ' CZ ' ' A' ' 143' ' ' PHE . 16.5 p -69.37 -54.52 14.03 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.457 1.098 . . . . 72.439999999999998 110.38 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.471 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 24.1 t-105 -42.17 -38.05 1.62 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.962 -1.125 . . . . 72.439999999999998 107.962 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 149' ' ' CYS . . . . . 0.446 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 53.3 t -79.02 -45.33 20.42 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.524 1.14 . . . . 71.120000000000005 108.295 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 150' ' ' ASN . . . . . 0.439 ' N ' ' O ' ' A' ' 147' ' ' THR . 3.0 t30 -57.91 -17.78 18.88 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.484 1.115 . . . . 65.150000000000006 109.306 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.561 ' HD2' ' HE3' ' A' ' 158' ' ' MET . 9.7 m-30 -83.06 -46.35 12.93 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 75.409999999999997 111.004 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -49.21 -33.51 12.67 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.48 1.113 . . . . 65.239999999999995 110.287 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -97.29 -19.83 18.28 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.45 1.094 . . . . 75.120000000000005 111.023 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.48 ' CE1' ' HB2' ' A' ' 156' ' ' SER . 0.4 OUTLIER -128.59 94.94 3.99 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.535 1.147 . . . . 74.400000000000006 111.006 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.401 ' O ' ' N ' ' A' ' 158' ' ' MET . 3.5 t -64.53 -21.23 66.63 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.526 1.141 . . . . 75.150000000000006 110.355 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 156' ' ' SER . . . . . 0.48 ' HB2' ' CE1' ' A' ' 154' ' ' TYR . 18.8 t -40.13 -48.16 2.46 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.503 1.127 . . . . 63.310000000000002 109.997 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.445 HD21 HD13 ' A' ' 125' ' ' LEU . 0.5 OUTLIER -70.29 -42.95 71.38 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.519 1.137 . . . . 72.430000000000007 109.323 179.97 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 158' ' ' MET . . . . . 0.607 ' HE1' HG21 ' A' ' 161' ' ' VAL . 24.9 mmt -55.2 -20.71 11.32 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.55 1.156 . . . . 72.409999999999997 110.982 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -86.3 -30.78 22.0 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.623 1.202 . . . . 73.510000000000005 109.275 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 160' ' ' SER . . . . . 0.583 ' HB2' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -82.22 -17.48 45.93 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.518 1.136 . . . . 75.430000000000007 110.026 179.973 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 161' ' ' VAL . . . . . 0.607 HG21 ' HE1' ' A' ' 158' ' ' MET . 6.6 t -61.85 -30.6 48.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.48 1.113 . . . . 31.399999999999999 109.297 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 162' ' ' ASN . . . . . 0.482 ' O ' ' C ' ' A' ' 163' ' ' ARG . 15.5 t-20 -82.41 4.53 23.73 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.59 1.181 . . . . 75.120000000000005 109.263 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.482 ' C ' ' O ' ' A' ' 162' ' ' ASN . 0.0 OUTLIER 32.42 49.77 0.16 Allowed 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.498 1.124 . . . . 75.140000000000001 110.289 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -52.37 -173.74 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.508 1.13 . . . . 72.019999999999996 110.292 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -84.18 60.74 6.11 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.504 1.127 . . . . 72.140000000000001 109.528 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.49 ' HG3' ' CD1' ' A' ' 167' ' ' TYR . 0.1 OUTLIER -121.51 157.66 30.17 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.544 1.152 . . . . 74.310000000000002 109.28 179.976 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 167' ' ' TYR . . . . . 0.565 ' CD2' ' N ' ' A' ' 168' ' ' ASN . 52.1 p90 -54.65 -47.17 73.87 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.54 1.15 . . . . 74.329999999999998 110.999 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 168' ' ' ASN . . . . . 0.565 ' N ' ' CD2' ' A' ' 167' ' ' TYR . 12.7 p30 -87.07 126.18 34.6 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.439 1.087 . . . . 71.420000000000002 109.279 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.416 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 3.1 t -121.86 176.91 5.51 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.494 1.121 . . . . 55.119999999999997 110.011 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.727 ' O ' HD12 ' A' ' 171' ' ' ILE . 3.2 t -134.16 117.26 24.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.464 1.103 . . . . 73.409999999999997 109.291 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.727 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.6 mp -128.13 97.45 29.04 Favored Pre-proline 0 C--N 1.325 -0.481 0 O-C-N 124.518 1.136 . . . . 74.510000000000005 109.252 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 172' ' ' PRO . . . . . 0.905 ' HG3' HD22 ' A' ' 189' ' ' LEU . 18.6 Cg_endo -74.95 107.1 2.4 Favored 'Trans proline' 0 C--N 1.359 1.126 0 O-C-N 124.51 1.795 . . . . 71.439999999999998 111.003 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 173' ' ' MET . . . . . 0.653 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.8 ttt -82.52 157.66 23.46 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.427 1.079 . . . . 72.049999999999997 110.982 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 174' ' ' ARG . . . . . 0.436 ' N ' ' HG2' ' A' ' 173' ' ' MET . 29.4 mmm-85 -108.98 113.67 59.08 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.498 1.124 . . . . 74.109999999999999 110.314 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 175' ' ' PRO . . . . . 0.448 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.3 Cg_endo -74.99 146.39 32.61 Favored 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.451 1.764 . . . . 55.219999999999999 111.013 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 176' ' ' LEU . . . . . 0.572 HD13 ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -82.32 -40.77 20.97 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.534 1.146 . . . . 73.540000000000006 109.251 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -72.18 -28.63 63.34 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 124.535 1.147 . . . . 65.319999999999993 109.293 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 178' ' ' ASN . . . . . 0.612 ' OD1' HG23 ' A' ' 140' ' ' THR . 4.7 m-80 -110.77 99.2 41.06 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.53 1.144 . . . . 73.409999999999997 109.255 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 135.49 19.15 Favored 'Trans proline' 0 C--N 1.359 1.111 0 O-C-N 124.449 1.763 . . . . 43.399999999999999 111.019 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.604 HD12 ' OG1' ' A' ' 185' ' ' THR . 0.4 OUTLIER -141.2 96.99 7.0 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.463 1.102 . . . . 71.209999999999994 109.364 179.973 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.01 171.35 18.51 Favored 'Trans proline' 0 C--N 1.359 1.121 0 O-C-N 124.529 1.804 . . . . 62.399999999999999 110.978 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 182' ' ' ARG . . . . . 0.5 ' CG ' ' OE1' ' A' ' 190' ' ' GLN . 50.0 mtm-85 -62.74 -23.57 67.25 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.55 1.156 . . . . 74.099999999999994 110.305 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -72.02 -5.17 33.13 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.499 1.125 . . . . 60.509999999999998 110.279 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 184' ' ' ARG . . . . . 0.484 ' O ' HD11 ' A' ' 180' ' ' LEU . 15.6 mmt85 -128.94 4.95 5.38 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.478 1.111 . . . . 65.329999999999998 110.274 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 185' ' ' THR . . . . . 0.604 ' OG1' HD12 ' A' ' 180' ' ' LEU . 51.5 m -110.97 143.8 29.05 Favored Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.49 1.119 . . . . 74.0 110.36 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 186' ' ' PRO . . . . . 0.7 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -75.05 146.91 33.03 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.556 1.819 . . . . 72.439999999999998 111.018 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 187' ' ' PHE . . . . . 0.457 ' O ' HG23 ' A' ' 191' ' ' THR . 38.6 p90 -63.05 -11.49 19.79 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.447 1.092 . . . . 73.439999999999998 111.031 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -87.78 -54.03 4.46 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.51 1.131 . . . . 71.019999999999996 109.313 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.905 HD22 ' HG3' ' A' ' 172' ' ' PRO . 23.0 mt -73.31 -19.0 61.14 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.504 1.127 . . . . 64.030000000000001 109.311 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 190' ' ' GLN . . . . . 0.5 ' OE1' ' CG ' ' A' ' 182' ' ' ARG . 6.7 tt0 -84.84 -2.2 57.45 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.485 1.115 . . . . 64.109999999999999 110.297 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 191' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 187' ' ' PHE . 41.2 p -126.38 1.83 7.0 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.509 1.13 . . . . 53.340000000000003 110.399 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.497 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 12.9 mt -94.25 163.94 2.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.547 1.154 . . . . 74.239999999999995 109.309 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 193' ' ' ASN . . . . . 0.491 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 3.7 t-20 -78.07 57.53 1.81 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.52 1.138 . . . . 64.049999999999997 109.319 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 194' ' ' ALA . . . . . 0.857 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -61.11 177.16 0.36 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.485 1.116 . . . . 65.329999999999998 109.324 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 195' ' ' LEU . . . . . 0.935 HD23 HD12 ' A' ' 209' ' ' ILE . 0.2 OUTLIER -108.29 152.89 24.01 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.523 1.139 . . . . 64.519999999999996 109.26 -179.932 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 196' ' ' GLU . . . . . 0.55 ' H ' HD13 ' A' ' 195' ' ' LEU . 99.1 mt-10 -144.47 137.09 26.69 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.535 1.147 . . . . 53.210000000000001 110.341 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.475 ' HG3' ' CD1' ' A' ' 176' ' ' LEU . 0.8 OUTLIER -111.06 -12.0 14.23 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.431 1.082 . . . . 74.299999999999997 110.29 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 198' ' ' GLU . . . . . 0.457 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 1.4 pt-20 -95.22 13.24 26.14 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.482 1.114 . . . . 64.310000000000002 110.318 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 1.7 t -118.18 164.96 14.39 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.541 1.151 . . . . 73.25 110.005 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -78.59 -26.5 45.49 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.51 1.131 . . . . 74.120000000000005 110.298 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -87.08 13.08 60.42 Favored Glycine 0 CA--C 1.53 1.009 0 O-C-N 124.45 1.094 . . . . 74.310000000000002 111.026 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 202' ' ' PHE . . . . . 0.774 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.0 OUTLIER -52.61 -45.74 96.04 Favored Pre-proline 0 C--N 1.325 -0.458 0 O-C-N 124.423 0.72 . . . . 72.25 110.986 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 203' ' ' PRO . . . . . 0.592 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.2 Cg_endo -74.97 -34.8 3.58 Favored 'Trans proline' 0 C--N 1.359 1.116 0 O-C-N 124.562 1.822 . . . . 54.539999999999999 111.014 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -57.45 -56.0 27.47 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.448 1.092 . . . . 61.009999999999998 110.358 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -63.61 -36.65 84.51 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.467 1.104 . . . . 74.510000000000005 110.33 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 206' ' ' VAL . . . . . 0.939 HG11 ' CE2' ' A' ' 104' ' ' PHE . 37.7 t -63.86 -37.09 78.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 O-C-N 124.491 1.119 . . . . 74.400000000000006 109.329 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 207' ' ' GLU . . . . . 0.435 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 4.3 mt-10 -69.68 -49.49 53.01 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.545 1.153 . . . . 72.329999999999998 110.305 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 80.0 mtt-85 -67.21 -66.25 0.58 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.476 1.11 . . . . 70.239999999999995 110.271 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 209' ' ' ILE . . . . . 0.935 HD12 HD23 ' A' ' 195' ' ' LEU . 45.4 mt -43.46 -57.78 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.53 1.144 . . . . 70.109999999999999 109.309 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 210' ' ' PHE . . . . . 0.83 ' CD1' HG22 ' A' ' 209' ' ' ILE . 3.2 m-85 -102.53 69.45 1.1 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.54 1.15 . . . . 62.219999999999999 110.967 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 211' ' ' GLN . . . . . 0.468 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -110.83 143.26 41.69 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.457 1.098 . . . . 61.140000000000001 110.3 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 212' ' ' GLU . . . . . 0.454 ' O ' ' N ' ' A' ' 215' ' ' TYR . 29.2 tt0 -50.09 -53.74 25.21 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.541 1.15 . . . . 71.219999999999999 110.246 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -48.56 -23.53 1.02 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.482 1.114 . . . . 71.439999999999998 109.983 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.468 HG23 ' HG2' ' A' ' 211' ' ' GLN . 20.4 t -95.14 -29.56 4.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 O-C-N 124.499 1.124 . . . . 71.019999999999996 109.26 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 215' ' ' TYR . . . . . 0.461 ' OH ' ' CD2' ' A' ' 78' ' ' PHE . 9.4 t80 -61.92 -19.01 62.25 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.476 1.11 . . . . 72.150000000000006 111.039 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 216' ' ' LYS . . . . . 0.42 ' N ' ' HD2' ' A' ' 216' ' ' LYS . 16.5 mmmt -76.13 -44.52 38.06 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.539 1.149 . . . . 75.120000000000005 109.245 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 217' ' ' THR . . . . . 0.871 HG22 HD11 ' A' ' 221' ' ' ILE . 74.7 m -59.63 -66.43 0.51 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.5 1.125 . . . . 44.009999999999998 110.445 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 218' ' ' GLN . . . . . 0.425 ' NE2' ' N ' ' A' ' 218' ' ' GLN . 0.0 OUTLIER -51.34 -28.31 12.01 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.486 1.117 . . . . 73.200000000000003 110.32 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 219' ' ' GLN . . . . . 0.426 ' NE2' ' HD2' ' A' ' 223' ' ' LYS . 33.3 tp60 -67.96 -55.57 12.25 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.54 1.15 . . . . 74.5 110.263 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.6 m -62.31 -36.4 82.05 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.534 1.146 . . . . 63.310000000000002 110.392 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 221' ' ' ILE . . . . . 0.871 HD11 HG22 ' A' ' 217' ' ' THR . 20.3 mt -66.87 -18.91 24.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.519 1.137 . . . . 74.230000000000004 109.302 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 222' ' ' TRP . . . . . 0.502 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 11.8 t90 -69.89 -64.68 0.84 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.517 1.135 . . . . 71.219999999999999 107.958 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 223' ' ' LYS . . . . . 0.492 ' CB ' ' HZ2' ' A' ' 223' ' ' LYS . 0.0 OUTLIER -54.14 -31.21 51.81 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.509 1.13 . . . . 73.209999999999994 109.247 -179.942 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.325 -0.473 0 O-C-N 124.498 1.124 . . . . 75.409999999999997 110.301 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.444 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 2.4 p . . . . . 0 N--CA 1.453 -0.289 0 N-CA-C 109.295 -0.631 . . . . 61.340000000000003 109.295 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.553 ' CE2' ' HD3' ' A' ' 108' ' ' PRO . 48.2 p90 -96.22 40.33 1.13 Allowed 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.556 1.16 . . . . 74.010000000000005 111.003 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.475 HD11 HG22 ' A' ' 110' ' ' ILE . 3.0 tp -39.97 133.82 1.59 Allowed 'General case' 0 C--N 1.323 -0.553 0 O-C-N 124.52 1.138 . . . . 65.329999999999998 109.258 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.964 ' NZ ' HG23 ' A' ' 106' ' ' ILE . 9.2 mmmm -57.04 -66.35 0.47 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.483 1.114 . . . . 55.240000000000002 109.317 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.605 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 2.2 p90 -166.32 179.81 5.43 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.585 1.178 . . . . 72.129999999999995 111.001 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 1.047 HG11 ' HB1' ' A' ' 128' ' ' ALA . 0.8 OUTLIER -111.73 149.91 14.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.433 1.083 . . . . 71.420000000000002 109.318 179.999 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.892 ' CG2' ' HB1' ' A' ' 93' ' ' ALA . 4.9 mp -121.2 89.51 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.533 1.145 . . . . 72.420000000000002 109.252 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.893 HD21 ' CB ' ' A' ' 128' ' ' ALA . 6.2 mt -70.24 121.79 18.27 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.568 1.168 . . . . 71.409999999999997 109.35 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.823 ' CD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -144.14 174.64 10.7 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.541 1.151 . . . . 75.209999999999994 109.552 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.478 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -111.99 164.35 13.23 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.474 1.109 . . . . 70.150000000000006 109.279 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -63.04 -12.27 25.19 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.502 1.126 . . . . 73.519999999999996 110.244 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -82.33 -46.12 14.02 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.481 1.113 . . . . 64.439999999999998 109.273 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -120.71 44.33 2.52 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.452 1.095 . . . . 71.430000000000007 109.293 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.607 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -76.85 -25.66 53.41 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.457 1.098 . . . . 74.510000000000005 110.347 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -85.79 -21.75 28.01 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.453 1.096 . . . . 72.349999999999994 109.314 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -73.18 -45.67 55.11 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.56 1.163 . . . . 72.439999999999998 110.338 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.892 ' HB1' ' CG2' ' A' ' 83' ' ' ILE . . . -70.14 -31.43 68.93 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.464 1.103 . . . . 71.409999999999997 109.352 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.941 ' HB2' HD13 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -73.1 -52.82 12.84 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.51 1.131 . . . . 74.5 109.311 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.663 ' N ' HD13 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -43.23 -37.25 2.07 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.46 1.1 . . . . 73.209999999999994 110.328 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.805 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.3 t -73.42 -64.76 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.512 1.133 . . . . 64.439999999999998 109.315 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.486 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -40.6 -26.86 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.53 1.144 . . . . 64.430000000000007 110.319 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.454 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.2 OUTLIER -73.21 -60.18 2.36 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.521 1.138 . . . . 62.229999999999997 109.287 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.841 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -62.61 -22.11 66.16 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.504 1.127 . . . . 73.120000000000005 109.282 179.995 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.841 ' N ' HD23 ' A' ' 99' ' ' LEU . 28.5 mt -67.75 -43.23 80.35 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.415 1.072 . . . . 61.219999999999999 109.272 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -86.41 46.73 1.38 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.567 1.167 . . . . 64.409999999999997 110.272 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -166.68 -63.74 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.574 1.171 . . . . 61.240000000000002 109.247 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.551 ' OD1' ' CE2' ' A' ' 104' ' ' PHE . 22.4 t70 -46.55 -46.46 19.38 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.55 1.156 . . . . 63.310000000000002 109.297 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.911 ' CE1' HG11 ' A' ' 206' ' ' VAL . 0.4 OUTLIER -116.26 -31.87 5.5 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.514 1.134 . . . . 74.019999999999996 110.96 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.444 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 100.73 44.63 2.07 Favored Glycine 0 CA--C 1.531 1.049 0 O-C-N 124.519 1.137 . . . . 74.129999999999995 110.986 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.964 HG23 ' NZ ' ' A' ' 80' ' ' LYS . 6.1 mm -84.95 70.11 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.556 0.798 . . . . 73.510000000000005 109.308 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.541 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -120.92 155.48 57.52 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.468 1.105 . . . . 74.420000000000002 109.272 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.553 ' HD3' ' CE2' ' A' ' 78' ' ' PHE . 18.1 Cg_endo -74.97 160.76 96.07 Favored 'Cis proline' 0 C--N 1.36 1.176 0 C-N-CA 120.927 -2.53 . . . . 74.140000000000001 111.022 -0.052 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -136.56 137.11 8.81 Favored Glycine 0 CA--C 1.53 0.985 0 O-C-N 124.498 1.124 . . . . 65.409999999999997 111.028 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.544 HD11 ' O ' ' A' ' 114' ' ' GLU . 2.5 tt -148.2 152.09 12.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.529 0.782 . . . . 65.200000000000003 109.263 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ILE . . . . . 0.941 HD13 ' HB2' ' A' ' 94' ' ' LEU . 40.9 pt -101.22 167.33 2.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.426 1.079 . . . . 50.409999999999997 109.31 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.802 ' CD1' HD23 ' A' ' 84' ' ' LEU . 2.7 t80 -66.88 -19.24 65.7 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.481 1.113 . . . . 55.539999999999999 111.0 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -90.69 -6.64 54.23 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.552 1.157 . . . . 73.109999999999999 109.324 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.544 ' O ' HD11 ' A' ' 110' ' ' ILE . 12.2 mm-40 -110.64 -5.91 14.95 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.495 1.122 . . . . 72.299999999999997 110.3 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 10.8 ttm -61.4 110.94 3.54 Favored Pre-proline 0 C--N 1.325 -0.457 0 O-C-N 124.456 1.097 . . . . 74.430000000000007 110.958 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 C--N 1.359 1.128 0 O-C-N 124.497 1.788 . . . . 51.039999999999999 111.0 179.958 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.591 ' CD1' HD23 ' A' ' 157' ' ' LEU . 4.2 pp . . . . . 0 N--CA 1.453 -0.313 0 N-CA-C 109.303 -0.628 . . . . 73.340000000000003 109.303 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.44 ' O ' ' N ' ' A' ' 129' ' ' VAL . 11.9 p-10 -63.85 -42.34 97.61 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.494 1.121 . . . . 70.030000000000001 109.313 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -48.98 -32.92 9.98 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.509 1.131 . . . . 74.040000000000006 109.307 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 1.047 ' HB1' HG11 ' A' ' 82' ' ' VAL . . . -68.44 -36.2 78.7 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.522 1.138 . . . . 72.319999999999993 109.311 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.673 HG12 ' O ' ' A' ' 129' ' ' VAL . 53.9 t -89.12 14.2 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.478 1.111 . . . . 63.100000000000001 109.29 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -129.27 120.84 26.39 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.544 1.153 . . . . 71.150000000000006 109.265 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 88.2 -20.12 31.41 Favored Glycine 0 CA--C 1.53 0.973 0 O-C-N 124.506 1.129 . . . . 35.100000000000001 110.994 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 39.2 m -87.95 151.67 22.63 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.522 0.777 . . . . 62.43 110.027 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.785 ' HB3' ' O ' ' A' ' 80' ' ' LYS . . . -94.44 -9.69 34.76 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.454 1.096 . . . . 71.219999999999999 109.308 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.597 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 9.7 m-90 -161.91 173.7 14.14 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.524 1.14 . . . . 73.420000000000002 107.981 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' THR . . . . . 0.946 HG22 HG12 ' A' ' 82' ' ' VAL . 11.8 p -153.29 131.26 11.76 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 124.528 1.143 . . . . 61.409999999999997 110.436 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.763 ' C ' HD23 ' A' ' 137' ' ' LEU . 21.5 mm -93.21 134.62 30.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 124.552 1.158 . . . . 64.010000000000005 109.292 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.884 ' O ' HD22 ' A' ' 139' ' ' LEU . 5.2 mt -113.64 85.49 2.21 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.499 1.124 . . . . 72.040000000000006 109.263 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.777 HD22 ' HB2' ' A' ' 93' ' ' ALA . 1.8 tp -62.65 90.14 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.575 1.172 . . . . 64.310000000000002 109.33 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.884 HD22 ' O ' ' A' ' 137' ' ' LEU . 0.7 OUTLIER -70.44 116.69 11.06 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.541 1.15 . . . . 34.299999999999997 109.272 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 140' ' ' THR . . . . . 0.421 ' HB ' ' CB ' ' A' ' 143' ' ' PHE . 6.8 m -139.22 157.87 45.17 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.43 1.082 . . . . 60.100000000000001 110.352 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -50.24 -40.96 49.23 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.477 1.111 . . . . 62.200000000000003 110.271 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -89.27 -52.18 5.19 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.509 1.13 . . . . 73.150000000000006 109.337 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 1.007 ' CE1' HG21 ' A' ' 147' ' ' THR . 29.0 t80 -52.18 -20.16 2.42 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.483 1.114 . . . . 72.120000000000005 111.018 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.695 ' C ' HD13 ' A' ' 144' ' ' LEU . 1.9 tm? -72.14 -67.54 0.53 Allowed 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.518 1.136 . . . . 75.239999999999995 109.282 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.445 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 25.4 mmm180 -52.75 -23.1 6.11 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.59 1.181 . . . . 70.349999999999994 110.302 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -75.69 -73.11 0.28 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.521 1.138 . . . . 64.540000000000006 109.265 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' THR . . . . . 1.007 HG21 ' CE1' ' A' ' 143' ' ' PHE . 47.2 p -57.42 -56.18 25.24 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.428 1.08 . . . . 64.140000000000001 110.403 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.494 ' CH2' ' HB3' ' A' ' 186' ' ' PRO . 4.6 t-105 -43.9 -42.2 5.67 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.558 1.161 . . . . 73.409999999999997 108.01 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 149' ' ' CYS . . . . . 0.445 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 12.6 t -67.88 -45.4 74.58 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.486 1.116 . . . . 44.240000000000002 108.279 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 150' ' ' ASN . . . . . 0.454 ' N ' ' O ' ' A' ' 147' ' ' THR . 34.2 m-20 -52.23 -61.96 1.94 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.5 1.125 . . . . 70.430000000000007 109.309 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.869 ' CE1' HD12 ' A' ' 157' ' ' LEU . 9.8 m-30 -38.46 -45.88 1.09 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.437 1.086 . . . . 63.340000000000003 110.971 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -49.27 -48.84 45.66 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.544 1.153 . . . . 65.420000000000002 110.31 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -88.06 -11.72 46.34 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.538 1.148 . . . . 73.530000000000001 111.041 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.4 ' N ' ' O ' ' A' ' 150' ' ' ASN . 3.2 m-30 -116.67 77.36 1.1 Allowed 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.437 1.086 . . . . 74.439999999999998 110.995 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.1 t -61.82 -13.41 23.71 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.538 1.149 . . . . 64.329999999999998 110.448 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 13.1 m -71.53 -32.26 67.96 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.461 1.1 . . . . 74.340000000000003 110.017 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.869 HD12 ' CE1' ' A' ' 151' ' ' PHE . 0.4 OUTLIER -74.1 -47.21 37.86 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.566 1.166 . . . . 53.009999999999998 109.322 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 158' ' ' MET . . . . . 0.623 ' CE ' HG21 ' A' ' 161' ' ' VAL . 1.9 tpt -48.76 -23.01 0.91 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.485 1.115 . . . . 71.420000000000002 111.083 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -77.84 -42.79 32.41 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.528 1.143 . . . . 71.25 109.271 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 160' ' ' SER . . . . . 0.542 ' CB ' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -63.16 -22.79 67.1 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.484 1.115 . . . . 74.030000000000001 110.011 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 161' ' ' VAL . . . . . 0.623 HG21 ' CE ' ' A' ' 158' ' ' MET . 41.9 t -57.41 -17.87 7.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.489 1.118 . . . . 70.109999999999999 109.315 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -90.96 21.5 4.16 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.621 1.201 . . . . 73.430000000000007 109.288 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.483 ' CD ' ' O ' ' A' ' 170' ' ' VAL . 0.0 OUTLIER 46.6 37.12 4.16 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.5 1.125 . . . . 73.329999999999998 110.327 -179.94 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 164' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' A' ' 163' ' ' ARG . 21.9 mt-30 -38.3 131.31 1.19 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.483 1.114 . . . . 73.230000000000004 110.295 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 13.8 m-70 -90.1 57.4 3.76 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.518 1.136 . . . . 75.510000000000005 109.587 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.608 ' HA ' HG21 ' A' ' 221' ' ' ILE . 0.0 OUTLIER -118.25 89.7 3.18 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.534 1.146 . . . . 64.329999999999998 109.24 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 167' ' ' TYR . . . . . 0.603 ' CD1' ' O ' ' A' ' 166' ' ' LYS . 12.7 p90 36.61 32.98 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.571 1.17 . . . . 75.200000000000003 111.047 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 168' ' ' ASN . . . . . 0.439 ' ND2' ' O ' ' A' ' 129' ' ' VAL . 27.0 p30 178.48 156.97 0.45 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.548 1.155 . . . . 75.019999999999996 109.277 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.576 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 0.4 OUTLIER -140.05 176.99 8.29 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.494 1.121 . . . . 42.030000000000001 109.969 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.902 ' O ' HD12 ' A' ' 171' ' ' ILE . 65.3 t -131.34 120.57 46.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.563 1.164 . . . . 71.439999999999998 109.272 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.902 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.3 mp -136.37 105.42 9.31 Favored Pre-proline 0 C--N 1.325 -0.468 0 O-C-N 124.497 1.123 . . . . 70.420000000000002 109.359 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 172' ' ' PRO . . . . . 0.674 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.5 Cg_endo -74.95 112.96 3.68 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.507 1.793 . . . . 44.439999999999998 111.041 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 173' ' ' MET . . . . . 0.805 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.7 ttt -89.16 160.67 16.87 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.576 1.173 . . . . 64.219999999999999 110.96 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 174' ' ' ARG . . . . . 0.423 ' N ' ' HG2' ' A' ' 173' ' ' MET . 0.0 OUTLIER -123.48 119.05 27.35 Favored Pre-proline 0 C--N 1.325 -0.48 0 O-C-N 124.531 1.144 . . . . 73.049999999999997 110.296 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 175' ' ' PRO . . . . . 0.636 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -75.05 155.05 42.68 Favored 'Trans proline' 0 C--N 1.36 1.142 0 O-C-N 124.5 1.79 . . . . 71.109999999999999 110.983 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 176' ' ' LEU . . . . . 1.018 HD21 ' CG ' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -98.18 -36.87 9.91 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.584 1.177 . . . . 75.120000000000005 109.319 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -72.68 -23.02 60.83 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.504 1.127 . . . . 53.200000000000003 109.278 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -110.35 113.09 56.61 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.409 1.068 . . . . 71.099999999999994 109.292 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.05 115.02 4.16 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.536 1.808 . . . . 62.020000000000003 110.958 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.539 HD13 ' HB2' ' A' ' 184' ' ' ARG . 0.8 OUTLIER -132.86 96.62 17.88 Favored Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.537 1.148 . . . . 61.399999999999999 109.342 179.939 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 181' ' ' PRO . . . . . 0.424 ' HG2' ' CG ' ' A' ' 183' ' ' GLU . 18.3 Cg_endo -74.98 164.21 33.83 Favored 'Trans proline' 0 C--N 1.361 1.203 0 O-C-N 124.455 1.766 . . . . 52.219999999999999 111.025 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 182' ' ' ARG . . . . . 0.424 ' HG3' ' N ' ' A' ' 183' ' ' GLU . 0.7 OUTLIER -51.88 -35.16 44.16 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.446 1.091 . . . . 73.099999999999994 110.329 -179.985 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 183' ' ' GLU . . . . . 0.424 ' CG ' ' HG2' ' A' ' 181' ' ' PRO . 4.7 pt-20 -56.8 -32.01 65.25 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.54 1.15 . . . . 55.140000000000001 110.324 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 184' ' ' ARG . . . . . 0.539 ' HB2' HD13 ' A' ' 180' ' ' LEU . 5.7 mmp_? -87.96 -28.6 21.37 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.476 1.11 . . . . 75.519999999999996 110.236 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 185' ' ' THR . . . . . 0.494 HG22 ' HD2' ' A' ' 186' ' ' PRO . 21.2 m -77.27 144.03 70.3 Favored Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.477 1.111 . . . . 73.129999999999995 110.454 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 186' ' ' PRO . . . . . 0.701 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -74.93 152.33 41.0 Favored 'Trans proline' 0 C--N 1.36 1.167 0 O-C-N 124.508 1.793 . . . . 64.200000000000003 111.02 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 187' ' ' PHE . . . . . 0.483 ' O ' ' CG2' ' A' ' 191' ' ' THR . 13.2 p90 -68.22 -6.79 25.48 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.517 1.135 . . . . 72.409999999999997 111.0 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.75 -53.84 3.86 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.528 1.143 . . . . 63.420000000000002 109.267 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.701 HD12 ' CG ' ' A' ' 186' ' ' PRO . 49.3 mt -68.5 -42.21 78.91 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.455 1.097 . . . . 74.010000000000005 109.306 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 190' ' ' GLN . . . . . 0.402 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 6.4 pt20 -63.31 -11.5 22.52 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.5 1.125 . . . . 72.239999999999995 110.293 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 191' ' ' THR . . . . . 0.483 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 32.5 p -112.67 2.4 16.1 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.49 1.118 . . . . 74.120000000000005 110.353 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.49 ' CG2' ' N ' ' A' ' 193' ' ' ASN . 30.9 mt -105.31 163.36 4.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.461 1.101 . . . . 72.340000000000003 109.36 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 193' ' ' ASN . . . . . 0.49 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 22.7 p30 -66.8 74.78 0.11 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.507 1.129 . . . . 74.010000000000005 109.301 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 194' ' ' ALA . . . . . 0.674 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -70.04 156.36 39.27 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.557 1.16 . . . . 52.530000000000001 109.342 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 195' ' ' LEU . . . . . 0.725 HD23 ' CD1' ' A' ' 209' ' ' ILE . 0.3 OUTLIER -95.83 127.58 41.98 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.474 1.109 . . . . 72.310000000000002 109.256 -179.967 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 196' ' ' GLU . . . . . 0.402 ' HB3' ' CB ' ' A' ' 199' ' ' SER . 45.3 mt-10 -108.42 130.42 55.24 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.543 1.152 . . . . 73.019999999999996 110.292 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 1.018 ' CG ' HD21 ' A' ' 176' ' ' LEU . 25.2 tp10 -100.53 -23.14 14.77 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.509 1.131 . . . . 72.519999999999996 110.305 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 198' ' ' GLU . . . . . 0.508 ' HB3' HD12 ' A' ' 176' ' ' LEU . 0.4 OUTLIER -104.95 15.33 27.91 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.527 1.142 . . . . 64.239999999999995 110.292 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 199' ' ' SER . . . . . 0.402 ' CB ' ' HB3' ' A' ' 196' ' ' GLU . 40.2 t -104.54 139.78 38.94 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.437 1.086 . . . . 73.219999999999999 110.023 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 21.5 ttp180 -59.47 -15.34 16.86 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.538 1.149 . . . . 75.319999999999993 110.315 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -102.89 17.61 52.15 Favored Glycine 0 CA--C 1.531 1.047 0 O-C-N 124.543 1.152 . . . . 44.219999999999999 110.928 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 202' ' ' PHE . . . . . 0.8 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.1 OUTLIER -54.16 -44.49 98.58 Favored Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.535 0.785 . . . . 65.209999999999994 111.019 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 203' ' ' PRO . . . . . 0.601 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.2 Cg_endo -74.99 -34.98 3.42 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.542 1.811 . . . . 75.209999999999994 110.994 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.98 -51.03 70.86 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.538 1.149 . . . . 53.140000000000001 110.411 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 205' ' ' GLN . . . . . 0.401 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 6.2 mt-30 -69.53 -33.04 72.23 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.495 1.122 . . . . 71.510000000000005 110.3 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 206' ' ' VAL . . . . . 0.911 HG11 ' CE1' ' A' ' 104' ' ' PHE . 50.5 t -70.28 -29.68 40.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.564 1.165 . . . . 61.119999999999997 109.287 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 207' ' ' GLU . . . . . 0.504 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 3.9 mt-10 -77.92 -36.67 49.16 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.544 1.152 . . . . 74.109999999999999 110.335 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -78.79 -62.93 1.54 Allowed 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.459 1.099 . . . . 72.239999999999995 110.279 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 209' ' ' ILE . . . . . 0.825 HG22 ' CD1' ' A' ' 210' ' ' PHE . 81.3 mt -47.83 -61.13 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.443 1.09 . . . . 73.439999999999998 109.325 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 210' ' ' PHE . . . . . 0.825 ' CD1' HG22 ' A' ' 209' ' ' ILE . 3.9 m-85 -97.42 67.36 2.09 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.519 1.137 . . . . 75.340000000000003 111.012 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 211' ' ' GLN . . . . . 0.504 ' CB ' ' O ' ' A' ' 207' ' ' GLU . 0.0 OUTLIER -110.98 141.09 44.92 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.502 1.126 . . . . 71.129999999999995 110.372 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 212' ' ' GLU . . . . . 0.454 ' O ' ' N ' ' A' ' 215' ' ' TYR . 25.6 tt0 -51.97 -51.52 56.63 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.528 1.142 . . . . 71.530000000000001 110.255 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.42 -23.16 0.85 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.443 1.09 . . . . 64.120000000000005 109.943 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.52 HG12 HE22 ' A' ' 218' ' ' GLN . 17.4 t -95.47 -30.19 4.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 O-C-N 124.603 1.189 . . . . 73.030000000000001 109.301 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 215' ' ' TYR . . . . . 0.454 ' N ' ' O ' ' A' ' 212' ' ' GLU . 13.7 t80 -64.64 -20.37 66.25 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.586 1.178 . . . . 74.319999999999993 111.025 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 4.8 mmpt? -69.37 -54.88 12.27 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.468 1.105 . . . . 72.299999999999997 109.305 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 217' ' ' THR . . . . . 0.796 HG22 HD11 ' A' ' 221' ' ' ILE . 2.2 m -49.13 -67.52 0.26 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.506 1.129 . . . . 74.239999999999995 110.409 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 218' ' ' GLN . . . . . 0.947 ' HA ' HD12 ' A' ' 221' ' ' ILE . 0.7 OUTLIER -50.32 -43.64 53.86 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.493 1.12 . . . . 75.340000000000003 110.252 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 219' ' ' GLN . . . . . 0.402 ' CB ' ' O ' ' A' ' 215' ' ' TYR . 5.7 tp-100 -52.3 -37.87 56.92 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.505 1.128 . . . . 73.409999999999997 110.284 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 22.7 m -79.6 -35.17 40.0 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.429 1.081 . . . . 73.040000000000006 110.381 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 221' ' ' ILE . . . . . 0.947 HD12 ' HA ' ' A' ' 218' ' ' GLN . 10.9 mt -66.03 -27.24 40.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 O-C-N 124.443 1.09 . . . . 71.209999999999994 109.32 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 222' ' ' TRP . . . . . 0.444 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 24.1 t90 -89.11 -49.18 6.9 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.498 1.124 . . . . 54.43 107.991 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 223' ' ' LYS . . . . . 0.462 ' CD ' ' C ' ' A' ' 223' ' ' LYS . 0.0 OUTLIER -60.47 -16.77 39.91 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.532 1.145 . . . . 73.0 109.283 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 . . . . . 0 C--N 1.324 -0.504 0 O-C-N 124.554 1.159 . . . . 61.130000000000003 110.309 -179.996 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.427 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 5.3 p . . . . . 0 N--CA 1.454 -0.249 0 N-CA-C 109.303 -0.628 . . . . 74.420000000000002 109.303 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.49 ' CE2' ' OH ' ' A' ' 215' ' ' TYR . 5.6 t80 -88.68 24.82 1.89 Allowed 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.481 1.113 . . . . 74.299999999999997 111.004 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.407 ' C ' ' O ' ' A' ' 78' ' ' PHE . 3.2 tp -39.5 143.14 0.23 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.486 1.116 . . . . 74.409999999999997 109.269 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.6 ' O ' ' HB3' ' A' ' 133' ' ' ALA . 8.2 ttmt -79.03 -62.3 1.74 Allowed 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.522 1.139 . . . . 62.43 109.249 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.944 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.3 OUTLIER -165.47 140.09 4.87 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.563 1.164 . . . . 75.140000000000001 110.979 179.97 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.94 ' CG1' HG22 ' A' ' 135' ' ' THR . 7.5 p -90.69 167.49 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 O-C-N 124.428 1.08 . . . . 65.219999999999999 109.313 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.944 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 3.8 mp -132.64 92.0 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.47 1.106 . . . . 72.030000000000001 109.33 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.735 HD21 ' HB3' ' A' ' 128' ' ' ALA . 5.9 mp -70.16 113.22 7.13 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.454 1.096 . . . . 71.409999999999997 109.304 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.619 ' CB ' HD22 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -128.44 174.39 9.39 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.465 1.103 . . . . 73.219999999999999 109.661 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -113.24 162.47 15.98 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.538 1.149 . . . . 55.25 109.309 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -64.31 -11.33 31.02 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.541 1.151 . . . . 61.009999999999998 110.374 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -81.68 -45.95 15.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.482 1.114 . . . . 74.439999999999998 109.284 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.416 ' CG ' HD23 ' A' ' 138' ' ' LEU . 0.8 OUTLIER -124.58 44.21 2.82 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.441 1.088 . . . . 64.019999999999996 109.265 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.607 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -75.54 -33.89 60.71 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.456 1.098 . . . . 72.340000000000003 110.383 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -79.01 -17.21 55.75 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.537 1.148 . . . . 73.099999999999994 109.354 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -79.39 -54.04 6.32 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.548 1.155 . . . . 72.400000000000006 110.302 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.872 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -65.16 -19.75 66.12 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.473 1.108 . . . . 73.409999999999997 109.251 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.936 ' HB2' HD13 ' A' ' 111' ' ' ILE . 0.1 OUTLIER -87.96 -51.89 5.57 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.573 1.17 . . . . 64.409999999999997 109.264 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.568 ' N ' HD13 ' A' ' 94' ' ' LEU . 10.7 tpt180 -45.27 -33.32 2.33 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.514 1.133 . . . . 72.519999999999996 110.334 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.582 HG13 ' N ' ' A' ' 97' ' ' GLN . 10.7 p -82.77 -55.89 6.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.516 1.135 . . . . 72.219999999999999 109.295 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.582 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -48.24 -22.12 0.61 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.466 1.104 . . . . 73.230000000000004 110.339 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -77.21 -38.61 51.03 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.466 1.104 . . . . 73.5 109.334 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.783 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -83.08 -21.99 33.57 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.473 1.108 . . . . 72.519999999999996 109.263 -179.98 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.783 ' N ' HD23 ' A' ' 99' ' ' LEU . 71.9 mt -63.44 -51.51 65.37 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.529 1.143 . . . . 55.450000000000003 109.276 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -77.5 54.79 1.21 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.487 1.117 . . . . 64.129999999999995 110.306 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -176.3 -67.05 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.482 1.114 . . . . 70.040000000000006 109.321 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -43.57 -54.09 5.17 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.462 1.101 . . . . 51.310000000000002 109.276 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.418 ' CZ ' ' HB3' ' A' ' 203' ' ' PRO . 6.4 m-85 -107.96 -31.2 8.08 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.507 1.13 . . . . 71.430000000000007 110.992 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 104.78 41.98 1.9 Allowed Glycine 0 CA--C 1.531 1.048 0 O-C-N 124.482 1.114 . . . . 71.239999999999995 110.996 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.1 mm -82.97 79.69 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.555 0.797 . . . . 74.040000000000006 109.295 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.538 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -131.76 156.39 80.18 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.522 1.139 . . . . 73.310000000000002 109.321 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.538 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.0 160.1 97.05 Favored 'Cis proline' 0 C--N 1.36 1.168 0 C-N-CA 120.981 -2.508 . . . . 71.209999999999994 110.994 -0.029 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -122.7 141.48 14.03 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.466 1.104 . . . . 60.229999999999997 111.046 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -158.72 130.16 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.5 0.765 . . . . 53.340000000000003 109.275 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ILE . . . . . 0.936 HD13 ' HB2' ' A' ' 94' ' ' LEU . 1.9 pt -96.67 156.88 3.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.571 1.169 . . . . 73.450000000000003 109.291 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.685 ' HE1' ' HB2' ' A' ' 128' ' ' ALA . 1.5 t80 -54.65 -19.17 5.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.491 1.12 . . . . 43.43 110.998 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.856 ' HB3' HD12 ' A' ' 111' ' ' ILE . . . -76.26 -51.58 11.74 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.541 1.15 . . . . 52.420000000000002 109.356 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -71.02 -25.93 62.89 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.425 1.078 . . . . 73.140000000000001 110.319 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.43 ' HE1' ' CG2' ' A' ' 82' ' ' VAL . 34.8 tpp -38.12 111.03 0.57 Allowed Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.508 1.13 . . . . 73.140000000000001 110.974 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 C--N 1.36 1.157 0 O-C-N 124.483 1.781 . . . . 64.519999999999996 111.048 179.933 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.643 HD11 ' HE1' ' A' ' 151' ' ' PHE . 1.1 pt? . . . . . 0 N--CA 1.453 -0.276 0 N-CA-C 109.242 -0.651 . . . . 63.240000000000002 109.242 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.9 -40.06 72.49 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.55 1.157 . . . . 73.209999999999994 109.265 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -43.9 -54.53 5.24 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.548 1.155 . . . . 75.400000000000006 109.302 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.735 ' HB3' HD21 ' A' ' 84' ' ' LEU . . . -60.5 -36.03 77.37 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.53 1.144 . . . . 63.219999999999999 109.293 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.822 HG21 HD21 ' A' ' 157' ' ' LEU . 3.4 t -73.31 -5.5 6.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.526 1.141 . . . . 73.310000000000002 109.276 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -109.59 119.81 40.55 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.473 1.108 . . . . 72.420000000000002 109.268 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 78.77 63.49 2.09 Favored Glycine 0 CA--C 1.529 0.951 0 O-C-N 124.436 1.085 . . . . 63.25 111.033 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 50.9 p -163.52 155.94 17.94 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.45 0.735 . . . . 42.229999999999997 110.073 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.6 ' HB3' ' O ' ' A' ' 80' ' ' LYS . . . -94.92 -22.31 18.07 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.497 1.123 . . . . 73.150000000000006 109.336 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.583 ' CZ2' ' HA ' ' A' ' 210' ' ' PHE . 16.1 m-90 -161.07 154.87 22.27 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.492 1.12 . . . . 71.530000000000001 108.041 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 135' ' ' THR . . . . . 0.94 HG22 ' CG1' ' A' ' 82' ' ' VAL . 1.8 p -140.55 122.3 15.36 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.551 1.157 . . . . 72.219999999999999 110.391 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.754 ' O ' HD23 ' A' ' 137' ' ' LEU . 0.9 OUTLIER -84.08 142.09 13.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.542 1.151 . . . . 74.239999999999995 109.23 -179.936 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.754 HD23 ' O ' ' A' ' 136' ' ' ILE . 47.7 mt -130.06 98.88 4.88 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.535 1.147 . . . . 72.129999999999995 109.378 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.872 HD21 ' HB2' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.46 102.23 0.3 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.571 1.169 . . . . 50.329999999999998 109.307 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.955 HD11 HD13 ' A' ' 189' ' ' LEU . 0.2 OUTLIER -68.56 99.13 0.94 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.474 1.109 . . . . 75.510000000000005 109.269 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 140' ' ' THR . . . . . 0.447 ' O ' ' N ' ' A' ' 144' ' ' LEU . 2.4 m -125.34 141.55 52.01 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.582 1.176 . . . . 74.140000000000001 110.394 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' GLU . . . . . 0.441 ' HB3' ' CD2' ' A' ' 180' ' ' LEU . 0.1 OUTLIER -47.41 -46.18 26.11 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.512 1.132 . . . . 73.329999999999998 110.307 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 142' ' ' ASN . . . . . 0.453 ' OD1' ' N ' ' A' ' 143' ' ' PHE . 11.2 p30 -73.04 -47.57 43.6 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.562 1.164 . . . . 71.430000000000007 109.331 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.976 ' CE2' HG21 ' A' ' 147' ' ' THR . 76.9 t80 -60.24 -19.37 54.26 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.44 1.087 . . . . 72.109999999999999 110.997 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.723 HD13 ' C ' ' A' ' 144' ' ' LEU . 2.0 tm? -66.83 -67.54 0.44 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.515 1.134 . . . . 73.349999999999994 109.319 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.447 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 30.3 mmt180 -50.95 -21.51 1.78 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.534 1.146 . . . . 75.420000000000002 110.276 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 92.7 m-20 -78.36 -72.33 0.38 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.442 1.089 . . . . 71.400000000000006 109.283 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.976 HG21 ' CE2' ' A' ' 143' ' ' PHE . 20.6 p -58.64 -56.0 27.76 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.489 1.118 . . . . 72.420000000000002 110.394 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.407 ' CE3' ' HA ' ' A' ' 148' ' ' TRP . 2.1 t-105 -43.48 -56.65 3.51 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.98 -1.119 . . . . 75.010000000000005 107.98 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 149' ' ' CYS . . . . . 0.447 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 42.6 t -58.86 -37.88 77.51 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.446 1.091 . . . . 74.129999999999995 108.261 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 150' ' ' ASN . . . . . 0.457 ' HA ' ' CE2' ' A' ' 153' ' ' PHE . 14.5 t-20 -63.5 -27.6 69.38 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.47 1.106 . . . . 72.450000000000003 109.3 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.853 ' CZ ' HD12 ' A' ' 157' ' ' LEU . 10.1 m-30 -87.15 -13.3 44.46 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.452 1.095 . . . . 72.409999999999997 110.978 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -75.46 -35.76 60.83 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.541 1.151 . . . . 61.200000000000003 110.293 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.594 ' C ' ' CD1' ' A' ' 153' ' ' PHE . 0.8 OUTLIER -94.08 -21.4 19.15 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.489 1.118 . . . . 74.099999999999994 111.017 -179.989 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.557 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 1.0 OUTLIER -115.24 109.74 18.41 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.519 1.137 . . . . 63.229999999999997 111.043 -179.974 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.2 t -85.81 -5.98 59.17 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.573 1.17 . . . . 72.450000000000003 110.369 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 1.6 t -72.52 -31.89 65.69 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.543 1.152 . . . . 45.130000000000003 110.051 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.853 HD12 ' CZ ' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -85.46 -25.87 26.65 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.471 1.107 . . . . 72.239999999999995 109.291 179.984 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 158' ' ' MET . . . . . 0.701 ' HA ' ' HE2' ' A' ' 158' ' ' MET . 7.0 mmt -67.64 -25.61 65.82 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.445 1.091 . . . . 74.450000000000003 110.978 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -78.08 -15.81 58.57 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.475 1.11 . . . . 73.430000000000007 109.354 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 160' ' ' SER . . . . . 0.94 ' OG ' HG21 ' A' ' 170' ' ' VAL . 0.5 OUTLIER -80.0 -43.08 22.61 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.521 1.138 . . . . 65.319999999999993 109.976 179.978 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 161' ' ' VAL . . . . . 0.686 HG22 ' O ' ' A' ' 158' ' ' MET . 35.5 m -61.02 -17.02 15.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 O-C-N 124.447 1.092 . . . . 75.549999999999997 109.258 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -76.04 -0.8 23.04 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.509 1.13 . . . . 64.519999999999996 109.323 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.488 ' NH2' ' H ' ' A' ' 170' ' ' VAL . 2.6 mmp_? 51.35 58.64 5.3 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.472 1.108 . . . . 71.230000000000004 110.32 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -78.62 -163.54 0.47 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.51 1.131 . . . . 73.299999999999997 110.353 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -112.17 54.48 0.7 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.476 1.11 . . . . 73.430000000000007 109.552 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.572 ' HG3' ' CD2' ' A' ' 167' ' ' TYR . 3.5 tptt -97.72 164.46 12.39 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.476 1.11 . . . . 63.539999999999999 109.309 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 167' ' ' TYR . . . . . 0.581 ' CD1' ' N ' ' A' ' 168' ' ' ASN . 40.0 p90 -58.09 -48.22 80.83 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.46 1.1 . . . . 74.200000000000003 110.983 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 168' ' ' ASN . . . . . 0.581 ' N ' ' CD1' ' A' ' 167' ' ' TYR . 7.8 p30 -79.86 134.88 36.34 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.519 1.137 . . . . 62.310000000000002 109.264 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.574 ' HB3' ' CD1' ' A' ' 134' ' ' TRP . 47.0 t -113.06 132.3 55.47 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.463 1.102 . . . . 73.530000000000001 109.992 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 1.015 ' O ' HD12 ' A' ' 171' ' ' ILE . 9.6 t -99.48 133.98 40.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.494 1.121 . . . . 63.439999999999998 109.272 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 1.015 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.2 mp -140.52 108.05 6.61 Favored Pre-proline 0 C--N 1.326 -0.44 0 O-C-N 124.389 1.056 . . . . 72.340000000000003 109.361 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 172' ' ' PRO . . . . . 0.715 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -74.99 106.57 2.3 Favored 'Trans proline' 0 C--N 1.359 1.097 0 O-C-N 124.537 1.809 . . . . 74.209999999999994 111.012 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 173' ' ' MET . . . . . 0.43 ' HG2' ' N ' ' A' ' 174' ' ' ARG . 6.7 ttt -89.21 156.41 18.79 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.579 1.175 . . . . 60.109999999999999 110.983 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 174' ' ' ARG . . . . . 0.43 ' N ' ' HG2' ' A' ' 173' ' ' MET . 8.7 mmm-85 -114.94 121.62 35.02 Favored Pre-proline 0 C--N 1.324 -0.506 0 O-C-N 124.47 1.106 . . . . 73.239999999999995 110.284 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 175' ' ' PRO . . . . . 0.746 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -75.01 159.94 40.71 Favored 'Trans proline' 0 C--N 1.359 1.114 0 O-C-N 124.516 1.798 . . . . 61.439999999999998 110.975 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 176' ' ' LEU . . . . . 0.958 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -104.21 -40.17 6.24 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.523 1.139 . . . . 73.120000000000005 109.278 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -72.89 -23.76 60.76 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.543 1.152 . . . . 75.099999999999994 109.311 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -110.19 105.91 57.59 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.503 1.127 . . . . 75.109999999999999 109.34 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.92 115.67 4.36 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.466 1.772 . . . . 74.019999999999996 111.049 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.639 HD21 ' CB ' ' A' ' 184' ' ' ARG . 2.1 tm? -139.12 101.67 7.61 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.432 1.083 . . . . 72.209999999999994 109.342 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.99 171.79 17.64 Favored 'Trans proline' 0 C--N 1.362 1.245 0 O-C-N 124.441 1.759 . . . . 73.230000000000004 110.993 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 3.5 ptp85 -59.53 -32.17 70.08 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.505 1.128 . . . . 64.219999999999999 110.299 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -48.47 -31.82 6.92 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.523 1.14 . . . . 51.549999999999997 110.279 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 184' ' ' ARG . . . . . 0.639 ' CB ' HD21 ' A' ' 180' ' ' LEU . 39.6 mmt180 -96.11 -22.38 17.36 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.507 1.129 . . . . 61.229999999999997 110.292 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 185' ' ' THR . . . . . 0.578 HG23 HD23 ' A' ' 139' ' ' LEU . 12.1 m -77.44 144.35 70.09 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.492 1.12 . . . . 51.219999999999999 110.424 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 186' ' ' PRO . . . . . 0.796 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.2 Cg_endo -74.97 164.6 33.07 Favored 'Trans proline' 0 C--N 1.36 1.155 0 O-C-N 124.404 1.739 . . . . 60.240000000000002 110.989 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 187' ' ' PHE . . . . . 0.466 ' O ' ' CG2' ' A' ' 191' ' ' THR . 32.2 p90 -77.35 -6.92 55.07 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.596 1.185 . . . . 75.329999999999998 111.028 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 188' ' ' ALA . . . . . 0.566 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -95.33 -51.29 4.65 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.434 1.084 . . . . 71.400000000000006 109.279 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.955 HD13 HD11 ' A' ' 139' ' ' LEU . 49.4 mt -68.39 -42.66 78.77 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.502 1.126 . . . . 63.329999999999998 109.257 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 190' ' ' GLN . . . . . 0.439 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 2.0 pt20 -65.2 -9.68 25.4 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.505 1.128 . . . . 74.129999999999995 110.262 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 191' ' ' THR . . . . . 0.466 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 80.8 p -120.84 24.55 10.17 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.491 1.119 . . . . 73.319999999999993 110.403 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.566 HD12 ' O ' ' A' ' 188' ' ' ALA . 7.8 mt -123.41 163.32 22.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.499 1.125 . . . . 73.329999999999998 109.315 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 193' ' ' ASN . . . . . 0.496 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 2.4 m-20 -66.71 74.22 0.1 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.558 1.161 . . . . 70.439999999999998 109.284 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 194' ' ' ALA . . . . . 0.715 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -71.04 162.3 29.66 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.452 1.095 . . . . 73.549999999999997 109.3 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 195' ' ' LEU . . . . . 0.754 HD23 HD12 ' A' ' 209' ' ' ILE . 0.3 OUTLIER -106.72 149.32 27.41 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.478 1.111 . . . . 72.450000000000003 109.288 -179.967 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 196' ' ' GLU . . . . . 0.415 ' N ' HD13 ' A' ' 195' ' ' LEU . 6.8 mm-40 -142.94 142.07 31.59 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.477 1.111 . . . . 53.43 110.335 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.958 ' HG3' HD21 ' A' ' 176' ' ' LEU . 3.4 pm0 -113.62 -28.67 7.4 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.464 1.103 . . . . 72.230000000000004 110.233 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 198' ' ' GLU . . . . . 0.493 ' HG2' HD12 ' A' ' 176' ' ' LEU . 1.5 pp20? -77.39 0.7 21.47 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.488 1.118 . . . . 60.340000000000003 110.334 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 6.9 t -104.28 161.33 14.14 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.49 1.119 . . . . 71.219999999999999 110.042 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 22.0 ttt-85 -77.55 -26.14 50.7 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.458 1.099 . . . . 72.0 110.274 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -88.73 21.99 23.67 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.554 1.159 . . . . 42.030000000000001 110.98 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 202' ' ' PHE . . . . . 0.848 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.3 OUTLIER -61.18 -41.96 83.35 Favored Pre-proline 0 C--N 1.326 -0.438 0 O-C-N 124.458 0.74 . . . . 73.340000000000003 110.981 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 203' ' ' PRO . . . . . 0.646 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.6 Cg_endo -74.94 -37.43 2.08 Favored 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.494 1.786 . . . . 44.340000000000003 111.049 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.36 -50.98 61.3 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.558 1.161 . . . . 71.329999999999998 110.406 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 205' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 3.0 mt-30 -71.05 -40.15 71.83 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.559 1.162 . . . . 74.549999999999997 110.326 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 206' ' ' VAL . . . . . 0.848 HG23 ' O ' ' A' ' 202' ' ' PHE . 57.1 t -62.82 -26.64 41.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 O-C-N 124.586 1.179 . . . . 75.150000000000006 109.261 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -81.01 -49.93 10.32 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.482 1.114 . . . . 64.319999999999993 110.345 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 83.7 mtt-85 -67.46 -62.75 1.27 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.57 1.169 . . . . 71.530000000000001 110.293 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 209' ' ' ILE . . . . . 0.754 HD12 HD23 ' A' ' 195' ' ' LEU . 96.5 mt -45.61 -50.0 3.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.554 1.159 . . . . 71.140000000000001 109.325 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 210' ' ' PHE . . . . . 0.751 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.5 m-85 -105.83 67.39 0.75 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.524 1.14 . . . . 64.310000000000002 111.01 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 211' ' ' GLN . . . . . 0.548 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.3 OUTLIER -111.04 142.95 42.51 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.485 1.116 . . . . 72.230000000000004 110.324 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 212' ' ' GLU . . . . . 0.449 ' CG ' ' HE3' ' A' ' 216' ' ' LYS . 7.1 tt0 -49.06 -54.42 16.01 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.498 1.124 . . . . 65.120000000000005 110.324 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.01 -25.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.499 1.125 . . . . 51.299999999999997 109.993 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.548 HG23 ' HG2' ' A' ' 211' ' ' GLN . 42.5 t -96.1 -28.45 3.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.487 1.117 . . . . 72.299999999999997 109.279 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 215' ' ' TYR . . . . . 0.49 ' OH ' ' CE2' ' A' ' 78' ' ' PHE . 32.0 t80 -64.69 -30.77 71.79 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.522 1.139 . . . . 74.120000000000005 111.051 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 216' ' ' LYS . . . . . 0.449 ' HE3' ' CG ' ' A' ' 212' ' ' GLU . 12.7 mttp -63.11 -66.32 0.56 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.565 1.166 . . . . 73.420000000000002 109.323 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 217' ' ' THR . . . . . 0.713 HG22 HD11 ' A' ' 221' ' ' ILE . 86.9 m -41.01 -55.26 2.59 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.502 1.126 . . . . 74.450000000000003 110.362 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 218' ' ' GLN . . . . . 0.453 ' O ' ' N ' ' A' ' 221' ' ' ILE . 12.6 mm100 -57.15 -67.2 0.34 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.496 1.122 . . . . 75.319999999999993 110.321 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -44.05 -27.36 0.37 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.539 1.15 . . . . 73.219999999999999 110.385 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 4.4 m -81.2 -41.01 22.96 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.503 1.127 . . . . 74.120000000000005 110.392 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 221' ' ' ILE . . . . . 0.713 HD11 HG22 ' A' ' 217' ' ' THR . 14.5 mt -66.56 -31.26 52.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.439 1.087 . . . . 75.420000000000002 109.215 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 222' ' ' TRP . . . . . 0.427 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 28.9 t90 -69.57 -61.46 1.78 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.549 1.156 . . . . 74.5 107.968 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.05 -20.48 6.51 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.564 1.165 . . . . 70.120000000000005 109.275 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 . . . . . 0 C--N 1.325 -0.499 0 O-C-N 124.518 1.136 . . . . 73.510000000000005 110.344 179.94 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.54 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.7 p . . . . . 0 N--CA 1.453 -0.281 0 N-CA-C 109.288 -0.634 . . . . 73.510000000000005 109.288 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.451 ' N ' HG22 ' A' ' 77' ' ' VAL . 8.3 m-85 -88.84 25.21 1.83 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.494 1.121 . . . . 61.520000000000003 111.007 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.677 HD11 HG22 ' A' ' 110' ' ' ILE . 6.1 tp -40.07 158.51 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.553 1.158 . . . . 62.140000000000001 109.317 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.903 ' HZ3' ' HA ' ' A' ' 106' ' ' ILE . 11.4 ptmt -111.76 -47.68 3.13 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.458 1.099 . . . . 71.209999999999994 109.338 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 1.127 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.1 OUTLIER -166.48 151.3 7.84 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.567 1.167 . . . . 75.430000000000007 110.936 -179.972 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.535 HG22 ' N ' ' A' ' 83' ' ' ILE . 3.9 p -104.86 167.78 2.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.451 1.095 . . . . 45.549999999999997 109.347 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 1.127 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 2.3 mp -126.49 105.03 13.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 O-C-N 124.525 1.14 . . . . 63.310000000000002 109.412 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.525 HD23 ' HA ' ' A' ' 84' ' ' LEU . 5.3 mt -70.22 133.27 46.88 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.464 1.102 . . . . 50.219999999999999 109.259 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.68 ' CB ' HD22 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -156.61 174.45 15.43 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.519 1.137 . . . . 72.450000000000003 109.568 179.972 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.577 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -119.2 164.92 14.88 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.514 1.133 . . . . 41.539999999999999 109.307 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -54.46 -35.12 62.69 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 124.478 1.111 . . . . 73.310000000000002 110.267 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -69.28 -46.33 67.46 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.554 1.159 . . . . 65.409999999999997 109.281 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.726 ' HB3' HD23 ' A' ' 138' ' ' LEU . 2.1 m-20 -108.02 44.43 1.1 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.464 1.103 . . . . 72.349999999999994 109.33 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.587 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -80.42 -51.59 8.65 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.47 1.106 . . . . 70.030000000000001 110.39 -179.962 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.04 -32.88 74.59 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.479 1.112 . . . . 73.219999999999999 109.289 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.404 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 4.5 tp10 -58.61 -67.8 0.32 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.498 1.124 . . . . 71.409999999999997 110.288 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.652 ' HB1' ' CG2' ' A' ' 83' ' ' ILE . . . -47.71 -29.66 3.23 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.495 1.122 . . . . 72.310000000000002 109.302 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.496 ' HG ' HD13 ' A' ' 111' ' ' ILE . 1.2 tt -69.9 -49.62 50.4 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.506 1.128 . . . . 71.420000000000002 109.332 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -47.19 -33.15 5.03 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.474 1.109 . . . . 73.030000000000001 110.326 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.814 HG21 ' HE1' ' A' ' 173' ' ' MET . 1.8 t -79.31 -64.69 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.531 1.145 . . . . 73.549999999999997 109.224 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.607 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.8 OUTLIER -45.08 -22.48 0.1 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.489 1.118 . . . . 74.120000000000005 110.353 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.435 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.1 OUTLIER -78.02 -59.91 2.59 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.541 1.151 . . . . 75.209999999999994 109.291 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.836 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -61.73 -21.55 64.61 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.509 1.131 . . . . 71.230000000000004 109.375 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.836 ' N ' HD23 ' A' ' 99' ' ' LEU . 22.6 mt -66.42 -52.61 44.73 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.521 1.138 . . . . 73.400000000000006 109.292 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLN . . . . . 0.549 ' OE1' ' NE2' ' A' ' 97' ' ' GLN . 10.4 pt20 -81.0 49.86 1.3 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.485 1.116 . . . . 72.420000000000002 110.276 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -169.63 -65.79 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.498 1.124 . . . . 64.230000000000004 109.337 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -48.42 -48.13 37.38 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.455 1.097 . . . . 75.040000000000006 109.29 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -115.94 -29.8 6.24 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.596 1.185 . . . . 74.450000000000003 111.018 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.43 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 95.21 45.83 2.95 Favored Glycine 0 CA--C 1.53 1.012 0 O-C-N 124.517 1.136 . . . . 64.239999999999995 110.95 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.903 ' HA ' ' HZ3' ' A' ' 80' ' ' LYS . 10.0 mm -81.29 68.12 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.452 0.736 . . . . 75.340000000000003 109.326 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.524 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -118.42 155.46 51.96 Favored Pre-proline 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 64.019999999999996 109.327 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.524 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.96 154.43 99.69 Favored 'Cis proline' 0 C--N 1.359 1.117 0 C-N-CA 120.925 -2.531 . . . . 54.0 111.049 -0.111 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -135.2 142.99 14.49 Favored Glycine 0 CA--C 1.531 1.038 0 O-C-N 124.468 1.105 . . . . 43.539999999999999 110.957 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.677 HG22 HD11 ' A' ' 79' ' ' LEU . 3.3 tt -153.2 151.92 10.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.506 0.768 . . . . 75.409999999999997 109.269 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ILE . . . . . 0.607 HG23 ' HG2' ' A' ' 97' ' ' GLN . 21.3 pt -95.73 -178.14 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.445 1.091 . . . . 74.409999999999997 109.293 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.45 ' HB3' ' CE1' ' A' ' 85' ' ' HIS . 8.0 t80 -82.07 -19.21 40.7 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.488 1.118 . . . . 64.140000000000001 111.059 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.45 -4.37 51.41 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.425 1.078 . . . . 63.039999999999999 109.251 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.43 ' O ' HD11 ' A' ' 110' ' ' ILE . 48.6 mm-40 -109.09 -12.22 14.85 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.502 1.126 . . . . 71.049999999999997 110.292 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.444 ' CG ' ' HD2' ' A' ' 116' ' ' PRO . 6.2 ttm -55.74 143.89 58.08 Favored Pre-proline 0 C--N 1.326 -0.439 0 O-C-N 124.465 1.103 . . . . 73.439999999999998 111.06 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.444 ' HD2' ' CG ' ' A' ' 115' ' ' MET . 18.2 Cg_endo . . . . . 0 C--N 1.36 1.159 0 O-C-N 124.498 1.788 . . . . 72.030000000000001 110.964 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.634 HD12 ' N ' ' A' ' 126' ' ' ASP . 2.4 pp . . . . . 0 N--CA 1.452 -0.335 0 N-CA-C 109.249 -0.648 . . . . 72.109999999999999 109.249 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.634 ' N ' HD12 ' A' ' 125' ' ' LEU . 7.4 t0 -62.81 -14.12 41.72 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 124.568 1.168 . . . . 74.099999999999994 109.295 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -55.54 -26.29 42.42 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.518 1.136 . . . . 73.209999999999994 109.366 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -93.91 -22.5 18.57 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.459 1.099 . . . . 72.230000000000004 109.324 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.568 ' O ' HG12 ' A' ' 129' ' ' VAL . 25.4 t -82.8 5.17 2.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.5 1.125 . . . . 63.520000000000003 109.259 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 -143.55 118.54 10.02 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.579 1.175 . . . . 74.219999999999999 109.293 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 102.1 42.19 2.29 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.478 1.111 . . . . 30.350000000000001 111.032 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' SER . . . . . 0.462 ' CB ' ' HA ' ' A' ' 81' ' ' PHE . 0.2 OUTLIER -163.26 -177.03 5.11 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.513 0.772 . . . . 52.119999999999997 110.014 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.832 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -107.24 -25.86 11.31 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.536 1.148 . . . . 73.120000000000005 109.343 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.832 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 4.2 m-90 -159.66 172.9 16.91 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.487 1.117 . . . . 74.540000000000006 108.035 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' THR . . . . . 0.491 ' O ' ' CD1' ' A' ' 137' ' ' LEU . 38.9 p -147.25 124.62 11.6 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.518 1.136 . . . . 61.5 110.421 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.764 HD13 HG13 ' A' ' 83' ' ' ILE . 1.1 mp -84.32 128.65 38.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.528 1.143 . . . . 65.310000000000002 109.353 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.717 HD12 ' C ' ' A' ' 136' ' ' ILE . 2.0 mp -110.96 101.69 10.23 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.508 1.13 . . . . 74.329999999999998 109.252 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.726 HD23 ' HB3' ' A' ' 89' ' ' ASP . 0.1 OUTLIER -62.02 89.87 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.43 1.081 . . . . 73.519999999999996 109.306 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.864 HD21 HG23 ' A' ' 185' ' ' THR . 5.2 tp -63.04 99.99 0.19 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.472 1.107 . . . . 72.329999999999998 109.27 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 18.9 m -131.11 154.11 48.65 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.542 1.151 . . . . 74.219999999999999 110.397 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -52.71 -34.32 51.81 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.54 1.15 . . . . 72.120000000000005 110.304 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -89.39 -53.06 4.72 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.541 1.151 . . . . 73.010000000000005 109.324 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.592 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 58.7 t80 -55.16 -19.8 8.69 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.442 1.089 . . . . 71.109999999999999 110.982 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.594 HD13 ' C ' ' A' ' 144' ' ' LEU . 3.0 tm? -63.08 -67.83 0.39 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.52 1.138 . . . . 64.150000000000006 109.3 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.454 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 0.2 OUTLIER -62.7 -15.03 50.87 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.521 1.138 . . . . 72.040000000000006 110.255 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -64.21 -60.65 2.95 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.551 1.157 . . . . 65.409999999999997 109.246 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.573 HG23 ' CZ ' ' A' ' 151' ' ' PHE . 1.0 OUTLIER -92.06 -47.03 7.48 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.523 1.139 . . . . 74.439999999999998 110.392 -179.946 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.502 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 30.2 t-105 -43.37 -35.72 1.65 Allowed 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.503 1.127 . . . . 73.0 108.017 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 149' ' ' CYS . . . . . 0.454 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 17.9 t -80.37 -45.01 18.45 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.479 1.112 . . . . 73.420000000000002 108.282 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 150' ' ' ASN . . . . . 0.427 ' N ' ' O ' ' A' ' 147' ' ' THR . 24.3 t-20 -60.7 -15.65 31.26 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.461 1.1 . . . . 50.240000000000002 109.317 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.698 ' CZ ' HD12 ' A' ' 157' ' ' LEU . 10.7 m-30 -82.41 -50.91 8.36 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.54 1.15 . . . . 75.209999999999994 110.951 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -46.26 -38.11 8.11 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.507 1.13 . . . . 72.049999999999997 110.385 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -77.66 -33.76 53.32 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.483 1.114 . . . . 72.400000000000006 110.957 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -116.41 91.32 3.55 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.468 1.105 . . . . 73.219999999999999 110.966 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.2 t -62.56 -13.03 26.52 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.5 1.125 . . . . 72.409999999999997 110.334 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 12.1 t -70.19 -18.64 63.19 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.461 1.1 . . . . 63.240000000000002 109.956 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.698 HD12 ' CZ ' ' A' ' 151' ' ' PHE . 0.2 OUTLIER -88.58 -36.02 16.57 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.523 1.139 . . . . 74.239999999999995 109.315 179.98 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 158' ' ' MET . . . . . 0.479 ' CE ' ' HA ' ' A' ' 158' ' ' MET . 2.2 mmt -68.67 -11.55 60.3 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.53 1.144 . . . . 65.049999999999997 110.989 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -77.58 -48.52 16.73 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.465 1.103 . . . . 75.329999999999998 109.317 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 160' ' ' SER . . . . . 0.471 ' HB3' ' CG2' ' A' ' 170' ' ' VAL . 0.4 OUTLIER -59.86 -24.88 64.59 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.495 1.122 . . . . 70.430000000000007 110.019 179.958 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 161' ' ' VAL . . . . . 0.832 ' O ' HD11 ' A' ' 192' ' ' ILE . 44.2 t -62.01 -18.03 18.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.513 1.133 . . . . 60.130000000000003 109.337 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 162' ' ' ASN . . . . . 0.42 ' HB3' ' NE2' ' A' ' 164' ' ' GLN . 4.0 t-20 -79.45 1.36 25.82 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.427 1.079 . . . . 45.030000000000001 109.271 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.487 ' NH1' ' ND2' ' A' ' 193' ' ' ASN . 17.6 mmm-85 63.33 62.97 0.93 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.449 1.093 . . . . 62.030000000000001 110.323 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 164' ' ' GLN . . . . . 0.549 ' N ' HE21 ' A' ' 164' ' ' GLN . 0.0 OUTLIER -60.1 -173.66 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 75.209999999999994 110.244 -179.973 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -124.54 24.72 7.8 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.572 1.17 . . . . 73.129999999999995 109.62 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -82.95 174.89 10.49 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.566 1.166 . . . . 74.219999999999999 109.284 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 167' ' ' TYR . . . . . 0.714 ' HB2' HG22 ' A' ' 221' ' ' ILE . 9.9 t80 -45.27 -65.47 0.53 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.53 1.144 . . . . 74.400000000000006 111.04 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 168' ' ' ASN . . . . . 0.402 ' CG ' ' O ' ' A' ' 129' ' ' VAL . 2.0 p-10 -76.84 154.67 33.64 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.487 1.117 . . . . 63.32 109.316 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.54 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 43.2 m -140.23 168.09 20.63 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.479 1.112 . . . . 73.349999999999994 110.065 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.99 ' O ' HD12 ' A' ' 171' ' ' ILE . 73.0 t -122.72 130.96 74.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.546 1.154 . . . . 52.43 109.253 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.99 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.1 mp -142.34 110.74 5.9 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.52 1.138 . . . . 73.099999999999994 109.313 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 172' ' ' PRO . . . . . 0.674 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.0 Cg_endo -75.06 106.77 2.34 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.533 1.807 . . . . 75.430000000000007 110.939 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 173' ' ' MET . . . . . 0.814 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.1 ttt -87.37 155.69 19.92 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.515 1.135 . . . . 62.119999999999997 110.968 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 174' ' ' ARG . . . . . 0.517 HH21 ' HB2' ' A' ' 139' ' ' LEU . 0.0 OUTLIER -115.89 116.53 40.44 Favored Pre-proline 0 C--N 1.325 -0.46 0 O-C-N 124.49 1.119 . . . . 73.209999999999994 110.321 -179.966 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 175' ' ' PRO . . . . . 0.663 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -75.04 160.12 40.41 Favored 'Trans proline' 0 C--N 1.359 1.109 0 O-C-N 124.492 1.786 . . . . 43.25 110.943 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 176' ' ' LEU . . . . . 0.824 HD13 ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -95.25 -43.8 7.9 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.526 1.141 . . . . 73.420000000000002 109.257 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 177' ' ' ASN . . . . . 0.469 ' ND2' ' H ' ' A' ' 177' ' ' ASN . 1.9 p30 -72.77 -25.71 61.28 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.509 1.13 . . . . 60.130000000000003 109.25 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -110.26 102.38 51.05 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.52 1.138 . . . . 73.349999999999994 109.326 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.04 134.32 17.61 Favored 'Trans proline' 0 C--N 1.359 1.118 0 O-C-N 124.48 1.779 . . . . 71.040000000000006 110.969 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.401 ' HA ' HD22 ' A' ' 180' ' ' LEU . 1.2 tm? -141.18 97.18 6.98 Favored Pre-proline 0 C--N 1.326 -0.42 0 O-C-N 124.493 1.121 . . . . 61.520000000000003 109.3 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.02 165.8 30.52 Favored 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.495 1.787 . . . . 61.350000000000001 110.973 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 182' ' ' ARG . . . . . 0.416 ' HG3' ' N ' ' A' ' 183' ' ' GLU . 5.4 ptm180 -68.11 -22.33 64.9 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.54 1.15 . . . . 73.209999999999994 110.283 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 183' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' A' ' 182' ' ' ARG . 11.6 pt-20 -61.96 -14.5 35.45 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.53 1.144 . . . . 72.310000000000002 110.262 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -121.4 3.43 10.26 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.594 1.184 . . . . 74.439999999999998 110.313 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 185' ' ' THR . . . . . 0.864 HG23 HD21 ' A' ' 139' ' ' LEU . 10.5 m -100.42 144.13 27.87 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.476 1.11 . . . . 64.049999999999997 110.425 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 186' ' ' PRO . . . . . 0.786 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -74.95 164.38 33.52 Favored 'Trans proline' 0 C--N 1.36 1.179 0 O-C-N 124.522 1.801 . . . . 72.310000000000002 110.97 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 187' ' ' PHE . . . . . 0.495 ' O ' ' CG2' ' A' ' 191' ' ' THR . 5.7 p90 -77.01 -7.0 54.87 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.515 1.134 . . . . 74.439999999999998 110.996 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -95.03 -51.36 4.69 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.557 1.161 . . . . 74.530000000000001 109.252 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.786 HD12 ' CG ' ' A' ' 186' ' ' PRO . 51.9 mt -68.41 -42.55 78.82 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.555 1.159 . . . . 63.43 109.37 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 190' ' ' GLN . . . . . 0.436 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.9 pt20 -65.3 -9.41 24.07 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.494 1.121 . . . . 74.140000000000001 110.241 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 191' ' ' THR . . . . . 0.495 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 67.7 p -119.32 17.95 13.0 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.472 1.107 . . . . 63.039999999999999 110.439 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.832 HD11 ' O ' ' A' ' 161' ' ' VAL . 7.4 mt -112.97 157.36 13.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.552 1.157 . . . . 72.219999999999999 109.277 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 193' ' ' ASN . . . . . 0.555 HD21 HD11 ' A' ' 171' ' ' ILE . 46.2 p-10 -65.53 75.38 0.06 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.477 1.111 . . . . 72.430000000000007 109.324 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 194' ' ' ALA . . . . . 0.674 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -71.9 149.58 45.0 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.424 1.078 . . . . 74.310000000000002 109.292 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 195' ' ' LEU . . . . . 0.584 HD23 HD12 ' A' ' 209' ' ' ILE . 0.5 OUTLIER -93.15 124.53 37.19 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.533 1.146 . . . . 64.439999999999998 109.291 -179.951 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -118.6 109.17 15.83 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.529 1.143 . . . . 72.209999999999994 110.287 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.819 ' CG ' HD11 ' A' ' 176' ' ' LEU . 14.0 pt-20 -79.63 -34.03 40.93 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.453 1.095 . . . . 73.510000000000005 110.314 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 198' ' ' GLU . . . . . 0.575 ' CG ' HD12 ' A' ' 176' ' ' LEU . 11.7 pt-20 -79.62 2.43 22.51 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.49 1.119 . . . . 64.310000000000002 110.303 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 29.4 t -96.52 145.35 25.78 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.445 1.09 . . . . 53.450000000000003 110.063 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -57.55 -28.69 63.76 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.535 1.147 . . . . 72.439999999999998 110.371 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -93.59 23.44 30.41 Favored Glycine 0 CA--C 1.53 1.027 0 O-C-N 124.552 1.158 . . . . 72.209999999999994 111.03 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 202' ' ' PHE . . . . . 0.863 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.2 OUTLIER -59.04 -43.14 97.04 Favored Pre-proline 0 C--N 1.324 -0.534 0 O-C-N 124.567 0.804 . . . . 75.299999999999997 111.027 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 203' ' ' PRO . . . . . 0.619 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -75.03 -36.05 2.76 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.487 1.783 . . . . 71.030000000000001 110.971 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -57.87 -47.2 83.42 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.483 1.114 . . . . 70.140000000000001 110.36 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 205' ' ' GLN . . . . . 0.401 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 1.8 mt-30 -70.67 -40.04 73.19 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.495 1.122 . . . . 64.439999999999998 110.293 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 206' ' ' VAL . . . . . 0.863 HG23 ' O ' ' A' ' 202' ' ' PHE . 89.7 t -66.85 -27.83 41.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.453 1.095 . . . . 63.229999999999997 109.273 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 207' ' ' GLU . . . . . 0.477 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 2.3 mt-10 -80.31 -51.72 8.56 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.494 1.121 . . . . 72.120000000000005 110.253 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 77.4 mtt180 -62.75 -57.92 9.26 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.518 1.136 . . . . 55.350000000000001 110.34 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 209' ' ' ILE . . . . . 0.766 HG22 ' CD1' ' A' ' 210' ' ' PHE . 65.5 mt -52.49 -53.82 18.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.485 1.116 . . . . 73.019999999999996 109.29 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 210' ' ' PHE . . . . . 0.766 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.1 m-85 -104.97 57.51 0.69 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.488 1.118 . . . . 74.439999999999998 110.959 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 211' ' ' GLN . . . . . 0.503 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -96.23 139.51 32.28 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.414 1.071 . . . . 53.43 110.291 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 212' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 215' ' ' TYR . 56.9 tt0 -49.98 -53.35 27.03 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.516 1.135 . . . . 73.209999999999994 110.309 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -47.1 -24.25 0.63 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.478 1.111 . . . . 64.340000000000003 110.013 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.503 HG23 ' HG2' ' A' ' 211' ' ' GLN . 34.6 t -95.9 -32.02 4.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.513 1.133 . . . . 62.109999999999999 109.261 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 215' ' ' TYR . . . . . 0.45 ' N ' ' O ' ' A' ' 212' ' ' GLU . 4.5 t80 -63.3 -36.41 83.6 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.512 1.133 . . . . 72.530000000000001 111.027 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt -50.4 -60.86 2.57 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.547 1.154 . . . . 72.230000000000004 109.289 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 217' ' ' THR . . . . . 0.966 HG22 HD11 ' A' ' 221' ' ' ILE . 1.3 m -51.98 -46.89 65.03 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.446 1.091 . . . . 73.209999999999994 110.443 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 218' ' ' GLN . . . . . 0.695 ' HA ' HD12 ' A' ' 221' ' ' ILE . 11.0 mm-40 -49.11 -54.67 15.11 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.476 1.11 . . . . 71.010000000000005 110.265 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 219' ' ' GLN . . . . . 0.417 ' NE2' ' HB2' ' A' ' 223' ' ' LYS . 21.8 tp60 -45.42 -52.81 9.59 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.514 1.134 . . . . 75.129999999999995 110.295 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -59.09 -44.87 91.96 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.483 1.115 . . . . 74.019999999999996 110.399 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 221' ' ' ILE . . . . . 0.966 HD11 HG22 ' A' ' 217' ' ' THR . 17.4 mt -59.18 -27.31 36.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.536 1.148 . . . . 72.409999999999997 109.311 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 222' ' ' TRP . . . . . 0.572 ' HB2' ' CE1' ' A' ' 167' ' ' TYR . 21.2 t90 -89.41 -17.42 28.8 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.98 -1.119 . . . . 71.519999999999996 107.98 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 223' ' ' LYS . . . . . 0.417 ' HB2' ' NE2' ' A' ' 219' ' ' GLN . 1.6 tmmm? -85.91 -29.73 23.41 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.457 1.098 . . . . 71.430000000000007 109.351 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 224' ' ' GLU . . . . . 0.463 ' CG ' ' HA ' ' A' ' 221' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.444 0 O-C-N 124.458 1.099 . . . . 72.409999999999997 110.262 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.505 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 2.9 p . . . . . 0 N--CA 1.454 -0.245 0 N-CA-C 109.307 -0.627 . . . . 72.340000000000003 109.307 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.499 ' CE2' ' HG3' ' A' ' 108' ' ' PRO . 51.4 p90 -89.72 30.95 0.98 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.448 1.092 . . . . 71.209999999999994 110.984 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.626 HD11 HG22 ' A' ' 110' ' ' ILE . 6.1 tp -39.91 134.81 1.39 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.553 1.158 . . . . 72.129999999999995 109.359 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.475 ' O ' ' CB ' ' A' ' 133' ' ' ALA . 9.1 ttmt -74.84 -67.07 0.67 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.589 1.181 . . . . 71.319999999999993 109.365 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 1.08 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 1.5 p90 -152.16 140.68 20.69 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.384 1.052 . . . . 64.219999999999999 111.018 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.576 HG12 ' HB ' ' A' ' 135' ' ' THR . 8.6 p -84.07 171.59 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 O-C-N 124.48 1.112 . . . . 64.340000000000003 109.306 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 1.08 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 2.8 mp -137.4 86.04 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.574 1.172 . . . . 73.540000000000006 109.224 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.753 HD11 ' HB3' ' A' ' 128' ' ' ALA . 12.8 mt -70.41 101.38 1.94 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.501 1.125 . . . . 73.430000000000007 109.275 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.654 ' CE1' ' HB2' ' A' ' 113' ' ' ALA . 0.0 OUTLIER -121.32 174.62 6.61 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 124.552 1.157 . . . . 65.150000000000006 109.6 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.435 ' HB2' ' CD1' ' A' ' 143' ' ' PHE . . . -117.37 164.49 14.78 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.444 1.09 . . . . 74.400000000000006 109.252 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.4 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 21.0 tt0 -63.54 -11.4 24.04 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.512 1.132 . . . . 71.540000000000006 110.316 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -83.66 -45.93 12.89 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.488 1.118 . . . . 44.210000000000001 109.278 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.415 ' CG ' HD23 ' A' ' 138' ' ' LEU . 1.3 p30 -123.05 44.44 2.66 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.475 1.11 . . . . 74.519999999999996 109.324 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.623 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -76.03 -28.94 57.89 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.49 1.119 . . . . 71.319999999999993 110.42 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -84.72 -24.2 29.0 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.472 1.108 . . . . 73.230000000000004 109.408 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.424 ' HG3' ' ND2' ' A' ' 177' ' ' ASN . 0.0 OUTLIER -71.68 -54.73 9.38 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.495 1.122 . . . . 43.340000000000003 110.325 179.972 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.944 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -59.63 -35.63 74.75 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.471 1.107 . . . . 45.020000000000003 109.296 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.842 HD22 ' O ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -69.95 -49.6 50.17 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.537 1.148 . . . . 64.420000000000002 109.249 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.705 ' N ' HD13 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -44.97 -37.83 4.29 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.515 1.134 . . . . 63.009999999999998 110.232 -179.955 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.591 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.1 t -73.63 -64.51 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.489 1.118 . . . . 53.0 109.268 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.453 ' N ' HG12 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -41.67 -26.53 0.08 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.463 1.102 . . . . 74.200000000000003 110.302 -179.95 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.449 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.2 OUTLIER -71.34 -49.68 39.96 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.516 1.135 . . . . 73.299999999999997 109.286 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.85 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -74.95 -22.19 58.72 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.555 1.159 . . . . 74.120000000000005 109.333 -179.995 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.85 ' N ' HD23 ' A' ' 99' ' ' LEU . 30.8 mt -62.83 -51.73 65.89 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.529 1.143 . . . . 65.319999999999993 109.281 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 101' ' ' GLN . 10.0 pt20 -79.81 51.48 1.32 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.538 1.149 . . . . 73.120000000000005 110.297 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -170.13 -66.55 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.566 1.166 . . . . 61.140000000000001 109.27 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -50.28 -44.67 53.95 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.466 1.104 . . . . 72.430000000000007 109.36 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.513 ' HE2' HD23 ' A' ' 100' ' ' LEU . 1.6 m-85 -116.5 -32.27 5.28 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.514 1.134 . . . . 74.530000000000001 111.011 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.429 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 98.47 44.7 2.47 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 124.474 1.109 . . . . 64.409999999999997 110.978 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.414 HG23 ' HD3' ' A' ' 80' ' ' LYS . 8.9 mm -84.1 72.64 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.519 0.776 . . . . 71.230000000000004 109.31 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.522 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -119.9 156.69 54.01 Favored Pre-proline 0 C--N 1.324 -0.51 0 O-C-N 124.515 1.135 . . . . 74.439999999999998 109.322 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.522 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.1 Cg_endo -75.06 164.39 88.49 Favored 'Cis proline' 0 C--N 1.359 1.121 0 C-N-CA 120.994 -2.502 . . . . 65.209999999999994 110.953 0.025 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.44 125.4 5.02 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.405 1.066 . . . . 72.340000000000003 111.008 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.626 HG22 HD11 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -141.17 130.27 24.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.439 0.729 . . . . 70.310000000000002 109.271 179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ILE . . . . . 1.107 HD12 ' HB3' ' A' ' 113' ' ' ALA . 1.8 pt -94.19 148.49 4.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 124.447 1.092 . . . . 72.230000000000004 109.326 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.573 ' CE1' HD21 ' A' ' 84' ' ' LEU . 2.6 t80 -51.59 -20.25 1.88 Allowed 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.49 1.119 . . . . 70.420000000000002 110.965 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 1.107 ' HB3' HD12 ' A' ' 111' ' ' ILE . . . -78.89 -35.98 42.78 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.512 1.132 . . . . 64.439999999999998 109.288 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -83.37 -24.87 31.83 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.474 1.109 . . . . 71.400000000000006 110.327 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 42.1 tpp -37.37 110.81 0.51 Allowed Pre-proline 0 C--N 1.326 -0.45 0 O-C-N 124.536 1.147 . . . . 74.5 110.997 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo . . . . . 0 C--N 1.36 1.158 0 O-C-N 124.525 1.803 . . . . 74.409999999999997 110.994 179.993 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.779 HD12 ' N ' ' A' ' 126' ' ' ASP . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.302 0 N-CA-C 109.31 -0.626 . . . . 71.430000000000007 109.31 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.779 ' N ' HD12 ' A' ' 125' ' ' LEU . 1.4 t70 -59.8 -20.23 55.52 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.504 1.127 . . . . 71.409999999999997 109.328 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -55.3 -21.87 16.49 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.434 1.084 . . . . 72.519999999999996 109.281 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.753 ' HB3' HD11 ' A' ' 84' ' ' LEU . . . -77.42 -40.87 41.99 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.488 1.118 . . . . 62.420000000000002 109.326 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.534 HG11 HG22 ' A' ' 170' ' ' VAL . 3.6 m -92.27 29.3 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 O-C-N 124.576 1.173 . . . . 73.530000000000001 109.26 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 24.4 m-20 -109.97 124.22 51.03 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.493 1.121 . . . . 73.120000000000005 109.283 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' GLY . . . . . 0.556 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 44.21 73.05 0.28 Allowed Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.532 1.145 . . . . 41.200000000000003 111.028 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' SER . . . . . 0.402 ' O ' ' O ' ' A' ' 167' ' ' TYR . 2.5 m -162.96 -175.79 4.56 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.491 0.76 . . . . 73.239999999999995 109.955 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.564 ' CB ' ' CE3' ' A' ' 134' ' ' TRP . . . -99.83 -77.11 0.53 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.497 1.123 . . . . 54.219999999999999 109.296 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.586 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 0.8 OUTLIER -125.18 176.16 6.91 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.544 1.153 . . . . 74.030000000000001 108.001 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 135' ' ' THR . . . . . 0.576 ' HB ' HG12 ' A' ' 82' ' ' VAL . 3.4 t -153.98 130.86 10.89 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.462 1.101 . . . . 73.329999999999998 110.423 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.763 HD13 ' HE2' ' A' ' 81' ' ' PHE . 1.4 mp -84.33 133.53 29.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.514 1.134 . . . . 64.040000000000006 109.303 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.692 HD11 ' CG1' ' A' ' 170' ' ' VAL . 10.2 mt -116.13 96.75 5.71 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.51 1.131 . . . . 75.109999999999999 109.311 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.944 HD21 ' HB2' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.34 92.08 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.522 1.139 . . . . 63.219999999999999 109.311 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.576 HD11 ' HB2' ' A' ' 172' ' ' PRO . 97.4 mt -68.43 111.04 4.42 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.513 1.133 . . . . 61.340000000000003 109.3 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 140' ' ' THR . . . . . 0.663 HG23 ' CG ' ' A' ' 178' ' ' ASN . 4.5 m -124.61 160.97 27.26 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 124.482 1.114 . . . . 72.140000000000001 110.47 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -56.04 -39.12 71.51 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.523 1.14 . . . . 73.430000000000007 110.352 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -89.6 -52.62 4.92 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.452 1.095 . . . . 71.310000000000002 109.318 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.54 ' CE2' HG21 ' A' ' 147' ' ' THR . 55.3 t80 -53.23 -24.92 12.34 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.536 1.148 . . . . 72.540000000000006 110.968 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.611 HD13 ' N ' ' A' ' 145' ' ' ARG . 2.0 tm? -70.95 -67.19 0.52 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.545 1.153 . . . . 75.340000000000003 109.304 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.611 ' N ' HD13 ' A' ' 144' ' ' LEU . 0.8 OUTLIER -46.23 -25.03 0.54 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.526 1.141 . . . . 70.319999999999993 110.296 179.99 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -81.03 -54.54 5.46 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.545 1.153 . . . . 55.100000000000001 109.263 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.545 ' O ' ' CG ' ' A' ' 151' ' ' PHE . 27.2 p -70.48 -7.54 44.23 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.497 1.123 . . . . 74.319999999999993 110.414 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.564 ' CZ2' ' HB3' ' A' ' 186' ' ' PRO . 0.8 OUTLIER -96.77 -25.75 15.39 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.447 1.092 . . . . 75.230000000000004 108.059 179.916 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 14.5 t -82.77 -39.48 21.77 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.448 1.093 . . . . 74.420000000000002 108.269 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' ASN . . . . . 0.405 ' O ' ' N ' ' A' ' 154' ' ' TYR . 4.0 m120 -68.12 -53.13 27.6 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.442 1.089 . . . . 75.150000000000006 109.269 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 1.009 ' CZ ' HD12 ' A' ' 157' ' ' LEU . 6.9 m-30 -46.43 -53.2 11.55 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.512 1.132 . . . . 74.120000000000005 111.01 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -46.83 -47.53 21.12 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.534 1.146 . . . . 74.430000000000007 110.301 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -79.54 -19.43 49.57 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.581 1.176 . . . . 74.409999999999997 110.965 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.405 ' N ' ' O ' ' A' ' 150' ' ' ASN . 3.1 m-30 -113.31 97.82 6.72 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.551 1.157 . . . . 73.540000000000006 110.998 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.49 ' O ' ' ND2' ' A' ' 159' ' ' ASN . 1.2 t -74.93 -3.01 29.63 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.509 1.131 . . . . 64.120000000000005 110.389 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 8.8 t -78.51 -67.82 0.7 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.578 1.174 . . . . 54.32 109.939 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 1.009 HD12 ' CZ ' ' A' ' 151' ' ' PHE . 0.4 OUTLIER -44.04 -51.69 7.65 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.491 1.12 . . . . 71.340000000000003 109.263 -179.933 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 158' ' ' MET . . . . . 0.488 ' HA ' ' CE ' ' A' ' 158' ' ' MET . 6.6 mmt -44.15 -43.24 6.91 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.558 1.161 . . . . 75.120000000000005 110.937 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 159' ' ' ASN . . . . . 0.49 ' ND2' ' O ' ' A' ' 155' ' ' THR . 5.2 m120 -64.24 -42.29 96.6 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 74.209999999999994 109.241 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 160' ' ' SER . . . . . 0.575 ' HB2' HG21 ' A' ' 170' ' ' VAL . 1.3 m -59.37 -35.2 73.46 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.592 1.183 . . . . 72.140000000000001 110.001 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 161' ' ' VAL . . . . . 0.861 ' O ' HD13 ' A' ' 192' ' ' ILE . 36.1 t -62.08 -18.36 19.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 O-C-N 124.577 1.173 . . . . 71.430000000000007 109.348 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -87.48 11.42 14.79 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.579 1.174 . . . . 70.319999999999993 109.282 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.697 ' NE ' HG23 ' A' ' 192' ' ' ILE . 0.6 OUTLIER 38.75 59.08 1.63 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.55 1.156 . . . . 74.5 110.271 -179.956 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -73.17 -173.11 1.23 Allowed 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.557 1.161 . . . . 74.109999999999999 110.284 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 27.6 p80 -85.59 51.04 2.08 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.528 1.143 . . . . 64.519999999999996 109.595 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.584 ' C ' HG21 ' A' ' 221' ' ' ILE . 0.0 OUTLIER -109.9 173.33 6.38 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.518 1.136 . . . . 75.450000000000003 109.23 -179.984 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 167' ' ' TYR . . . . . 0.402 ' O ' ' O ' ' A' ' 132' ' ' SER . 28.2 p90 -87.46 40.33 0.92 Allowed 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.465 1.103 . . . . 75.099999999999994 110.964 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -164.16 124.13 2.06 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.519 1.137 . . . . 71.319999999999993 109.296 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.504 ' HB3' ' CD1' ' A' ' 134' ' ' TRP . 27.6 t -118.28 105.79 12.12 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.441 1.088 . . . . 74.230000000000004 110.052 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.692 ' CG1' HD11 ' A' ' 137' ' ' LEU . 5.0 t -79.53 122.08 34.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.495 1.122 . . . . 65.510000000000005 109.319 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.597 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.3 mp -128.67 113.74 19.24 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.464 1.103 . . . . 51.310000000000002 109.251 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 172' ' ' PRO . . . . . 0.915 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.1 Cg_endo -75.04 107.43 2.48 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.502 1.791 . . . . 74.209999999999994 110.992 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 173' ' ' MET . . . . . 0.664 ' CE ' HD12 ' A' ' 195' ' ' LEU . 3.2 ttt -87.75 152.25 22.27 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.501 1.126 . . . . 64.420000000000002 110.976 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 174' ' ' ARG . . . . . 0.424 ' N ' ' HG2' ' A' ' 173' ' ' MET . 0.0 OUTLIER -100.76 112.41 64.64 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.509 1.131 . . . . 63.020000000000003 110.305 179.975 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 175' ' ' PRO . . . . . 0.413 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.2 Cg_endo -74.97 151.57 39.86 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.58 1.831 . . . . 74.019999999999996 111.026 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 176' ' ' LEU . . . . . 0.873 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -86.56 -42.68 13.31 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.581 1.175 . . . . 65.219999999999999 109.33 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 177' ' ' ASN . . . . . 0.424 ' ND2' ' HG3' ' A' ' 92' ' ' GLU . 7.2 p30 -72.17 -28.0 62.94 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.528 1.142 . . . . 71.209999999999994 109.269 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 178' ' ' ASN . . . . . 0.663 ' CG ' HG23 ' A' ' 140' ' ' THR . 6.7 m-20 -110.7 98.19 36.41 Favored Pre-proline 0 C--N 1.324 -0.507 0 O-C-N 124.533 1.146 . . . . 73.400000000000006 109.325 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.98 114.98 4.15 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.565 1.824 . . . . 43.100000000000001 110.992 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.628 HD12 ' OG1' ' A' ' 185' ' ' THR . 0.4 OUTLIER -121.88 96.65 46.8 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.509 1.131 . . . . 71.310000000000002 109.313 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.05 167.49 26.89 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.44 1.758 . . . . 55.43 110.989 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 14.4 ptt180 -61.55 -25.58 67.39 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.563 1.164 . . . . 71.219999999999999 110.33 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -71.31 -9.99 59.03 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.433 1.083 . . . . 72.510000000000005 110.343 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -112.95 -28.87 7.56 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.482 1.114 . . . . 74.040000000000006 110.295 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 185' ' ' THR . . . . . 0.628 ' OG1' HD12 ' A' ' 180' ' ' LEU . 53.4 m -72.3 143.92 86.29 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.463 1.102 . . . . 70.510000000000005 110.352 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 186' ' ' PRO . . . . . 0.669 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.7 Cg_endo -74.96 146.56 32.96 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.492 1.785 . . . . 62.420000000000002 111.067 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 187' ' ' PHE . . . . . 0.606 ' O ' HG23 ' A' ' 191' ' ' THR . 24.7 p90 -61.69 -12.49 16.71 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.56 1.162 . . . . 73.540000000000006 110.991 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 188' ' ' ALA . . . . . 0.417 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -87.05 -53.62 4.77 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.53 1.144 . . . . 53.409999999999997 109.306 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.669 HD12 ' CG ' ' A' ' 186' ' ' PRO . 23.2 mt -74.53 -16.34 60.83 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.562 1.164 . . . . 53.299999999999997 109.311 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 190' ' ' GLN . . . . . 0.401 ' O ' ' CG ' ' A' ' 190' ' ' GLN . 6.2 tt0 -86.68 -8.25 57.59 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.567 1.167 . . . . 64.120000000000005 110.243 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 191' ' ' THR . . . . . 0.606 HG23 ' O ' ' A' ' 187' ' ' PHE . 31.5 p -115.73 18.71 15.63 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.515 1.134 . . . . 75.140000000000001 110.322 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.861 HD13 ' O ' ' A' ' 161' ' ' VAL . 8.8 mt -130.73 145.84 34.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.444 1.09 . . . . 54.340000000000003 109.248 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -52.77 118.53 3.73 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.504 1.127 . . . . 41.0 109.27 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 194' ' ' ALA . . . . . 0.915 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -110.95 177.6 4.61 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.5 1.125 . . . . 70.329999999999998 109.297 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 195' ' ' LEU . . . . . 0.665 HD23 HD12 ' A' ' 209' ' ' ILE . 0.2 OUTLIER -109.63 127.84 54.82 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.452 1.095 . . . . 74.099999999999994 109.238 -179.958 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -109.51 120.04 41.28 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.526 1.141 . . . . 75.349999999999994 110.258 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.873 ' HG3' HD21 ' A' ' 176' ' ' LEU . 12.0 tp10 -101.84 -22.41 14.36 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.516 1.135 . . . . 63.100000000000001 110.236 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 198' ' ' GLU . . . . . 0.432 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 1.3 pt-20 -94.06 9.88 35.9 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.455 1.097 . . . . 75.5 110.298 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 2.3 t -112.31 151.22 29.96 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.504 1.127 . . . . 64.099999999999994 109.979 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 26.5 ttt85 -64.23 -26.46 68.51 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.52 1.138 . . . . 72.540000000000006 110.286 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -89.51 26.7 8.75 Favored Glycine 0 CA--C 1.53 0.989 0 O-C-N 124.465 1.103 . . . . 63.039999999999999 111.001 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 202' ' ' PHE . . . . . 0.778 ' O ' HG23 ' A' ' 206' ' ' VAL . 3.3 t80 -68.34 -38.72 13.75 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 124.506 0.768 . . . . 73.510000000000005 110.972 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 203' ' ' PRO . . . . . 0.687 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.1 Cg_endo -74.95 -30.11 7.59 Favored 'Trans proline' 0 C--N 1.36 1.168 0 O-C-N 124.519 1.8 . . . . 62.439999999999998 111.021 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 204' ' ' THR . . . . . 0.419 HG22 ' N ' ' A' ' 205' ' ' GLN . 0.9 OUTLIER -64.14 -65.73 0.64 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.475 1.109 . . . . 72.530000000000001 110.4 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 205' ' ' GLN . . . . . 0.419 ' N ' HG22 ' A' ' 204' ' ' THR . 7.4 mt-30 -50.09 -41.82 48.92 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.49 1.118 . . . . 73.340000000000003 110.334 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 206' ' ' VAL . . . . . 0.794 HG11 HD22 ' A' ' 100' ' ' LEU . 53.7 t -59.84 -30.06 44.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.514 1.134 . . . . 62.329999999999998 109.288 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -79.81 -53.25 6.96 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.516 1.135 . . . . 70.040000000000006 110.297 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 208' ' ' ARG . . . . . 0.419 ' N ' ' HD2' ' A' ' 208' ' ' ARG . 3.2 mpt_? -55.91 -59.15 5.3 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.503 1.127 . . . . 73.319999999999993 110.305 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 209' ' ' ILE . . . . . 0.665 HD12 HD23 ' A' ' 195' ' ' LEU . 73.2 mt -54.29 -59.15 2.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.572 1.17 . . . . 73.510000000000005 109.29 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 210' ' ' PHE . . . . . 0.647 ' CD2' HG13 ' A' ' 206' ' ' VAL . 1.0 OUTLIER -92.17 62.34 4.11 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.501 1.126 . . . . 73.310000000000002 111.05 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 211' ' ' GLN . . . . . 0.536 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -110.87 145.46 38.23 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.52 1.137 . . . . 73.319999999999993 110.289 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 212' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 215' ' ' TYR . 27.8 tt0 -49.11 -55.14 13.19 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.487 1.117 . . . . 74.140000000000001 110.333 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.68 -24.23 1.3 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.517 1.136 . . . . 71.540000000000006 110.022 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.536 HG23 ' HG2' ' A' ' 211' ' ' GLN . 40.4 t -96.31 -27.46 3.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.539 1.149 . . . . 42.140000000000001 109.265 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 215' ' ' TYR . . . . . 0.447 ' N ' ' O ' ' A' ' 212' ' ' GLU . 12.0 t80 -66.08 -27.21 67.9 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.493 1.121 . . . . 64.239999999999995 110.973 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 216' ' ' LYS . . . . . 0.443 ' O ' ' N ' ' A' ' 220' ' ' THR . 12.8 mmtp -59.49 -58.27 9.35 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.382 1.051 . . . . 53.140000000000001 109.274 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 217' ' ' THR . . . . . 0.636 HG22 HD11 ' A' ' 221' ' ' ILE . 4.4 m -50.1 -62.94 1.28 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.503 1.127 . . . . 64.340000000000003 110.355 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 218' ' ' GLN . . . . . 0.475 ' HA ' HD12 ' A' ' 221' ' ' ILE . 3.5 mp0 -54.2 -27.1 32.1 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.533 1.146 . . . . 64.25 110.333 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 219' ' ' GLN . . . . . 0.444 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 30.8 tp60 -82.29 -25.86 33.63 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.464 1.102 . . . . 71.209999999999994 110.269 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 220' ' ' THR . . . . . 0.444 ' O ' ' CG ' ' A' ' 224' ' ' GLU . 1.1 m -88.09 -20.32 25.86 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.53 1.144 . . . . 74.540000000000006 110.388 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 221' ' ' ILE . . . . . 0.636 HD11 HG22 ' A' ' 217' ' ' THR . 19.8 mt -82.12 -41.76 18.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.424 1.078 . . . . 72.120000000000005 109.27 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 222' ' ' TRP . . . . . 0.556 ' CD1' ' HA2' ' A' ' 131' ' ' GLY . 13.9 t90 -64.51 -55.86 17.9 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.507 1.13 . . . . 73.329999999999998 107.999 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.02 -18.64 25.48 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.46 1.1 . . . . 73.340000000000003 109.318 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 224' ' ' GLU . . . . . 0.444 ' CG ' ' O ' ' A' ' 220' ' ' THR . 3.0 mm-40 . . . . . 0 C--N 1.325 -0.468 0 O-C-N 124.522 1.139 . . . . 72.349999999999994 110.304 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.592 HG22 ' H ' ' A' ' 79' ' ' LEU . 6.5 p . . . . . 0 N--CA 1.452 -0.34 0 N-CA-C 109.274 -0.639 . . . . 74.310000000000002 109.274 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.415 ' O ' ' C ' ' A' ' 79' ' ' LEU . 34.1 t80 -80.38 12.76 2.77 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.463 1.102 . . . . 74.540000000000006 111.016 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.592 ' H ' HG22 ' A' ' 77' ' ' VAL . 15.5 tp -39.19 157.58 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.531 1.144 . . . . 71.400000000000006 109.299 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.834 ' HZ3' ' HA ' ' A' ' 106' ' ' ILE . 5.0 ptpt -100.83 -45.81 5.33 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.515 1.134 . . . . 70.349999999999994 109.333 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.833 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.7 OUTLIER -167.78 129.1 1.46 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.46 1.1 . . . . 73.299999999999997 110.963 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.953 HG12 HG22 ' A' ' 135' ' ' THR . 9.3 p -84.51 174.33 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.506 1.129 . . . . 74.140000000000001 109.317 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.861 ' CG2' ' HB1' ' A' ' 93' ' ' ALA . 2.1 mp -129.32 95.1 2.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.419 1.075 . . . . 70.439999999999998 109.344 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.814 HD11 ' HB3' ' A' ' 128' ' ' ALA . 1.0 OUTLIER -74.21 93.73 2.37 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.479 1.112 . . . . 74.409999999999997 109.232 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.706 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -112.85 174.49 5.87 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.49 1.119 . . . . 73.439999999999998 109.643 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.86 ' HB2' ' CD1' ' A' ' 143' ' ' PHE . . . -110.75 148.35 32.51 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.472 1.107 . . . . 62.530000000000001 109.276 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -50.3 -21.8 1.54 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.562 1.164 . . . . 74.519999999999996 110.411 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -77.37 -46.26 23.36 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.47 1.106 . . . . 72.439999999999998 109.299 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.68 ' CB ' HD12 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -117.05 44.46 2.07 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.581 1.176 . . . . 75.109999999999999 109.288 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.609 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -76.79 -44.1 34.12 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.478 1.112 . . . . 72.120000000000005 110.366 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -63.14 -37.67 88.13 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.487 1.117 . . . . 51.32 109.339 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.446 ' O ' ' N ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -55.63 -69.38 0.14 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.428 1.08 . . . . 61.299999999999997 110.339 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 1.154 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -47.73 -36.75 11.89 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.496 1.122 . . . . 52.229999999999997 109.268 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.646 HD23 ' O ' ' A' ' 94' ' ' LEU . 0.6 OUTLIER -67.7 -36.18 80.18 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.466 1.104 . . . . 75.420000000000002 109.364 179.936 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.446 ' N ' ' O ' ' A' ' 92' ' ' GLU . 17.5 tpp85 -61.0 -47.84 84.58 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.448 1.093 . . . . 73.540000000000006 110.32 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.622 HG21 ' HE1' ' A' ' 173' ' ' MET . 0.3 OUTLIER -69.59 -52.83 28.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.595 1.185 . . . . 74.140000000000001 109.31 179.993 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.549 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -51.8 -17.77 1.05 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.612 1.195 . . . . 71.150000000000006 110.347 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.411 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.3 OUTLIER -81.83 -52.41 7.14 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.484 1.115 . . . . 74.209999999999994 109.27 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.827 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -68.16 -22.46 64.85 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.475 1.109 . . . . 74.430000000000007 109.328 -179.937 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.827 ' N ' HD23 ' A' ' 99' ' ' LEU . 32.8 mt -66.81 -48.36 69.19 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.46 1.1 . . . . 73.040000000000006 109.298 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -79.52 52.84 1.45 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.501 1.126 . . . . 72.420000000000002 110.323 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -175.97 -64.17 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.529 1.143 . . . . 62.409999999999997 109.263 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -46.01 -45.95 16.19 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.473 1.108 . . . . 63.210000000000001 109.283 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -116.47 -32.02 5.38 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.444 1.09 . . . . 70.519999999999996 111.01 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.404 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 108.15 37.9 2.07 Favored Glycine 0 CA--C 1.53 1.02 0 O-C-N 124.538 1.148 . . . . 73.439999999999998 111.015 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.834 ' HA ' ' HZ3' ' A' ' 80' ' ' LYS . 16.6 mm -78.56 74.87 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.516 0.774 . . . . 72.150000000000006 109.362 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.557 ' H ' ' NZ ' ' A' ' 80' ' ' LYS . 0.0 OUTLIER -126.92 155.99 74.76 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.516 1.135 . . . . 72.109999999999999 109.28 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.53 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.4 Cg_endo -74.94 161.22 95.27 Favored 'Cis proline' 0 C--N 1.36 1.152 0 C-N-CA 121.026 -2.489 . . . . 61.219999999999999 111.02 -0.031 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -117.6 119.3 4.38 Favored Glycine 0 CA--C 1.53 0.97 0 O-C-N 124.422 1.076 . . . . 61.450000000000003 111.036 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.402 HD11 ' C ' ' A' ' 114' ' ' GLU . 0.0 OUTLIER -138.95 128.59 31.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.469 0.746 . . . . 72.5 109.287 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ILE . . . . . 0.706 HD12 ' NE2' ' A' ' 85' ' ' HIS . 39.3 pt -89.28 174.4 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.456 1.097 . . . . 72.200000000000003 109.323 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.986 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 2.4 t80 -75.2 -18.65 60.1 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.418 1.074 . . . . 71.409999999999997 110.967 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.5 -3.11 53.53 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.493 1.121 . . . . 71.319999999999993 109.256 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.402 ' C ' HD11 ' A' ' 110' ' ' ILE . 23.5 mt-10 -107.65 -26.74 10.71 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.532 1.145 . . . . 71.129999999999995 110.281 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 35.6 tpp -41.72 110.77 0.81 Allowed Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.502 1.126 . . . . 74.25 111.011 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo . . . . . 0 C--N 1.36 1.148 0 O-C-N 124.479 1.779 . . . . 74.400000000000006 111.066 179.949 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 1.04 HD11 HD11 ' A' ' 157' ' ' LEU . 3.6 pp . . . . . 0 N--CA 1.454 -0.269 0 N-CA-C 109.304 -0.628 . . . . 65.129999999999995 109.304 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -63.09 -14.3 46.7 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.566 1.166 . . . . 74.549999999999997 109.332 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.48 -48.79 65.7 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.438 1.087 . . . . 51.450000000000003 109.292 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.986 ' HB2' ' CE1' ' A' ' 112' ' ' PHE . . . -65.64 -22.71 66.67 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.499 1.124 . . . . 61.240000000000002 109.357 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.627 ' O ' HG12 ' A' ' 129' ' ' VAL . 70.9 t -86.6 10.04 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.517 1.136 . . . . 72.230000000000004 109.339 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -135.64 119.34 17.15 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 124.534 1.146 . . . . 75.219999999999999 109.302 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 91.76 47.98 3.29 Favored Glycine 0 CA--C 1.53 0.974 0 O-C-N 124.474 1.109 . . . . 51.420000000000002 111.033 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' SER . . . . . 0.51 ' OG ' HD23 ' A' ' 79' ' ' LEU . 3.2 m -163.35 171.14 16.5 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.496 0.762 . . . . 75.310000000000002 109.956 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.525 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -104.85 -27.35 11.79 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.535 1.147 . . . . 60.43 109.251 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.587 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 6.6 m-90 -158.82 157.83 32.34 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.536 1.148 . . . . 74.230000000000004 108.0 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' THR . . . . . 0.953 HG22 HG12 ' A' ' 82' ' ' VAL . 6.3 p -140.56 128.77 22.31 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.5 1.125 . . . . 61.340000000000003 110.412 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.54 HD13 ' HE2' ' A' ' 81' ' ' PHE . 1.4 mp -84.07 149.6 4.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 124.423 1.077 . . . . 71.230000000000004 109.321 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.678 HD11 HG13 ' A' ' 170' ' ' VAL . 47.6 mt -131.35 108.02 9.35 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.507 1.13 . . . . 74.010000000000005 109.356 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 1.154 HD21 ' HB2' ' A' ' 93' ' ' ALA . 1.4 mm? -62.35 93.25 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.502 1.126 . . . . 63.32 109.306 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.853 HD21 HG23 ' A' ' 185' ' ' THR . 6.3 tp -69.12 99.15 1.08 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.55 1.156 . . . . 73.140000000000001 109.334 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 140' ' ' THR . . . . . 0.427 ' O ' ' N ' ' A' ' 144' ' ' LEU . 2.5 m -127.05 162.68 25.47 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.568 1.167 . . . . 71.219999999999999 110.401 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -69.41 -29.95 67.81 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.5 1.125 . . . . 70.5 110.329 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -89.61 -25.06 21.49 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.457 1.098 . . . . 62.229999999999997 109.318 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.86 ' CD1' ' HB2' ' A' ' 86' ' ' ALA . 82.0 t80 -90.16 -19.8 23.82 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.472 1.107 . . . . 73.019999999999996 111.016 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.584 HD13 ' C ' ' A' ' 144' ' ' LEU . 2.7 tm? -53.62 -67.61 0.24 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.602 1.188 . . . . 75.430000000000007 109.292 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.49 ' N ' HD13 ' A' ' 144' ' ' LEU . 54.6 mmm-85 -57.98 -16.38 12.25 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.545 1.153 . . . . 61.43 110.273 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -77.47 -34.68 54.27 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.522 1.139 . . . . 52.100000000000001 109.336 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.855 HG21 ' CE2' ' A' ' 143' ' ' PHE . 2.1 p -102.87 -8.3 20.85 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.555 1.16 . . . . 73.329999999999998 110.406 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.424 ' HA ' ' CE3' ' A' ' 148' ' ' TRP . 0.3 OUTLIER -95.85 -25.35 16.05 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.077 -1.082 . . . . 62.229999999999997 108.077 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 16.8 t -92.53 -37.71 12.34 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.534 1.146 . . . . 71.340000000000003 108.275 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' ASN . . . . . 0.516 ' O ' ' CG ' ' A' ' 154' ' ' TYR . 68.7 m-20 -68.47 -49.65 58.25 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.52 1.137 . . . . 73.439999999999998 109.255 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.789 ' CD1' HD13 ' A' ' 157' ' ' LEU . 6.4 m-30 -60.88 -55.33 34.34 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.505 1.128 . . . . 63.210000000000001 111.007 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 30.3 tp60 -48.1 -47.74 34.16 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.517 1.136 . . . . 54.310000000000002 110.323 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -74.1 -20.3 60.31 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.495 1.122 . . . . 74.239999999999995 110.962 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.516 ' CG ' ' O ' ' A' ' 150' ' ' ASN . 15.8 m-30 -117.79 83.2 1.95 Allowed 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.49 1.119 . . . . 71.420000000000002 111.032 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.3 t -49.7 -22.84 1.49 Allowed 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.429 1.081 . . . . 73.25 110.364 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 11.3 p -62.03 -40.58 96.22 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.49 1.119 . . . . 65.340000000000003 109.992 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 1.04 HD11 HD11 ' A' ' 125' ' ' LEU . 6.4 mt -68.5 -47.41 67.07 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.441 1.088 . . . . 65.0 109.272 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 158' ' ' MET . . . . . 0.436 ' HE2' HG11 ' A' ' 161' ' ' VAL . 5.3 mmt -47.04 -33.04 4.45 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.512 1.133 . . . . 64.420000000000002 111.0 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -66.11 -44.76 83.36 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 124.496 1.122 . . . . 52.340000000000003 109.328 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 160' ' ' SER . . . . . 0.542 ' HB3' HG21 ' A' ' 170' ' ' VAL . 1.4 m -71.83 -28.76 63.79 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.542 1.151 . . . . 74.239999999999995 110.011 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 161' ' ' VAL . . . . . 0.649 ' CG2' ' CE2' ' A' ' 151' ' ' PHE . 3.5 t -56.84 -18.08 6.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.508 1.13 . . . . 73.25 109.318 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 162' ' ' ASN . . . . . 0.479 ' O ' ' N ' ' A' ' 164' ' ' GLN . 1.5 t-20 -90.61 20.97 4.24 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.491 1.12 . . . . 74.140000000000001 109.354 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.422 ' C ' ' O ' ' A' ' 162' ' ' ASN . 0.1 OUTLIER 36.43 31.79 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.492 1.12 . . . . 71.450000000000003 110.294 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 164' ' ' GLN . . . . . 0.479 ' N ' ' O ' ' A' ' 162' ' ' ASN . 81.4 mt-30 -38.34 132.03 1.12 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.471 1.107 . . . . 65.430000000000007 110.224 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 165' ' ' HIS . . . . . 0.527 ' CG ' ' O ' ' A' ' 165' ' ' HIS . 5.4 p80 -69.47 72.2 0.32 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.513 1.133 . . . . 73.430000000000007 109.565 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.502 ' O ' ' NE2' ' A' ' 218' ' ' GLN . 0.5 OUTLIER -125.13 -178.7 4.28 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.467 1.104 . . . . 63.299999999999997 109.336 179.928 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 167' ' ' TYR . . . . . 0.467 ' CD1' ' HB2' ' A' ' 168' ' ' ASN . 37.8 p90 -49.82 -35.83 24.38 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.662 1.226 . . . . 73.0 111.029 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 168' ' ' ASN . . . . . 0.467 ' HB2' ' CD1' ' A' ' 167' ' ' TYR . 2.9 t30 -117.12 129.41 55.95 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.52 1.138 . . . . 74.299999999999997 109.323 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.451 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 0.4 OUTLIER -119.87 155.59 32.37 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.436 1.085 . . . . 62.509999999999998 109.992 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.804 ' C ' HD12 ' A' ' 171' ' ' ILE . 18.5 t -118.82 122.06 68.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.437 1.086 . . . . 54.210000000000001 109.26 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.804 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -127.1 112.84 21.71 Favored Pre-proline 0 C--N 1.324 -0.522 0 O-C-N 124.503 1.127 . . . . 71.340000000000003 109.348 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 172' ' ' PRO . . . . . 0.719 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.96 106.6 2.3 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.518 1.799 . . . . 75.329999999999998 111.024 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 173' ' ' MET . . . . . 0.647 ' CE ' HD12 ' A' ' 195' ' ' LEU . 11.0 ttt -82.92 166.32 18.99 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.531 1.144 . . . . 74.329999999999998 110.943 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 174' ' ' ARG . . . . . 0.424 ' N ' ' HG2' ' A' ' 173' ' ' MET . 17.0 mmm-85 -131.21 126.47 21.47 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.485 1.115 . . . . 74.209999999999994 110.356 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 175' ' ' PRO . . . . . 0.489 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.4 Cg_endo -75.01 163.18 35.83 Favored 'Trans proline' 0 C--N 1.36 1.14 0 O-C-N 124.481 1.78 . . . . 73.439999999999998 110.984 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 176' ' ' LEU . . . . . 0.921 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -94.85 -47.19 6.56 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.531 1.144 . . . . 73.540000000000006 109.289 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -71.27 -25.27 62.39 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.533 1.146 . . . . 63.350000000000001 109.365 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 178' ' ' ASN . . . . . 0.489 ' CB ' ' HG2' ' A' ' 175' ' ' PRO . 7.5 m-80 -109.39 100.95 43.78 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.551 1.157 . . . . 72.519999999999996 109.305 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.03 138.92 23.59 Favored 'Trans proline' 0 C--N 1.361 1.205 0 O-C-N 124.488 1.783 . . . . 72.310000000000002 111.037 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.436 ' HA ' HD22 ' A' ' 180' ' ' LEU . 0.4 OUTLIER -141.18 96.76 7.08 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.465 1.103 . . . . 73.430000000000007 109.314 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.95 166.31 29.51 Favored 'Trans proline' 0 C--N 1.361 1.22 0 O-C-N 124.51 1.795 . . . . 42.409999999999997 111.039 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 26.2 mtm105 -60.38 -26.72 66.86 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.467 1.104 . . . . 70.519999999999996 110.283 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -61.49 -18.74 60.42 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.514 1.134 . . . . 72.409999999999997 110.367 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -113.09 -0.59 14.66 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.508 1.13 . . . . 63.130000000000003 110.265 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 185' ' ' THR . . . . . 0.853 HG23 HD21 ' A' ' 139' ' ' LEU . 20.6 m -108.53 143.66 27.94 Favored Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.493 1.12 . . . . 53.149999999999999 110.368 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 186' ' ' PRO . . . . . 0.819 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.5 Cg_endo -74.95 155.78 43.18 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.428 1.751 . . . . 75.310000000000002 111.027 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 187' ' ' PHE . . . . . 0.502 ' O ' ' CG2' ' A' ' 191' ' ' THR . 49.3 p90 -69.45 -7.27 36.43 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.541 1.151 . . . . 73.120000000000005 111.024 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.81 -52.91 4.23 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.551 1.157 . . . . 45.43 109.305 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.819 HD12 ' CG ' ' A' ' 186' ' ' PRO . 44.6 mt -68.57 -42.3 78.49 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.515 1.134 . . . . 71.340000000000003 109.285 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 190' ' ' GLN . . . . . 0.426 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 6.9 pt20 -63.73 -11.09 23.26 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.551 1.157 . . . . 75.439999999999998 110.334 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 191' ' ' THR . . . . . 0.502 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 35.5 p -113.35 6.91 17.49 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.451 1.095 . . . . 61.329999999999998 110.383 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.476 ' CG2' ' N ' ' A' ' 193' ' ' ASN . 7.5 mt -103.79 162.2 4.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.465 1.103 . . . . 74.310000000000002 109.315 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 193' ' ' ASN . . . . . 0.476 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 30.8 p-10 -66.57 74.44 0.1 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.553 1.158 . . . . 75.109999999999999 109.251 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 194' ' ' ALA . . . . . 0.719 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -79.3 128.58 33.5 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.617 1.198 . . . . 61.030000000000001 109.298 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 195' ' ' LEU . . . . . 0.647 HD12 ' CE ' ' A' ' 173' ' ' MET . 0.3 OUTLIER -68.47 124.8 24.56 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.45 1.094 . . . . 51.340000000000003 109.241 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -109.18 111.18 22.65 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.468 1.105 . . . . 72.319999999999993 110.379 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.921 ' HG3' HD21 ' A' ' 176' ' ' LEU . 35.6 tp10 -87.7 -22.45 24.63 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.547 1.154 . . . . 75.310000000000002 110.278 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 198' ' ' GLU . . . . . 0.482 ' HB3' HD12 ' A' ' 176' ' ' LEU . 7.3 pt-20 -95.08 22.86 6.16 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.451 1.095 . . . . 74.439999999999998 110.275 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 4.0 t -127.58 143.91 51.12 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.548 1.155 . . . . 74.129999999999995 109.936 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 55.1 mtt180 -58.79 -20.93 54.38 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.537 1.148 . . . . 71.230000000000004 110.29 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -88.77 11.53 68.46 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.517 1.136 . . . . 54.329999999999998 110.97 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 202' ' ' PHE . . . . . 0.848 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.1 OUTLIER -53.45 -45.19 98.64 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.531 0.783 . . . . 71.420000000000002 110.976 179.967 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 203' ' ' PRO . . . . . 0.594 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.07 -37.89 1.8 Allowed 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.518 1.799 . . . . 70.400000000000006 110.944 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.49 -49.54 72.28 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.506 1.129 . . . . 44.130000000000003 110.367 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -68.86 -41.35 78.53 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.51 1.131 . . . . 74.219999999999999 110.314 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 206' ' ' VAL . . . . . 0.848 HG23 ' O ' ' A' ' 202' ' ' PHE . 69.3 t -64.64 -27.37 42.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.476 1.11 . . . . 75.030000000000001 109.283 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -80.64 -51.1 9.1 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.45 1.094 . . . . 72.439999999999998 110.349 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 87.6 mtt-85 -64.43 -62.31 1.68 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.461 1.101 . . . . 73.430000000000007 110.278 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 209' ' ' ILE . . . . . 0.815 HG22 ' CE1' ' A' ' 210' ' ' PHE . 90.9 mt -46.87 -44.75 7.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.454 1.096 . . . . 75.109999999999999 109.286 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 210' ' ' PHE . . . . . 0.815 ' CE1' HG22 ' A' ' 209' ' ' ILE . 1.3 m-85 -111.92 67.82 0.66 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.521 1.138 . . . . 74.420000000000002 111.066 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 211' ' ' GLN . . . . . 0.528 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.1 OUTLIER -110.7 143.61 40.92 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.508 1.13 . . . . 62.049999999999997 110.267 -179.937 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 212' ' ' GLU . . . . . 0.456 ' O ' ' N ' ' A' ' 215' ' ' TYR . 23.8 tt0 -49.58 -54.66 16.95 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.403 1.064 . . . . 70.120000000000005 110.273 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.89 -24.29 0.98 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.571 1.169 . . . . 72.120000000000005 110.005 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.528 HG23 ' HG2' ' A' ' 211' ' ' GLN . 40.0 t -96.15 -29.71 3.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.489 1.118 . . . . 71.310000000000002 109.294 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 215' ' ' TYR . . . . . 0.456 ' N ' ' O ' ' A' ' 212' ' ' GLU . 6.3 t80 -64.5 -34.08 77.38 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.477 1.111 . . . . 72.519999999999996 111.006 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp -55.59 -59.88 4.21 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 71.010000000000005 109.326 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 217' ' ' THR . . . . . 1.058 HG22 HD11 ' A' ' 221' ' ' ILE . 99.2 m -58.43 -66.45 0.49 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.523 1.139 . . . . 70.420000000000002 110.386 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 218' ' ' GLN . . . . . 0.821 ' HA ' HD12 ' A' ' 221' ' ' ILE . 13.9 mm100 -39.44 -40.48 0.83 Allowed 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.527 1.142 . . . . 71.420000000000002 110.313 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 219' ' ' GLN . . . . . 0.449 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 16.9 tp60 -65.96 -46.66 77.32 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.441 1.088 . . . . 70.430000000000007 110.254 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 220' ' ' THR . . . . . 0.456 ' N ' ' O ' ' A' ' 217' ' ' THR . 1.3 m -68.04 -23.1 64.94 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.506 1.129 . . . . 63.299999999999997 110.435 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 221' ' ' ILE . . . . . 1.058 HD11 HG22 ' A' ' 217' ' ' THR . 17.1 mt -78.6 -32.5 16.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 O-C-N 124.508 1.13 . . . . 75.510000000000005 109.33 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 222' ' ' TRP . . . . . 0.426 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 26.5 t90 -71.13 -50.59 31.94 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.539 1.15 . . . . 63.219999999999999 108.038 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.95 -18.04 63.85 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.425 1.078 . . . . 62.149999999999999 109.285 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 . . . . . 0 C--N 1.325 -0.495 0 O-C-N 124.47 1.106 . . . . 75.340000000000003 110.28 179.966 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.41 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 5.8 p . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 109.329 -0.619 . . . . 61.310000000000002 109.329 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.404 ' O ' ' C ' ' A' ' 79' ' ' LEU . 55.1 p90 -88.56 24.37 1.99 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.436 1.085 . . . . 74.230000000000004 110.966 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.404 ' C ' ' O ' ' A' ' 78' ' ' PHE . 6.6 tp -40.14 152.77 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.463 1.102 . . . . 74.340000000000003 109.27 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.54 ' HD3' HG23 ' A' ' 106' ' ' ILE . 6.4 ttmt -92.43 -60.29 1.87 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.522 1.139 . . . . 71.219999999999999 109.281 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.557 ' CE1' HD11 ' A' ' 83' ' ' ILE . 0.4 OUTLIER -162.14 138.69 7.95 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.532 1.145 . . . . 72.540000000000006 110.969 179.996 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.628 HG11 ' O ' ' A' ' 128' ' ' ALA . 2.8 p -89.63 160.23 2.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 O-C-N 124.567 1.167 . . . . 73.319999999999993 109.347 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.557 HD11 ' CE1' ' A' ' 81' ' ' PHE . 4.3 mp -118.13 92.46 2.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.499 1.124 . . . . 73.239999999999995 109.33 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.611 HD13 HD12 ' A' ' 125' ' ' LEU . 6.1 mt -70.18 118.73 13.38 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.54 1.15 . . . . 73.25 109.291 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.64 ' HE1' HD12 ' A' ' 111' ' ' ILE . 0.8 OUTLIER -143.89 174.53 10.75 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.463 1.102 . . . . 73.219999999999999 109.574 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -110.85 152.1 27.07 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.463 1.102 . . . . 73.219999999999999 109.273 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.09 -18.34 5.33 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.439 1.087 . . . . 70.409999999999997 110.277 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -69.97 -46.35 65.42 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.586 1.179 . . . . 65.239999999999995 109.225 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.435 ' CG ' ' ND2' ' A' ' 178' ' ' ASN . 2.5 m-20 -130.16 43.76 3.07 Favored 'General case' 0 C--N 1.323 -0.557 0 O-C-N 124.497 1.123 . . . . 73.030000000000001 109.319 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.635 HG23 ' CE1' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -73.91 -20.85 60.27 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.54 1.15 . . . . 72.310000000000002 110.412 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -81.44 -39.13 25.34 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.568 1.167 . . . . 71.409999999999997 109.301 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -59.86 -50.46 73.7 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 124.535 1.147 . . . . 71.109999999999999 110.261 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 1.053 ' HB2' ' CD2' ' A' ' 138' ' ' LEU . . . -59.93 -35.09 74.17 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.446 1.091 . . . . 61.420000000000002 109.286 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.997 ' HB2' HD13 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -68.66 -44.62 73.72 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.518 1.136 . . . . 64.25 109.306 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.705 ' N ' HD13 ' A' ' 94' ' ' LEU . 8.8 tpt180 -48.94 -31.57 7.56 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.58 1.175 . . . . 62.310000000000002 110.261 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.823 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.1 t -78.64 -65.26 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.557 1.16 . . . . 61.310000000000002 109.288 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.761 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -40.3 -27.35 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.486 1.117 . . . . 75.129999999999995 110.315 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.455 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.1 OUTLIER -71.75 -60.48 2.21 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.475 1.11 . . . . 73.040000000000006 109.288 179.979 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.852 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -61.6 -22.55 65.32 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.542 1.151 . . . . 74.219999999999999 109.339 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.852 ' N ' HD23 ' A' ' 99' ' ' LEU . 26.7 mt -65.59 -50.81 63.73 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.492 1.12 . . . . 74.230000000000004 109.277 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -76.97 55.69 1.14 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.469 1.105 . . . . 71.510000000000005 110.311 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.0 t70 179.71 -63.29 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.489 1.118 . . . . 73.140000000000001 109.299 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.559 ' HB3' ' CD1' ' A' ' 104' ' ' PHE . 64.0 t0 -43.99 -53.71 6.03 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.488 1.117 . . . . 75.319999999999993 109.292 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.683 ' CE1' HG11 ' A' ' 206' ' ' VAL . 0.3 OUTLIER -113.43 -23.87 9.61 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.496 1.123 . . . . 64.120000000000005 111.014 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.98 37.68 4.33 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.509 1.131 . . . . 50.25 111.036 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.54 HG23 ' HD3' ' A' ' 80' ' ' LYS . 8.1 mm -81.97 81.14 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.436 0.727 . . . . 75.129999999999995 109.362 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.516 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -128.21 156.76 76.06 Favored Pre-proline 0 C--N 1.325 -0.459 0 O-C-N 124.537 1.148 . . . . 65.239999999999995 109.276 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.516 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.93 152.89 98.8 Favored 'Cis proline' 0 C--N 1.36 1.141 0 C-N-CA 121.052 -2.479 . . . . 74.140000000000001 111.015 -0.062 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' GLY . . . . . 0.436 ' O ' ' NE2' ' A' ' 97' ' ' GLN . . . -119.28 110.86 1.95 Allowed Glycine 0 CA--C 1.531 1.043 0 O-C-N 124.513 1.133 . . . . 62.329999999999998 111.018 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.445 ' CD1' ' HA ' ' A' ' 115' ' ' MET . 0.3 OUTLIER -129.02 144.68 37.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.54 0.788 . . . . 72.239999999999995 109.32 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ILE . . . . . 0.997 HD13 ' HB2' ' A' ' 94' ' ' LEU . 20.7 pt -97.16 -177.3 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.499 1.124 . . . . 71.329999999999998 109.275 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.509 ' CD1' ' SD ' ' A' ' 115' ' ' MET . 2.2 t80 -81.77 -18.85 42.73 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.464 1.103 . . . . 62.119999999999997 110.964 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -96.44 -2.55 45.2 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.479 1.112 . . . . 73.129999999999995 109.312 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.595 ' HG2' HD11 ' A' ' 111' ' ' ILE . 67.1 mm-40 -110.44 -26.69 9.39 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.465 1.103 . . . . 73.530000000000001 110.328 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.509 ' SD ' ' CD1' ' A' ' 112' ' ' PHE . 1.2 ptp -70.02 135.03 87.4 Favored Pre-proline 0 C--N 1.325 -0.462 0 O-C-N 124.534 1.146 . . . . 50.450000000000003 111.016 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo . . . . . 0 C--N 1.36 1.163 0 O-C-N 124.51 1.795 . . . . 53.450000000000003 111.004 179.991 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.643 HD22 ' CG ' ' A' ' 150' ' ' ASN . 1.0 OUTLIER . . . . . 0 N--CA 1.454 -0.271 0 N-CA-C 109.296 -0.631 . . . . 65.030000000000001 109.296 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.407 ' O ' ' N ' ' A' ' 129' ' ' VAL . 10.9 t70 -49.69 -37.49 29.05 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.47 1.106 . . . . 74.209999999999994 109.26 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -50.88 -41.31 58.14 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.551 1.157 . . . . 74.099999999999994 109.335 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.628 ' O ' HG11 ' A' ' 82' ' ' VAL . . . -69.99 -26.44 64.08 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.493 1.12 . . . . 74.420000000000002 109.246 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.662 ' O ' HG12 ' A' ' 129' ' ' VAL . 63.1 t -89.11 14.38 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.509 1.131 . . . . 64.239999999999995 109.281 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -111.55 140.06 46.47 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.464 1.102 . . . . 75.219999999999999 109.272 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' GLY . . . . . 0.484 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 39.29 77.78 0.06 OUTLIER Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.485 1.116 . . . . 23.550000000000001 110.98 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -163.48 167.02 22.04 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.475 0.75 . . . . 75.219999999999999 110.017 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.76 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -95.67 -36.0 11.38 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.549 1.156 . . . . 71.430000000000007 109.285 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.76 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.1 m-90 -161.57 170.13 20.42 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.505 1.128 . . . . 74.319999999999993 108.039 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 56.2 p -138.78 138.19 37.37 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.573 1.171 . . . . 63.030000000000001 110.41 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.744 ' O ' HD22 ' A' ' 137' ' ' LEU . 39.2 mm -84.35 140.97 15.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.491 1.119 . . . . 63.549999999999997 109.28 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.744 HD22 ' O ' ' A' ' 136' ' ' ILE . 3.3 mm? -128.61 86.97 2.51 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.509 1.131 . . . . 53.530000000000001 109.323 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 1.053 ' CD2' ' HB2' ' A' ' 93' ' ' ALA . 0.3 OUTLIER -62.74 88.06 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.48 1.112 . . . . 74.530000000000001 109.306 -179.99 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.709 HD22 ' O ' ' A' ' 137' ' ' LEU . 0.6 OUTLIER -61.81 116.64 4.99 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.503 1.127 . . . . 64.019999999999996 109.246 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 140' ' ' THR . . . . . 0.628 HG23 ' OD1' ' A' ' 178' ' ' ASN . 7.4 m -136.41 169.69 17.26 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.491 1.12 . . . . 71.530000000000001 110.381 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -64.25 -39.74 94.58 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.559 1.162 . . . . 75.519999999999996 110.275 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' ASN . . . . . 0.441 ' CG ' ' N ' ' A' ' 143' ' ' PHE . 7.9 p30 -89.54 -46.74 8.46 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.45 1.094 . . . . 73.329999999999998 109.279 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.783 ' CE1' HG21 ' A' ' 147' ' ' THR . 7.1 t80 -53.07 -25.94 14.47 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.481 1.113 . . . . 64.129999999999995 110.951 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.705 HD13 ' C ' ' A' ' 144' ' ' LEU . 1.8 tm? -54.46 -68.11 0.21 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.54 1.15 . . . . 75.349999999999994 109.319 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.459 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 28.5 mmm180 -65.94 -14.33 61.38 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.415 1.072 . . . . 61.409999999999997 110.313 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -70.69 -51.87 24.82 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.511 1.132 . . . . 74.230000000000004 109.349 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.783 HG21 ' CE1' ' A' ' 143' ' ' PHE . 4.3 p -92.75 -52.99 4.35 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.513 1.133 . . . . 74.310000000000002 110.422 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.568 ' CH2' ' HB2' ' A' ' 186' ' ' PRO . 20.5 t-105 -41.87 -47.4 4.22 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.565 1.165 . . . . 71.25 107.977 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 149' ' ' CYS . . . . . 0.459 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 7.4 t -69.85 -44.54 69.66 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.436 1.085 . . . . 52.240000000000002 108.322 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 150' ' ' ASN . . . . . 0.643 ' CG ' HD22 ' A' ' 125' ' ' LEU . 34.2 t-20 -51.7 -29.52 18.63 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.465 1.103 . . . . 73.349999999999994 109.302 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.564 ' CD1' ' HG ' ' A' ' 157' ' ' LEU . 8.2 m-30 -77.6 -44.94 26.73 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.472 1.108 . . . . 75.319999999999993 111.005 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 42.2 tp60 -41.46 -39.73 1.59 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.437 1.086 . . . . 74.150000000000006 110.256 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -80.78 -34.3 34.27 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.453 1.096 . . . . 74.420000000000002 110.959 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.441 ' N ' ' O ' ' A' ' 151' ' ' PHE . 3.3 m-85 -117.05 87.52 2.72 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.558 1.161 . . . . 75.230000000000004 111.015 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 2.3 t -60.14 -25.17 65.3 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.451 1.095 . . . . 63.100000000000001 110.368 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 54.7 p -58.57 -16.88 17.62 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 124.527 1.142 . . . . 63.32 109.998 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.564 ' HG ' ' CD1' ' A' ' 151' ' ' PHE . 0.2 OUTLIER -75.85 -51.73 11.91 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.451 1.094 . . . . 73.519999999999996 109.316 -179.97 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 158' ' ' MET . . . . . 0.487 ' CE ' HG21 ' A' ' 161' ' ' VAL . 5.6 mmt -50.04 -32.99 16.79 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.436 1.085 . . . . 63.420000000000002 110.962 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -64.16 -38.6 91.63 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.524 1.14 . . . . 74.450000000000003 109.312 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 160' ' ' SER . . . . . 0.663 ' HB2' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -66.19 -33.1 75.0 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.555 1.159 . . . . 73.430000000000007 109.948 -179.962 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 161' ' ' VAL . . . . . 0.859 ' O ' HD13 ' A' ' 192' ' ' ILE . 48.3 t -59.09 -18.16 13.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.425 1.078 . . . . 61.409999999999997 109.358 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 30.8 m-20 -77.95 -27.71 49.35 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.46 1.1 . . . . 64.109999999999999 109.308 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.559 ' HE ' HD11 ' A' ' 171' ' ' ILE . 21.3 mtp180 68.78 29.06 5.3 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.464 1.102 . . . . 71.140000000000001 110.253 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 164' ' ' GLN . . . . . 0.404 ' O ' ' O ' ' A' ' 163' ' ' ARG . 21.3 mt-30 -50.75 -177.84 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.527 1.142 . . . . 72.230000000000004 110.315 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -78.93 70.64 5.3 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.577 1.173 . . . . 75.310000000000002 109.567 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.681 ' HA ' HG21 ' A' ' 221' ' ' ILE . 0.1 OUTLIER -123.92 177.47 5.75 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.496 1.122 . . . . 74.219999999999999 109.353 179.974 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 167' ' ' TYR . . . . . . . . . . . . . 49.9 p90 -90.02 29.85 1.16 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.489 1.118 . . . . 75.219999999999999 110.957 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 168' ' ' ASN . . . . . 0.467 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 3.5 p30 -169.56 108.8 0.42 Allowed 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.435 1.085 . . . . 70.239999999999995 109.29 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.474 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 6.3 m -102.04 164.04 11.92 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.436 1.085 . . . . 73.420000000000002 110.003 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.838 ' O ' HD12 ' A' ' 171' ' ' ILE . 76.0 t -130.5 125.03 58.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 124.459 1.099 . . . . 53.32 109.273 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.838 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.5 mp -131.48 113.75 15.61 Favored Pre-proline 0 C--N 1.326 -0.445 0 O-C-N 124.475 1.109 . . . . 61.039999999999999 109.237 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 172' ' ' PRO . . . . . 0.664 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.04 111.72 3.39 Favored 'Trans proline' 0 C--N 1.36 1.139 0 O-C-N 124.539 1.81 . . . . 64.430000000000007 110.975 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 173' ' ' MET . . . . . 0.823 ' HE1' HG21 ' A' ' 96' ' ' VAL . 4.5 ttt -92.74 152.08 19.69 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.531 1.144 . . . . 72.019999999999996 111.004 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 174' ' ' ARG . . . . . 0.421 ' N ' ' HG2' ' A' ' 173' ' ' MET . 21.2 mtp180 -110.85 116.66 51.7 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.546 1.154 . . . . 74.510000000000005 110.239 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 175' ' ' PRO . . . . . 0.419 ' C ' HD23 ' A' ' 176' ' ' LEU . 18.3 Cg_endo -75.01 164.61 33.01 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.474 1.776 . . . . 74.439999999999998 111.006 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 176' ' ' LEU . . . . . 0.879 HD22 ' HB3' ' A' ' 198' ' ' GLU . 0.1 OUTLIER -104.02 -44.4 5.02 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.597 1.186 . . . . 72.200000000000003 109.264 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -72.13 -20.81 61.56 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.409 1.068 . . . . 73.25 109.266 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 178' ' ' ASN . . . . . 0.628 ' OD1' HG23 ' A' ' 140' ' ' THR . 0.6 OUTLIER -110.2 107.49 58.64 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.539 1.149 . . . . 71.409999999999997 109.293 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 118.12 5.15 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.549 1.815 . . . . 72.439999999999998 111.041 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.576 HD13 ' HB2' ' A' ' 184' ' ' ARG . 1.1 tm? -140.42 96.56 7.78 Favored Pre-proline 0 C--N 1.325 -0.475 0 O-C-N 124.505 1.128 . . . . 73.430000000000007 109.28 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.95 168.23 25.3 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.47 1.774 . . . . 72.219999999999999 111.025 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -56.48 -27.69 57.7 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.435 1.084 . . . . 72.129999999999995 110.302 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -61.35 -26.56 67.9 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 124.474 1.109 . . . . 64.400000000000006 110.262 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 184' ' ' ARG . . . . . 0.576 ' HB2' HD13 ' A' ' 180' ' ' LEU . 69.0 mmt-85 -96.4 -24.51 16.1 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.455 1.097 . . . . 60.140000000000001 110.288 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 185' ' ' THR . . . . . 0.507 HG22 ' HD2' ' A' ' 186' ' ' PRO . 18.9 m -74.77 143.94 79.25 Favored Pre-proline 0 C--N 1.325 -0.468 0 O-C-N 124.436 1.085 . . . . 72.129999999999995 110.396 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 186' ' ' PRO . . . . . 0.743 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -74.94 155.41 43.21 Favored 'Trans proline' 0 C--N 1.36 1.142 0 O-C-N 124.476 1.777 . . . . 75.129999999999995 110.983 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 187' ' ' PHE . . . . . 0.498 ' O ' ' CG2' ' A' ' 191' ' ' THR . 17.1 p90 -69.76 -6.89 35.15 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.461 1.101 . . . . 75.310000000000002 111.035 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 188' ' ' ALA . . . . . 0.544 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -94.37 -52.96 4.11 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.491 1.12 . . . . 75.430000000000007 109.289 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.743 HD12 ' CG ' ' A' ' 186' ' ' PRO . 51.5 mt -68.45 -42.08 79.31 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.378 1.049 . . . . 74.120000000000005 109.268 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 190' ' ' GLN . . . . . 0.416 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 7.1 pt20 -64.48 -10.09 23.03 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.485 1.116 . . . . 73.230000000000004 110.327 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 191' ' ' THR . . . . . 0.498 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 39.9 p -115.08 11.12 16.32 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.545 1.153 . . . . 64.150000000000006 110.343 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.859 HD13 ' O ' ' A' ' 161' ' ' VAL . 4.0 mt -125.46 148.82 29.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.457 1.098 . . . . 74.209999999999994 109.255 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 193' ' ' ASN . . . . . 0.663 ' OD1' HD11 ' A' ' 209' ' ' ILE . 54.5 t-20 -47.55 102.64 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.392 1.058 . . . . 60.439999999999998 109.254 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 194' ' ' ALA . . . . . 0.664 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -99.54 129.84 45.74 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.499 1.124 . . . . 65.409999999999997 109.327 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 195' ' ' LEU . . . . . 0.83 HD23 HD12 ' A' ' 209' ' ' ILE . 0.6 OUTLIER -66.58 136.9 56.3 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.49 1.119 . . . . 73.450000000000003 109.316 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 196' ' ' GLU . . . . . 0.448 ' CB ' ' HB3' ' A' ' 199' ' ' SER . 31.3 mt-10 -114.93 131.48 56.87 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.463 1.102 . . . . 73.109999999999999 110.325 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.751 ' HG2' HD11 ' A' ' 176' ' ' LEU . 3.4 tt0 -109.47 -23.19 11.64 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.492 1.12 . . . . 61.409999999999997 110.321 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 198' ' ' GLU . . . . . 0.879 ' HB3' HD22 ' A' ' 176' ' ' LEU . 0.0 OUTLIER -107.09 8.44 30.22 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.483 1.115 . . . . 72.150000000000006 110.269 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 199' ' ' SER . . . . . 0.448 ' HB3' ' CB ' ' A' ' 196' ' ' GLU . 28.6 t -99.91 163.49 12.43 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.545 1.153 . . . . 75.040000000000006 109.982 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 200' ' ' ARG . . . . . 0.431 ' HA ' ' NE ' ' A' ' 200' ' ' ARG . 5.8 tpm_? -75.81 -20.83 57.88 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.477 1.111 . . . . 74.019999999999996 110.301 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -99.88 26.26 25.12 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.53 1.143 . . . . 70.409999999999997 111.045 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 202' ' ' PHE . . . . . 0.81 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.2 OUTLIER -60.87 -43.9 93.08 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.483 0.755 . . . . 71.010000000000005 110.983 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 203' ' ' PRO . . . . . 0.616 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -74.96 -37.89 1.85 Allowed 'Trans proline' 0 C--N 1.361 1.19 0 O-C-N 124.447 1.761 . . . . 61.509999999999998 110.944 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.04 -57.99 9.47 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.558 1.161 . . . . 65.420000000000002 110.431 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -59.57 -45.64 91.25 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.45 1.094 . . . . 74.310000000000002 110.293 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 206' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 202' ' ' PHE . 55.0 t -56.48 -33.8 39.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 O-C-N 124.477 1.11 . . . . 74.430000000000007 109.269 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -73.57 -60.0 2.45 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.496 1.123 . . . . 64.5 110.241 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 80.5 mtt-85 -56.06 -63.38 1.2 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.538 1.149 . . . . 74.150000000000006 110.332 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 209' ' ' ILE . . . . . 0.83 HD12 HD23 ' A' ' 195' ' ' LEU . 25.7 mt -46.45 -62.46 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.554 1.159 . . . . 72.209999999999994 109.339 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 210' ' ' PHE . . . . . 0.781 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.8 m-85 -97.09 68.8 2.29 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.502 1.126 . . . . 73.239999999999995 111.034 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 211' ' ' GLN . . . . . 0.553 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -110.79 144.52 39.65 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.497 1.123 . . . . 74.109999999999999 110.299 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 212' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 215' ' ' TYR . 39.6 tt0 -49.21 -55.16 13.41 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.479 1.112 . . . . 64.420000000000002 110.355 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.26 -23.96 1.04 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.452 1.095 . . . . 33.310000000000002 110.005 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.553 HG23 ' HG2' ' A' ' 211' ' ' GLN . 40.6 t -96.25 -29.19 3.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.412 1.07 . . . . 63.520000000000003 109.237 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 215' ' ' TYR . . . . . 0.45 ' N ' ' O ' ' A' ' 212' ' ' GLU . 5.8 t80 -62.98 -32.42 73.76 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.469 1.106 . . . . 73.310000000000002 110.966 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 45.6 mmtt -63.33 -46.95 84.24 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.51 1.131 . . . . 74.409999999999997 109.27 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 217' ' ' THR . . . . . 0.902 HG22 HD11 ' A' ' 221' ' ' ILE . 87.9 m -53.49 -66.45 0.39 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.457 1.098 . . . . 63.140000000000001 110.372 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 218' ' ' GLN . . . . . 0.501 ' HA ' HD12 ' A' ' 221' ' ' ILE . 12.5 mp0 -55.5 -18.54 7.43 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.451 1.094 . . . . 74.420000000000002 110.23 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -84.62 -33.31 23.33 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 124.471 1.107 . . . . 75.209999999999994 110.28 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 220' ' ' THR . . . . . 0.461 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 3.0 m -82.42 -28.93 31.06 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.508 1.13 . . . . 43.310000000000002 110.458 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 221' ' ' ILE . . . . . 0.902 HD11 HG22 ' A' ' 217' ' ' THR . 8.9 mt -75.07 -34.67 32.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.462 1.101 . . . . 53.119999999999997 109.323 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 222' ' ' TRP . . . . . 0.484 ' CD1' ' HA2' ' A' ' 131' ' ' GLY . 35.8 t90 -71.51 -57.84 4.05 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.492 1.12 . . . . 72.319999999999993 107.985 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 223' ' ' LYS . . . . . 0.461 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -52.74 -24.09 8.06 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.522 1.139 . . . . 74.209999999999994 109.239 179.989 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 . . . . . 0 C--N 1.325 -0.482 0 O-C-N 124.501 1.126 . . . . 62.119999999999997 110.373 179.977 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.59 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 7.3 p . . . . . 0 N--CA 1.453 -0.296 0 N-CA-C 109.262 -0.644 . . . . 74.239999999999995 109.262 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.436 ' N ' HG22 ' A' ' 77' ' ' VAL . 31.9 t80 -86.83 18.25 3.58 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.473 1.108 . . . . 74.239999999999995 110.969 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.413 ' HB2' HG13 ' A' ' 77' ' ' VAL . 3.9 tp -39.31 157.33 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.498 1.124 . . . . 74.420000000000002 109.318 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.852 ' HD3' HG22 ' A' ' 106' ' ' ILE . 4.9 ptmm? -104.69 -51.59 3.04 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.472 1.108 . . . . 71.420000000000002 109.335 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.603 ' HE2' HD11 ' A' ' 136' ' ' ILE . 0.2 OUTLIER -167.51 142.83 3.94 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.479 1.112 . . . . 73.310000000000002 111.043 179.99 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.57 HG22 ' H ' ' A' ' 83' ' ' ILE . 7.4 p -97.98 172.7 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.51 1.131 . . . . 64.340000000000003 109.272 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.883 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.3 mp -129.55 96.87 3.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.481 1.113 . . . . 71.5 109.288 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.465 ' HG ' ' CB ' ' A' ' 128' ' ' ALA . 5.5 mt -70.41 117.62 12.18 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.537 1.148 . . . . 74.519999999999996 109.317 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.765 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -142.22 174.57 10.49 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.559 1.162 . . . . 73.519999999999996 109.622 179.995 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.565 ' HB2' ' CD1' ' A' ' 143' ' ' PHE . . . -117.0 149.55 40.07 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.492 1.12 . . . . 63.549999999999997 109.282 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.08 -21.34 1.83 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.459 1.099 . . . . 73.420000000000002 110.28 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -66.66 -45.87 77.52 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.543 1.152 . . . . 60.520000000000003 109.304 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.409 ' O ' HD23 ' A' ' 138' ' ' LEU . 5.9 t0 -132.0 44.22 2.93 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.453 1.096 . . . . 74.519999999999996 109.328 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.619 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -74.73 -23.83 58.63 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.466 1.104 . . . . 73.140000000000001 110.44 179.955 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -76.3 -39.04 55.18 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.464 1.103 . . . . 75.099999999999994 109.264 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.409 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 0.1 OUTLIER -61.57 -50.54 72.2 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.482 1.114 . . . . 71.219999999999999 110.285 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 1.047 ' HB2' ' CD2' ' A' ' 138' ' ' LEU . . . -59.71 -27.95 66.9 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.569 1.168 . . . . 63.310000000000002 109.348 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.935 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -82.87 -33.38 27.02 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.524 1.14 . . . . 61.310000000000002 109.323 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.624 ' N ' HD13 ' A' ' 94' ' ' LEU . 9.3 tpp180 -57.16 -28.51 62.82 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.517 1.136 . . . . 72.329999999999998 110.368 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.842 HG21 ' HE1' ' A' ' 173' ' ' MET . 1.7 t -84.48 -65.35 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.435 1.085 . . . . 75.519999999999996 109.324 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.587 ' HA ' HD12 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -39.99 -28.12 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.538 1.149 . . . . 63.119999999999997 110.319 179.993 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.442 ' N ' ' O ' ' A' ' 96' ' ' VAL . 2.1 t-20 -69.85 -52.67 22.91 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.504 1.128 . . . . 74.129999999999995 109.252 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.822 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -71.03 -21.58 62.25 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.549 1.155 . . . . 71.340000000000003 109.355 179.981 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.822 ' N ' HD23 ' A' ' 99' ' ' LEU . 25.4 mt -60.15 -58.23 9.44 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.508 1.13 . . . . 70.099999999999994 109.277 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLN . . . . . 0.477 ' HB2' ' CE ' ' A' ' 107' ' ' LYS . 5.6 pt20 -75.28 59.13 1.0 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.534 1.146 . . . . 64.230000000000004 110.336 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -178.2 -64.06 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.439 1.087 . . . . 53.310000000000002 109.241 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -49.73 -50.68 43.19 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.491 1.119 . . . . 73.420000000000002 109.324 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.565 ' CZ ' HG11 ' A' ' 206' ' ' VAL . 2.6 m-85 -114.42 -22.47 9.84 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.494 1.121 . . . . 64.140000000000001 110.997 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.49 44.7 3.93 Favored Glycine 0 CA--C 1.53 1.021 0 O-C-N 124.524 1.14 . . . . 44.409999999999997 110.987 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.852 HG22 ' HD3' ' A' ' 80' ' ' LYS . 3.6 mm -86.97 87.66 2.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.476 0.75 . . . . 73.209999999999994 109.323 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.51 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -132.36 158.5 75.46 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.555 1.159 . . . . 70.140000000000001 109.28 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.51 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.01 167.06 81.6 Favored 'Cis proline' 0 C--N 1.36 1.175 0 C-N-CA 121.033 -2.486 . . . . 73.420000000000002 110.979 0.049 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.75 129.07 6.06 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.547 1.155 . . . . 74.409999999999997 110.989 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.4 HD11 ' C ' ' A' ' 114' ' ' GLU . 0.0 OUTLIER -148.05 132.4 9.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.502 0.766 . . . . 72.040000000000006 109.318 179.989 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ILE . . . . . 0.78 HD13 ' HB2' ' A' ' 94' ' ' LEU . 44.2 pt -91.83 -178.35 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.457 1.098 . . . . 65.200000000000003 109.318 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -81.53 -19.1 42.84 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.522 1.139 . . . . 70.549999999999997 111.006 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -91.54 -3.05 56.92 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.455 1.097 . . . . 74.129999999999995 109.332 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.4 ' C ' HD11 ' A' ' 110' ' ' ILE . 9.7 mm-40 -109.79 -26.75 9.66 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.465 1.103 . . . . 52.25 110.314 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 23.4 tpp -39.93 111.06 0.69 Allowed Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.571 1.169 . . . . 74.299999999999997 111.017 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 C--N 1.36 1.16 0 O-C-N 124.479 1.779 . . . . 75.129999999999995 111.021 179.98 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.293 0 N-CA-C 109.263 -0.643 . . . . 42.5 109.263 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.438 ' O ' ' N ' ' A' ' 129' ' ' VAL . 2.4 t70 -64.44 -22.24 66.9 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.526 1.141 . . . . 75.230000000000004 109.29 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -49.91 -23.48 1.98 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.501 1.126 . . . . 75.120000000000005 109.363 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.465 ' CB ' ' HG ' ' A' ' 84' ' ' LEU . . . -89.3 -33.16 17.03 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.469 1.105 . . . . 62.130000000000003 109.261 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.739 ' O ' HG12 ' A' ' 129' ' ' VAL . 73.6 t -92.94 30.48 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.499 1.124 . . . . 65.420000000000002 109.299 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -135.29 118.89 16.99 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.544 1.152 . . . . 74.329999999999998 109.234 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' GLY . . . . . 0.561 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 66.59 62.97 4.17 Favored Glycine 0 CA--C 1.531 1.033 0 O-C-N 124.51 1.131 . . . . 73.209999999999994 111.009 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -154.92 -176.87 6.15 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.552 0.796 . . . . 75.540000000000006 110.068 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.746 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -113.23 -32.22 6.36 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.438 1.086 . . . . 73.299999999999997 109.235 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.746 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.4 m-90 -161.48 160.2 28.93 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.489 1.118 . . . . 73.239999999999995 107.997 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.9 p -132.82 131.49 41.1 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.487 1.117 . . . . 63.450000000000003 110.428 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.883 ' HB ' HG23 ' A' ' 83' ' ' ILE . 9.8 mm -84.6 138.64 18.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.524 1.14 . . . . 74.030000000000001 109.334 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.766 HD11 HG13 ' A' ' 170' ' ' VAL . 4.1 mt -130.34 94.5 3.68 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.477 1.111 . . . . 62.229999999999997 109.341 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 1.047 ' CD2' ' HB2' ' A' ' 93' ' ' ALA . 0.5 OUTLIER -62.55 99.63 0.15 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.528 1.142 . . . . 64.230000000000004 109.32 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.583 HD21 ' HB2' ' A' ' 172' ' ' PRO . 0.4 OUTLIER -63.55 116.35 5.54 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.43 1.081 . . . . 64.409999999999997 109.334 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 140' ' ' THR . . . . . 0.588 HG22 ' H ' ' A' ' 141' ' ' GLU . 5.8 m -139.4 179.69 6.4 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.559 1.162 . . . . 72.519999999999996 110.397 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 141' ' ' GLU . . . . . 0.588 ' H ' HG22 ' A' ' 140' ' ' THR . 5.5 mp0 -84.87 -36.67 21.39 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.482 1.114 . . . . 74.150000000000006 110.227 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -88.44 -32.82 18.09 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.494 1.121 . . . . 74.109999999999999 109.308 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.739 ' O ' HG23 ' A' ' 147' ' ' THR . 51.1 t80 -72.44 -36.75 68.63 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.437 1.086 . . . . 72.329999999999998 110.926 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.711 HD13 ' N ' ' A' ' 145' ' ' ARG . 1.5 tm? -54.7 -67.49 0.26 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.533 1.145 . . . . 71.219999999999999 109.32 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.711 ' N ' HD13 ' A' ' 144' ' ' LEU . 0.0 OUTLIER -55.39 -18.4 6.7 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.551 1.157 . . . . 73.420000000000002 110.312 -179.975 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.69 -32.93 25.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.466 1.104 . . . . 64.430000000000007 109.321 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.739 HG23 ' O ' ' A' ' 143' ' ' PHE . 80.8 p -97.39 -7.02 32.76 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.552 1.158 . . . . 44.340000000000003 110.388 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.549 ' CH2' ' HB2' ' A' ' 186' ' ' PRO . 0.1 OUTLIER -94.24 -26.55 16.59 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.951 -1.129 . . . . 74.129999999999995 107.951 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 51.6 t -95.62 -26.39 15.77 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.488 1.117 . . . . 63.439999999999998 108.316 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 9.6 m-20 -77.92 -42.79 31.97 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.506 1.129 . . . . 72.150000000000006 109.347 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.71 ' CE2' HD12 ' A' ' 157' ' ' LEU . 4.0 m-85 -69.39 -51.08 40.11 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 72.450000000000003 110.981 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -46.6 -47.78 19.84 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.518 1.136 . . . . 73.349999999999994 110.266 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -68.83 -22.66 64.22 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.54 1.15 . . . . 72.129999999999995 110.983 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -118.9 91.94 3.68 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.464 1.103 . . . . 73.030000000000001 110.949 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.6 t -60.87 -15.65 32.93 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.537 1.148 . . . . 44.039999999999999 110.372 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 93.0 p -69.86 -20.7 63.4 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.449 1.093 . . . . 70.140000000000001 109.966 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.748 ' O ' HG23 ' A' ' 161' ' ' VAL . 0.0 OUTLIER -86.27 -37.17 18.84 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.563 1.164 . . . . 73.010000000000005 109.279 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 158' ' ' MET . . . . . 0.535 ' CE ' HG11 ' A' ' 161' ' ' VAL . 18.4 mmt -62.95 -11.58 19.67 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.517 1.136 . . . . 71.510000000000005 111.001 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -62.47 -68.48 0.33 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.513 1.133 . . . . 71.200000000000003 109.29 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 160' ' ' SER . . . . . 0.467 ' HB2' ' CG2' ' A' ' 170' ' ' VAL . 0.0 OUTLIER -59.19 -34.21 71.86 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.506 1.129 . . . . 74.510000000000005 110.042 179.997 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 161' ' ' VAL . . . . . 0.813 ' CG1' ' HB1' ' A' ' 188' ' ' ALA . 87.5 t -55.68 -18.99 5.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.516 1.135 . . . . 71.340000000000003 109.357 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -92.03 35.7 0.98 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.555 1.16 . . . . 74.219999999999999 109.278 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.466 ' CD ' ' CG1' ' A' ' 192' ' ' ILE . 0.1 OUTLIER 40.18 64.31 0.93 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.494 1.121 . . . . 72.299999999999997 110.294 -179.998 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -96.28 -174.78 3.16 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.479 1.112 . . . . 73.329999999999998 110.293 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 31.9 p80 -141.72 55.75 1.5 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.479 1.112 . . . . 73.299999999999997 109.598 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.2 tptm -90.89 -175.46 4.36 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.497 1.123 . . . . 74.129999999999995 109.272 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 167' ' ' TYR . . . . . 1.164 ' CD1' HG22 ' A' ' 221' ' ' ILE . 10.8 m-85 -37.65 -46.86 0.91 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.435 1.084 . . . . 74.349999999999994 110.893 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 168' ' ' ASN . . . . . 0.435 ' ND2' ' O ' ' A' ' 129' ' ' VAL . 0.6 OUTLIER -112.58 164.11 13.71 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.467 1.104 . . . . 74.439999999999998 109.305 -179.99 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.467 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 5.9 m -124.66 175.11 7.42 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.515 1.135 . . . . 72.409999999999997 110.057 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.803 ' O ' HD12 ' A' ' 171' ' ' ILE . 2.1 t -133.88 122.44 42.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 O-C-N 124.491 1.119 . . . . 75.430000000000007 109.319 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.907 HG12 HG21 ' A' ' 209' ' ' ILE . 1.4 mp -132.72 103.24 13.36 Favored Pre-proline 0 C--N 1.324 -0.506 0 O-C-N 124.583 1.177 . . . . 72.439999999999998 109.254 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 172' ' ' PRO . . . . . 0.583 ' HB2' HD21 ' A' ' 139' ' ' LEU . 18.3 Cg_endo -74.99 112.65 3.61 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.51 1.795 . . . . 72.109999999999999 111.025 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 173' ' ' MET . . . . . 0.842 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.5 ttt -92.92 157.55 16.29 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.443 1.089 . . . . 73.150000000000006 110.961 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 174' ' ' ARG . . . . . 0.439 ' N ' ' HG2' ' A' ' 173' ' ' MET . 1.4 mpt_? -113.54 120.26 39.96 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.511 1.132 . . . . 75.340000000000003 110.288 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 175' ' ' PRO . . . . . 0.474 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.3 Cg_endo -75.01 154.47 42.46 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.455 1.766 . . . . 70.5 110.963 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 176' ' ' LEU . . . . . 0.907 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -88.22 -43.21 11.77 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.528 1.143 . . . . 74.219999999999999 109.249 -179.996 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -72.23 -27.15 62.34 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.461 1.101 . . . . 72.310000000000002 109.296 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 178' ' ' ASN . . . . . 0.474 ' CB ' ' HG2' ' A' ' 175' ' ' PRO . 9.8 m-20 -110.33 99.39 40.15 Favored Pre-proline 0 C--N 1.325 -0.483 0 O-C-N 124.484 1.115 . . . . 74.319999999999993 109.279 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -74.97 124.61 8.77 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.493 1.786 . . . . 74.129999999999995 111.058 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.487 ' HA ' HD22 ' A' ' 180' ' ' LEU . 0.4 OUTLIER -136.0 96.34 13.02 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.531 1.145 . . . . 71.010000000000005 109.304 -179.983 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -75.07 171.7 17.79 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.481 1.78 . . . . 73.040000000000006 110.998 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 17.2 ptt180 -59.37 -32.27 69.97 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 65.519999999999996 110.255 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -60.74 -14.82 23.58 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.487 1.117 . . . . 75.299999999999997 110.328 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 184' ' ' ARG . . . . . 0.422 ' HB2' HD13 ' A' ' 180' ' ' LEU . 30.8 mmt180 -113.79 -28.61 7.37 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.48 1.113 . . . . 72.109999999999999 110.232 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 185' ' ' THR . . . . . . . . . . . . . 61.0 m -66.51 139.47 96.1 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.49 1.119 . . . . 71.239999999999995 110.422 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 186' ' ' PRO . . . . . 0.581 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -74.96 145.4 31.53 Favored 'Trans proline' 0 C--N 1.36 1.132 0 O-C-N 124.488 1.783 . . . . 52.420000000000002 110.997 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 187' ' ' PHE . . . . . 0.479 ' O ' ' CD1' ' A' ' 187' ' ' PHE . 5.2 t80 -59.73 -13.67 11.05 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.512 1.133 . . . . 72.230000000000004 110.985 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 188' ' ' ALA . . . . . 0.813 ' HB1' ' CG1' ' A' ' 161' ' ' VAL . . . -86.92 -53.77 4.71 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.509 1.131 . . . . 74.430000000000007 109.301 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.928 ' HA ' HD12 ' A' ' 192' ' ' ILE . 23.9 mt -76.57 -11.8 59.92 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.41 1.068 . . . . 74.5 109.261 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 190' ' ' GLN . . . . . 0.499 ' O ' ' CG ' ' A' ' 190' ' ' GLN . 4.7 tt0 -86.81 -0.78 57.03 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.494 1.121 . . . . 53.140000000000001 110.283 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 191' ' ' THR . . . . . 0.401 ' OG1' ' O ' ' A' ' 188' ' ' ALA . 3.4 p -115.72 -30.7 6.05 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.517 1.135 . . . . 74.540000000000006 110.426 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.928 HD12 ' HA ' ' A' ' 189' ' ' LEU . 7.2 mt -65.1 169.36 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.507 1.129 . . . . 74.230000000000004 109.3 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 193' ' ' ASN . . . . . 0.535 ' N ' HG22 ' A' ' 192' ' ' ILE . 5.7 m-20 -76.17 57.32 1.11 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.497 1.123 . . . . 54.439999999999998 109.32 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 194' ' ' ALA . . . . . 0.477 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -43.07 142.08 1.03 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.451 1.094 . . . . 72.299999999999997 109.307 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 195' ' ' LEU . . . . . 0.594 HD12 ' CE ' ' A' ' 173' ' ' MET . 0.4 OUTLIER -88.9 126.1 35.24 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.499 1.125 . . . . 63.420000000000002 109.297 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 196' ' ' GLU . . . . . 0.404 ' HB3' ' CB ' ' A' ' 199' ' ' SER . 38.7 mt-10 -101.44 130.57 47.7 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.549 1.156 . . . . 72.420000000000002 110.326 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.907 ' HG3' HD21 ' A' ' 176' ' ' LEU . 8.8 tp10 -113.61 -23.94 9.49 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.517 1.135 . . . . 75.129999999999995 110.311 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -103.06 4.03 36.72 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.498 1.124 . . . . 72.010000000000005 110.296 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 199' ' ' SER . . . . . 0.404 ' CB ' ' HB3' ' A' ' 196' ' ' GLU . 14.7 t -97.59 174.9 6.42 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.489 1.118 . . . . 70.349999999999994 109.98 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -70.64 -60.36 2.3 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.515 1.134 . . . . 73.200000000000003 110.244 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -78.82 51.34 3.76 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.459 1.099 . . . . 71.409999999999997 110.976 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 202' ' ' PHE . . . . . 0.614 ' C ' ' CD1' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -78.39 -47.27 2.0 Allowed Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.526 0.78 . . . . 74.150000000000006 110.972 -179.993 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 203' ' ' PRO . . . . . 0.654 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.3 Cg_endo -75.02 -27.44 9.97 Favored 'Trans proline' 0 C--N 1.36 1.145 0 O-C-N 124.444 1.76 . . . . 71.230000000000004 110.99 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.51 -50.77 71.38 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.615 1.197 . . . . 72.540000000000006 110.438 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 205' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 0.2 OUTLIER -58.75 -63.18 1.38 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.518 1.136 . . . . 75.120000000000005 110.31 -179.989 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 206' ' ' VAL . . . . . 0.776 HG21 HD22 ' A' ' 100' ' ' LEU . 2.7 p -38.82 -33.86 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.495 1.122 . . . . 71.200000000000003 109.304 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 207' ' ' GLU . . . . . 0.414 ' N ' ' C ' ' A' ' 205' ' ' GLN . 1.0 OUTLIER -76.39 -65.68 0.9 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.541 1.151 . . . . 71.510000000000005 110.283 -179.961 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 82.9 mtt-85 -47.82 -58.07 4.82 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.53 1.144 . . . . 71.540000000000006 110.276 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 209' ' ' ILE . . . . . 0.907 HG21 HG12 ' A' ' 171' ' ' ILE . 3.3 mt -52.56 -70.75 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.481 1.113 . . . . 73.109999999999999 109.341 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 210' ' ' PHE . . . . . 0.607 ' CD2' HG23 ' A' ' 206' ' ' VAL . 0.7 OUTLIER -84.9 65.28 9.11 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.534 1.146 . . . . 72.319999999999993 111.045 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 211' ' ' GLN . . . . . 0.447 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.2 OUTLIER -110.59 146.65 35.73 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.447 1.092 . . . . 65.109999999999999 110.262 -179.968 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 212' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' A' ' 215' ' ' TYR . 60.7 tt0 -48.33 -55.39 10.8 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 73.430000000000007 110.334 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.3 m -48.6 -25.23 1.64 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.544 1.152 . . . . 54.329999999999998 109.995 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.447 HG23 ' HG2' ' A' ' 211' ' ' GLN . 32.8 t -96.21 -26.35 4.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.485 1.116 . . . . 70.200000000000003 109.304 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 215' ' ' TYR . . . . . 0.455 ' N ' ' O ' ' A' ' 212' ' ' GLU . 8.5 t80 -69.27 -33.83 73.82 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.519 1.137 . . . . 75.430000000000007 110.987 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 216' ' ' LYS . . . . . 0.442 ' O ' ' N ' ' A' ' 220' ' ' THR . 4.2 mmtp -52.18 -54.84 25.92 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.486 1.116 . . . . 71.209999999999994 109.265 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 217' ' ' THR . . . . . 0.485 ' CG2' HD11 ' A' ' 221' ' ' ILE . 1.3 m -54.82 -65.19 0.62 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.478 1.111 . . . . 61.350000000000001 110.38 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 218' ' ' GLN . . . . . 0.657 ' HA ' HD12 ' A' ' 221' ' ' ILE . 5.3 mp0 -48.87 -28.35 3.7 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.472 1.107 . . . . 71.030000000000001 110.284 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -84.68 -27.75 26.85 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.483 1.115 . . . . 73.230000000000004 110.328 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 220' ' ' THR . . . . . 0.452 ' N ' ' O ' ' A' ' 217' ' ' THR . 1.0 OUTLIER -79.96 -17.41 53.03 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.529 1.143 . . . . 64.049999999999997 110.465 179.923 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 221' ' ' ILE . . . . . 1.164 HG22 ' CD1' ' A' ' 167' ' ' TYR . 7.4 mt -89.21 -45.58 15.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.559 1.162 . . . . 72.5 109.329 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 222' ' ' TRP . . . . . 0.59 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 41.7 t90 -68.57 -18.74 64.4 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.573 1.171 . . . . 72.25 107.982 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.76 -24.12 20.46 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.448 1.093 . . . . 62.049999999999997 109.271 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 . . . . . 0 C--N 1.324 -0.514 0 O-C-N 124.495 1.122 . . . . 72.239999999999995 110.294 179.998 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.61 ' O ' ' CZ2' ' A' ' 222' ' ' TRP . 3.2 p . . . . . 0 N--CA 1.454 -0.268 0 N-CA-C 109.257 -0.646 . . . . 70.439999999999998 109.257 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.488 ' N ' HG22 ' A' ' 77' ' ' VAL . 5.8 t80 -87.75 26.9 1.22 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.511 1.132 . . . . 75.450000000000003 110.969 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.634 HD11 HG22 ' A' ' 110' ' ' ILE . 4.5 tp -41.03 160.89 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.538 1.149 . . . . 73.340000000000003 109.309 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.722 ' HD3' HG22 ' A' ' 106' ' ' ILE . 6.4 ptmt -111.9 -47.22 3.15 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.529 1.143 . . . . 71.329999999999998 109.336 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.664 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.2 OUTLIER -167.32 139.58 3.31 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.516 1.135 . . . . 74.019999999999996 110.998 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.737 ' CG1' HG22 ' A' ' 135' ' ' THR . 7.3 p -96.72 165.42 2.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.544 1.152 . . . . 64.349999999999994 109.322 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.822 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.3 mp -126.01 97.2 4.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.569 1.168 . . . . 63.450000000000003 109.283 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.697 HD11 ' CB ' ' A' ' 128' ' ' ALA . 10.9 mt -70.88 117.37 12.3 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.525 1.14 . . . . 74.200000000000003 109.341 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.671 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -138.66 174.26 10.72 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.449 1.093 . . . . 70.099999999999994 109.646 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.48 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -124.83 149.08 47.83 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.499 1.125 . . . . 54.530000000000001 109.306 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -44.6 -27.05 0.43 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.436 1.085 . . . . 70.010000000000005 110.262 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 57.3 t0 -66.62 -44.83 80.99 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.542 1.151 . . . . 70.420000000000002 109.309 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.452 ' N ' ' O ' ' A' ' 86' ' ' ALA . 22.9 m-20 -124.01 41.27 3.53 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.515 1.135 . . . . 74.099999999999994 109.296 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.596 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -70.51 -41.11 73.03 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.469 1.106 . . . . 74.120000000000005 110.442 179.947 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -69.92 -31.96 70.0 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.468 1.105 . . . . 74.510000000000005 109.319 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -60.16 -69.45 0.22 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.525 1.141 . . . . 74.140000000000001 110.288 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.827 ' HB2' HD22 ' A' ' 138' ' ' LEU . . . -46.09 -28.87 1.31 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.526 1.141 . . . . 52.210000000000001 109.269 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.498 ' HG ' HD13 ' A' ' 111' ' ' ILE . 0.7 OUTLIER -69.37 -57.63 5.04 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.516 1.135 . . . . 71.129999999999995 109.286 -179.977 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 11.4 tpp180 -41.4 -36.2 0.8 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.457 1.098 . . . . 74.519999999999996 110.347 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.887 HG21 ' HE1' ' A' ' 173' ' ' MET . 1.9 t -77.75 -65.15 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 O-C-N 124.493 1.121 . . . . 74.420000000000002 109.334 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.5 ' N ' HG12 ' A' ' 96' ' ' VAL . 0.1 OUTLIER -45.14 -21.84 0.09 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.52 1.138 . . . . 72.099999999999994 110.309 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.44 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.1 OUTLIER -78.57 -59.64 2.7 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.519 1.137 . . . . 71.409999999999997 109.3 -179.975 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.845 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -61.8 -22.11 65.18 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.556 1.16 . . . . 70.129999999999995 109.312 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.845 ' N ' HD23 ' A' ' 99' ' ' LEU . 15.5 mt -64.64 -55.55 19.46 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.534 1.147 . . . . 44.420000000000002 109.252 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -78.82 54.01 1.47 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.506 1.129 . . . . 74.409999999999997 110.287 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -174.78 -67.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.515 1.135 . . . . 72.510000000000005 109.242 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -45.26 -51.86 10.29 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.523 1.14 . . . . 71.239999999999995 109.346 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.404 ' CE2' HG11 ' A' ' 206' ' ' VAL . 4.6 m-85 -113.4 -24.92 9.05 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.41 1.069 . . . . 75.219999999999999 110.942 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.406 ' C ' ' CD ' ' A' ' 107' ' ' LYS . . . 92.59 44.72 3.89 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.538 1.149 . . . . 53.32 111.031 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.722 HG22 ' HD3' ' A' ' 80' ' ' LYS . 8.5 mm -84.35 75.22 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 O-C-N 124.497 0.763 . . . . 72.420000000000002 109.35 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.536 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -119.56 156.38 53.51 Favored Pre-proline 0 C--N 1.326 -0.451 0 O-C-N 124.417 1.073 . . . . 71.209999999999994 109.282 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.536 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.95 161.36 94.99 Favored 'Cis proline' 0 C--N 1.359 1.111 0 C-N-CA 121.001 -2.499 . . . . 62.310000000000002 111.015 -0.048 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -135.91 118.7 1.89 Allowed Glycine 0 CA--C 1.53 0.995 0 O-C-N 124.422 1.076 . . . . 73.219999999999999 111.016 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.634 HG22 HD11 ' A' ' 79' ' ' LEU . 1.3 tt -136.06 149.89 27.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.55 0.794 . . . . 74.519999999999996 109.296 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ILE . . . . . 0.671 HD12 ' NE2' ' A' ' 85' ' ' HIS . 33.5 pt -98.11 161.0 3.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.439 1.087 . . . . 73.239999999999995 109.336 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.871 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 2.5 t80 -62.04 -19.21 62.66 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.52 1.138 . . . . 74.340000000000003 111.059 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.401 ' HB2' ' HE1' ' A' ' 85' ' ' HIS . . . -87.33 -11.6 48.96 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.517 1.136 . . . . 62.399999999999999 109.386 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.401 ' C ' HD11 ' A' ' 110' ' ' ILE . 7.7 mm-40 -104.08 -20.88 13.69 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.486 1.117 . . . . 73.409999999999997 110.321 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.471 ' CE ' ' CG2' ' A' ' 82' ' ' VAL . 21.9 tpp -44.57 134.36 4.66 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 124.464 1.102 . . . . 52.030000000000001 110.98 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 C--N 1.36 1.177 0 O-C-N 124.531 1.806 . . . . 54.43 110.992 -179.981 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.769 ' HB2' HD11 ' A' ' 157' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.271 0 N-CA-C 109.291 -0.633 . . . . 65.040000000000006 109.291 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.426 ' HA ' ' CG2' ' A' ' 129' ' ' VAL . 0.6 OUTLIER -41.31 -59.02 1.66 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.481 1.113 . . . . 73.299999999999997 109.307 -179.996 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -43.64 -46.95 7.54 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.492 1.12 . . . . 71.549999999999997 109.333 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.871 ' HB2' ' CE1' ' A' ' 112' ' ' PHE . . . -61.52 -46.66 89.0 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.427 1.079 . . . . 73.209999999999994 109.268 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.706 ' HA ' HG21 ' A' ' 135' ' ' THR . 35.2 m -92.38 30.94 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.525 1.14 . . . . 63.399999999999999 109.309 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' ASN . . . . . 0.403 ' N ' ' O ' ' A' ' 126' ' ' ASP . 8.9 t30 -148.46 118.48 7.2 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.494 1.121 . . . . 75.540000000000006 109.32 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 102.78 34.15 4.16 Favored Glycine 0 CA--C 1.53 1.028 0 O-C-N 124.515 1.135 . . . . 71.109999999999999 110.928 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' SER . . . . . 0.403 ' O ' ' O ' ' A' ' 167' ' ' TYR . 0.7 OUTLIER -163.54 -173.81 3.46 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.503 0.767 . . . . 73.109999999999999 110.025 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' A' ' 80' ' ' LYS . . . -91.09 -68.59 0.78 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.456 1.097 . . . . 74.349999999999994 109.275 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.605 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 0.9 OUTLIER -121.52 174.86 6.51 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.509 1.131 . . . . 73.409999999999997 108.021 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 135' ' ' THR . . . . . 0.737 HG22 ' CG1' ' A' ' 82' ' ' VAL . 2.5 p -143.28 136.0 27.56 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.483 1.114 . . . . 51.409999999999997 110.374 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.822 ' HB ' HG23 ' A' ' 83' ' ' ILE . 14.5 mm -89.5 113.46 25.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.477 1.111 . . . . 71.219999999999999 109.29 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.693 HD11 ' CG1' ' A' ' 170' ' ' VAL . 2.8 mt -99.06 89.65 4.34 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.536 1.147 . . . . 75.239999999999995 109.278 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.827 HD22 ' HB2' ' A' ' 93' ' ' ALA . 2.4 tp -62.2 102.3 0.29 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.472 1.107 . . . . 65.120000000000005 109.286 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.562 HD13 HG23 ' A' ' 185' ' ' THR . 55.2 mt -77.37 121.24 23.5 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.461 1.101 . . . . 63.409999999999997 109.344 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' THR . . . . . 0.668 HG23 ' ND2' ' A' ' 178' ' ' ASN . 10.6 m -139.74 162.19 35.73 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.523 1.14 . . . . 70.530000000000001 110.397 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -53.65 -40.86 66.21 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.566 1.166 . . . . 74.430000000000007 110.295 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -89.76 -52.32 5.05 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.442 1.089 . . . . 72.310000000000002 109.326 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.48 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 6.6 t80 -49.51 -27.64 4.58 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.481 1.113 . . . . 71.420000000000002 110.926 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.708 HD13 ' C ' ' A' ' 144' ' ' LEU . 2.1 tm? -63.0 -67.98 0.38 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.471 1.107 . . . . 60.450000000000003 109.336 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.463 ' C ' ' CD ' ' A' ' 145' ' ' ARG . 0.2 OUTLIER -65.32 -14.7 61.39 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.507 1.129 . . . . 71.310000000000002 110.242 -179.977 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 146' ' ' ASP . . . . . 0.418 ' N ' ' HD2' ' A' ' 145' ' ' ARG . 21.1 t0 -67.51 -60.64 2.4 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.498 1.124 . . . . 74.409999999999997 109.313 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.517 ' HB ' ' CE1' ' A' ' 151' ' ' PHE . 2.3 p -84.91 -47.52 10.22 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.519 1.137 . . . . 75.219999999999999 110.416 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.475 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 33.0 t-105 -45.7 -30.52 1.61 Allowed 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.517 1.136 . . . . 71.409999999999997 108.084 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 149' ' ' CYS . . . . . 0.452 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 40.5 t -78.47 -45.68 21.52 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.462 1.101 . . . . 75.319999999999993 108.27 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 150' ' ' ASN . . . . . 0.463 ' N ' ' O ' ' A' ' 147' ' ' THR . 17.2 m-80 -67.41 -13.66 62.22 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.475 1.109 . . . . 75.129999999999995 109.289 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.886 ' CE1' HD22 ' A' ' 157' ' ' LEU . 5.4 m-30 -80.62 -51.05 9.17 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.505 1.128 . . . . 70.239999999999995 111.025 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -50.91 -40.36 56.78 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.541 1.151 . . . . 73.340000000000003 110.349 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 51.4 t80 -83.8 -17.37 41.29 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.489 1.118 . . . . 62.399999999999999 111.017 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.429 ' CE2' ' HB3' ' A' ' 156' ' ' SER . 1.3 t80 -136.9 105.7 5.89 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.515 1.134 . . . . 72.109999999999999 110.946 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 4.0 t -78.06 -2.96 39.8 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.411 1.07 . . . . 53.340000000000003 110.461 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 156' ' ' SER . . . . . 0.429 ' HB3' ' CE2' ' A' ' 154' ' ' TYR . 10.2 p -44.39 -49.42 9.68 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.474 1.109 . . . . 54.439999999999998 110.032 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.886 HD22 ' CE1' ' A' ' 151' ' ' PHE . 4.4 mp -70.76 -42.47 70.39 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.458 1.099 . . . . 71.209999999999994 109.278 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 158' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -50.57 -21.53 1.58 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.512 1.132 . . . . 73.510000000000005 111.002 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -82.87 -32.77 27.26 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.549 1.156 . . . . 73.340000000000003 109.289 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 160' ' ' SER . . . . . 0.605 ' HB2' HG21 ' A' ' 170' ' ' VAL . 6.0 m -79.88 -31.56 40.35 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.55 1.156 . . . . 74.040000000000006 110.014 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 161' ' ' VAL . . . . . 0.589 HG12 HD11 ' A' ' 192' ' ' ILE . 96.5 t -61.28 -18.59 18.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.482 1.114 . . . . 74.200000000000003 109.264 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -66.41 -20.54 66.09 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.526 1.141 . . . . 61.030000000000001 109.267 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.553 ' HD3' HG23 ' A' ' 192' ' ' ILE . 15.7 mmm-85 69.03 43.79 1.09 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.543 1.152 . . . . 60.520000000000003 110.301 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -69.99 176.73 3.55 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.484 1.115 . . . . 62.039999999999999 110.255 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 11.2 m80 -90.69 39.58 0.99 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.523 1.14 . . . . 71.019999999999996 109.607 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -90.74 -178.73 5.34 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.53 1.144 . . . . 73.329999999999998 109.319 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 167' ' ' TYR . . . . . 0.515 ' HB3' HG22 ' A' ' 221' ' ' ILE . 0.4 OUTLIER -85.63 44.46 1.11 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.514 1.133 . . . . 73.150000000000006 110.976 -179.983 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 168' ' ' ASN . . . . . 0.465 ' O ' ' ND2' ' A' ' 168' ' ' ASN . 0.4 OUTLIER -170.36 124.27 0.71 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.505 1.128 . . . . 60.409999999999997 109.301 179.966 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.461 ' O ' ' HA ' ' A' ' 134' ' ' TRP . 2.5 m -125.0 111.52 15.49 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.486 1.116 . . . . 54.520000000000003 110.017 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.776 ' C ' HD12 ' A' ' 171' ' ' ILE . 3.8 t -79.45 112.78 17.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.57 1.168 . . . . 52.109999999999999 109.296 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.776 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -129.15 102.53 18.79 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.524 1.14 . . . . 54.210000000000001 109.264 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 172' ' ' PRO . . . . . 0.915 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.03 114.8 4.11 Favored 'Trans proline' 0 C--N 1.36 1.164 0 O-C-N 124.479 1.779 . . . . 51.409999999999997 111.056 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 173' ' ' MET . . . . . 0.887 ' HE1' HG21 ' A' ' 96' ' ' VAL . 6.1 ttt -80.2 161.55 25.14 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.527 1.142 . . . . 75.230000000000004 110.982 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 174' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 195' ' ' LEU . 75.0 mtt-85 -107.63 112.1 62.39 Favored Pre-proline 0 C--N 1.326 -0.435 0 O-C-N 124.528 1.142 . . . . 73.439999999999998 110.259 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 175' ' ' PRO . . . . . 0.727 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -74.98 154.69 42.79 Favored 'Trans proline' 0 C--N 1.36 1.168 0 O-C-N 124.446 1.761 . . . . 72.439999999999998 110.987 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 176' ' ' LEU . . . . . 0.901 HD11 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -100.36 -45.34 5.61 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.453 1.095 . . . . 45.43 109.312 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -72.73 -25.12 61.1 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 73.120000000000005 109.323 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 178' ' ' ASN . . . . . 0.668 ' ND2' HG23 ' A' ' 140' ' ' THR . 8.1 t-20 -108.75 101.7 44.89 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.507 1.129 . . . . 72.430000000000007 109.211 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.05 117.61 4.96 Favored 'Trans proline' 0 C--N 1.36 1.184 0 O-C-N 124.499 1.789 . . . . 64.400000000000006 111.001 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.482 ' HA ' HD22 ' A' ' 180' ' ' LEU . 0.9 OUTLIER -132.97 96.67 17.57 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.561 1.163 . . . . 61.549999999999997 109.279 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 181' ' ' PRO . . . . . 0.45 ' HG2' ' CG ' ' A' ' 183' ' ' GLU . 18.2 Cg_endo -75.04 164.31 33.54 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.471 1.774 . . . . 63.420000000000002 110.991 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.04 -38.98 54.79 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.473 1.108 . . . . 73.239999999999995 110.279 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 183' ' ' GLU . . . . . 0.45 ' CG ' ' HG2' ' A' ' 181' ' ' PRO . 4.4 pt-20 -49.45 -33.16 13.46 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.483 1.115 . . . . 74.239999999999995 110.325 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 184' ' ' ARG . . . . . 0.475 ' HB2' HD13 ' A' ' 180' ' ' LEU . 58.7 mmt-85 -91.83 -21.77 20.47 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.584 1.178 . . . . 73.230000000000004 110.317 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 185' ' ' THR . . . . . 0.562 HG23 HD13 ' A' ' 139' ' ' LEU . 19.4 m -84.36 143.86 42.54 Favored Pre-proline 0 C--N 1.325 -0.468 0 O-C-N 124.452 1.095 . . . . 74.409999999999997 110.412 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 186' ' ' PRO . . . . . 0.823 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -74.99 156.56 43.04 Favored 'Trans proline' 0 C--N 1.36 1.164 0 O-C-N 124.496 1.787 . . . . 63.420000000000002 111.007 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 187' ' ' PHE . . . . . 0.451 ' O ' ' CG2' ' A' ' 191' ' ' THR . 32.3 p90 -70.03 -7.03 37.71 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.493 1.121 . . . . 74.109999999999999 110.996 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 188' ' ' ALA . . . . . 0.473 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -94.26 -52.9 4.16 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.46 1.1 . . . . 63.219999999999999 109.23 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.823 HD12 ' CG ' ' A' ' 186' ' ' PRO . 44.2 mt -68.48 -42.09 79.19 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.513 1.133 . . . . 72.049999999999997 109.334 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 190' ' ' GLN . . . . . 0.409 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 7.2 pt20 -64.01 -9.9 18.67 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.523 1.139 . . . . 75.450000000000003 110.27 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 191' ' ' THR . . . . . 0.451 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 41.4 p -116.56 20.0 14.32 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.451 1.095 . . . . 75.319999999999993 110.38 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.589 HD11 HG12 ' A' ' 161' ' ' VAL . 6.5 mt -120.58 154.43 23.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.478 1.111 . . . . 74.409999999999997 109.285 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 193' ' ' ASN . . . . . 0.486 ' H ' ' NH1' ' A' ' 163' ' ' ARG . 35.4 t30 -64.84 77.47 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.491 1.12 . . . . 64.439999999999998 109.294 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 194' ' ' ALA . . . . . 0.915 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -73.51 174.78 7.75 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.496 1.123 . . . . 43.130000000000003 109.28 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 195' ' ' LEU . . . . . 0.936 HD23 HD12 ' A' ' 209' ' ' ILE . 0.4 OUTLIER -108.3 150.88 26.73 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.472 1.108 . . . . 71.120000000000005 109.348 179.97 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 196' ' ' GLU . . . . . 0.512 ' N ' HD13 ' A' ' 195' ' ' LEU . 26.3 mt-10 -141.92 141.4 32.98 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.429 1.08 . . . . 73.120000000000005 110.338 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.901 ' HG3' HD11 ' A' ' 176' ' ' LEU . 1.2 pt-20 -113.21 -28.78 7.5 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.474 1.109 . . . . 72.099999999999994 110.283 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 198' ' ' GLU . . . . . 0.56 ' CG ' HD12 ' A' ' 176' ' ' LEU . 21.0 pt-20 -88.37 3.01 51.37 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.488 1.117 . . . . 74.010000000000005 110.3 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 5.5 t -97.84 144.47 27.39 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.503 1.127 . . . . 73.349999999999994 110.03 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 4.8 tpm_? -61.87 -17.52 56.82 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.454 1.096 . . . . 71.230000000000004 110.253 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -103.07 19.05 47.63 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.47 1.106 . . . . 64.329999999999998 111.02 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 202' ' ' PHE . . . . . 0.885 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.1 OUTLIER -55.03 -44.34 99.55 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.469 0.747 . . . . 71.310000000000002 111.025 179.969 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 203' ' ' PRO . . . . . 0.597 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.05 -35.01 3.35 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.516 1.798 . . . . 60.049999999999997 110.963 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.98 -48.3 78.74 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.498 1.124 . . . . 62.549999999999997 110.362 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 205' ' ' GLN . . . . . 0.454 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 3.1 mt-30 -71.34 -38.7 71.64 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.443 1.09 . . . . 74.400000000000006 110.267 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 206' ' ' VAL . . . . . 0.885 HG23 ' O ' ' A' ' 202' ' ' PHE . 70.7 t -65.71 -28.96 45.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.544 1.153 . . . . 73.310000000000002 109.327 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 207' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 2.8 mt-10 -78.04 -47.37 18.54 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.49 1.119 . . . . 72.510000000000005 110.337 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -68.97 -62.39 1.4 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.497 1.123 . . . . 62.43 110.253 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 209' ' ' ILE . . . . . 0.936 HD12 HD23 ' A' ' 195' ' ' LEU . 59.8 mt -47.92 -58.28 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.491 1.119 . . . . 64.319999999999993 109.328 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 210' ' ' PHE . . . . . 0.785 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.7 m-85 -99.46 66.68 1.48 Allowed 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.547 1.154 . . . . 61.229999999999997 110.996 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 211' ' ' GLN . . . . . 0.543 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -108.5 144.75 35.74 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.543 1.152 . . . . 75.319999999999993 110.321 179.974 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 212' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' A' ' 215' ' ' TYR . 29.3 tt0 -48.79 -55.26 12.06 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.575 1.172 . . . . 64.439999999999998 110.243 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.43 -24.85 1.39 Allowed 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.484 1.115 . . . . 74.420000000000002 110.017 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.543 HG23 ' HG2' ' A' ' 211' ' ' GLN . 43.9 t -96.71 -26.66 4.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.431 1.082 . . . . 72.120000000000005 109.277 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 215' ' ' TYR . . . . . 0.488 ' O ' ' CB ' ' A' ' 219' ' ' GLN . 1.8 t80 -69.2 -29.87 67.93 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.481 1.113 . . . . 75.120000000000005 110.98 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 29.8 mmtt -65.13 -66.32 0.56 Allowed 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.502 1.126 . . . . 74.439999999999998 109.322 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 217' ' ' THR . . . . . 0.796 HG22 HD11 ' A' ' 221' ' ' ILE . 10.1 m -44.44 -66.46 0.39 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.453 1.095 . . . . 52.229999999999997 110.376 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 218' ' ' GLN . . . . . 0.946 ' HA ' HD12 ' A' ' 221' ' ' ILE . 3.2 mp0 -47.29 -62.36 1.46 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.54 1.15 . . . . 72.450000000000003 110.285 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 219' ' ' GLN . . . . . 0.488 ' CB ' ' O ' ' A' ' 215' ' ' TYR . 33.8 tp60 -40.01 -46.03 2.02 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.452 1.095 . . . . 75.129999999999995 110.281 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.1 m -66.09 -44.39 84.52 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.463 1.102 . . . . 71.120000000000005 110.4 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 221' ' ' ILE . . . . . 0.946 HD12 ' HA ' ' A' ' 218' ' ' GLN . 15.4 mt -56.19 -24.4 17.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 O-C-N 124.559 1.162 . . . . 60.240000000000002 109.274 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 222' ' ' TRP . . . . . 0.61 ' CZ2' ' O ' ' A' ' 77' ' ' VAL . 73.4 t90 -78.24 -74.09 0.29 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.529 1.143 . . . . 73.209999999999994 108.006 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 223' ' ' LYS . . . . . 0.419 ' HG3' ' N ' ' A' ' 224' ' ' GLU . 0.3 OUTLIER -44.28 -26.08 0.29 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.44 1.087 . . . . 75.209999999999994 109.334 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 224' ' ' GLU . . . . . 0.436 ' N ' ' C ' ' A' ' 222' ' ' TRP . 3.2 mm-40 . . . . . 0 C--N 1.326 -0.436 0 O-C-N 124.521 1.138 . . . . 73.310000000000002 110.263 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.491 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.5 p . . . . . 0 N--CA 1.453 -0.325 0 N-CA-C 109.332 -0.618 . . . . 70.109999999999999 109.332 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.564 ' CE2' ' HD3' ' A' ' 108' ' ' PRO . 8.5 p90 -89.61 29.35 1.15 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.422 1.076 . . . . 63.450000000000003 110.99 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 5.8 tp -39.9 155.66 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.529 1.143 . . . . 74.140000000000001 109.328 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.814 ' HZ3' HG23 ' A' ' 106' ' ' ILE . 1.4 ttpt -95.69 -58.54 2.08 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.548 1.155 . . . . 72.030000000000001 109.31 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.825 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.2 OUTLIER -165.05 146.69 7.76 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.468 1.105 . . . . 61.340000000000003 111.056 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.635 HG21 ' CE ' ' A' ' 115' ' ' MET . 12.0 p -99.62 151.37 4.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.559 1.162 . . . . 64.430000000000007 109.335 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.864 HG23 ' HB ' ' A' ' 136' ' ' ILE . 4.6 mp -114.77 99.41 8.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.525 1.141 . . . . 74.099999999999994 109.268 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.019 HD11 ' HB1' ' A' ' 128' ' ' ALA . 1.9 mp -73.45 117.46 15.24 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.566 1.166 . . . . 65.200000000000003 109.31 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.792 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -135.58 166.49 23.1 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.531 1.144 . . . . 75.510000000000005 109.611 -179.999 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.453 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -105.03 155.61 18.81 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.566 1.166 . . . . 62.520000000000003 109.341 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -57.49 -17.03 11.4 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.536 1.148 . . . . 45.119999999999997 110.349 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -82.99 -43.16 16.71 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.465 1.103 . . . . 63.520000000000003 109.292 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.463 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -119.1 42.97 2.7 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.525 1.141 . . . . 72.430000000000007 109.306 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.594 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -80.62 -25.97 38.07 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.571 1.169 . . . . 64.310000000000002 110.409 179.979 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.441 ' O ' ' N ' ' A' ' 95' ' ' ARG . 0.8 OUTLIER -79.81 -35.44 38.43 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.477 1.111 . . . . 75.530000000000001 109.334 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.462 ' O ' ' N ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -62.75 -66.89 0.47 Allowed 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.499 1.124 . . . . 44.539999999999999 110.259 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.698 ' HB2' HD22 ' A' ' 138' ' ' LEU . . . -47.31 -36.89 9.92 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.523 1.139 . . . . 53.32 109.302 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.841 HD22 ' O ' ' A' ' 94' ' ' LEU . 0.1 OUTLIER -74.97 -33.39 61.88 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 124.483 1.115 . . . . 64.120000000000005 109.298 -179.966 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 92' ' ' GLU . 11.6 tpt180 -54.09 -46.67 72.13 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.515 1.135 . . . . 73.120000000000005 110.293 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.543 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 0.3 OUTLIER -76.21 -52.39 17.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.415 1.072 . . . . 71.319999999999993 109.327 179.978 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.543 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -48.15 -23.49 0.86 Allowed 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.521 1.138 . . . . 44.439999999999998 110.343 179.951 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -75.65 -38.59 58.72 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.557 1.161 . . . . 73.420000000000002 109.298 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.71 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -83.26 -21.67 33.26 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.515 1.134 . . . . 54.420000000000002 109.318 179.954 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.852 HD22 HG21 ' A' ' 206' ' ' VAL . 51.1 mt -61.97 -51.84 66.44 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.485 1.116 . . . . 74.099999999999994 109.285 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 16.7 pt20 -76.39 55.1 0.97 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.524 1.14 . . . . 73.430000000000007 110.281 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -179.71 -67.43 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.497 1.123 . . . . 74.329999999999998 109.318 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -40.73 -60.96 1.03 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.523 1.139 . . . . 65.120000000000005 109.36 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.48 ' CZ ' HG11 ' A' ' 206' ' ' VAL . 1.3 m-85 -104.25 -19.47 14.1 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.477 1.111 . . . . 43.409999999999997 110.977 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.06 45.18 4.22 Favored Glycine 0 CA--C 1.529 0.945 0 O-C-N 124.493 1.121 . . . . 73.239999999999995 111.042 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.814 HG23 ' HZ3' ' A' ' 80' ' ' LYS . 6.6 mm -85.29 86.36 2.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.436 0.727 . . . . 73.0 109.298 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.529 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -138.06 157.2 73.39 Favored Pre-proline 0 C--N 1.326 -0.454 0 O-C-N 124.475 1.11 . . . . 74.200000000000003 109.322 179.951 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.564 ' HD3' ' CE2' ' A' ' 78' ' ' PHE . 18.0 Cg_endo -75.12 150.17 94.83 Favored 'Cis proline' 0 C--N 1.36 1.141 0 C-N-CA 120.938 -2.526 . . . . 75.420000000000002 110.987 0.173 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -122.65 137.73 11.44 Favored Glycine 0 CA--C 1.53 1.0 0 O-C-N 124.484 1.115 . . . . 73.349999999999994 110.955 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 1.2 tt -153.72 148.26 13.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.516 0.774 . . . . 73.299999999999997 109.334 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ILE . . . . . 0.792 HD12 ' NE2' ' A' ' 85' ' ' HIS . 32.4 pt -101.39 161.45 3.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.482 1.114 . . . . 73.019999999999996 109.272 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -61.55 -19.6 62.33 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.46 1.1 . . . . 73.329999999999998 110.95 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.429 ' HB2' ' HE1' ' A' ' 85' ' ' HIS . . . -87.64 -12.41 45.59 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.536 1.148 . . . . 71.299999999999997 109.304 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -103.83 -17.49 15.03 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.528 1.142 . . . . 64.310000000000002 110.276 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.635 ' CE ' HG21 ' A' ' 82' ' ' VAL . 9.1 ttm -50.84 143.52 14.93 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.523 1.139 . . . . 71.209999999999994 110.996 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.459 ' HD2' ' CG ' ' A' ' 115' ' ' MET . 18.1 Cg_endo . . . . . 0 C--N 1.359 1.13 0 O-C-N 124.532 1.806 . . . . 72.25 111.057 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.802 HD11 ' HB3' ' A' ' 150' ' ' ASN . 2.9 mt . . . . . 0 N--CA 1.454 -0.256 0 N-CA-C 109.339 -0.615 . . . . 70.099999999999994 109.339 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.474 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 0.2 OUTLIER -40.31 -44.23 1.88 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.49 1.119 . . . . 64.519999999999996 109.278 -179.995 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -50.07 -49.68 50.54 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.477 1.11 . . . . 55.310000000000002 109.362 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 1.019 ' HB1' HD11 ' A' ' 84' ' ' LEU . . . -68.87 -38.56 79.8 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.53 1.144 . . . . 73.209999999999994 109.324 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.712 HG12 ' O ' ' A' ' 129' ' ' VAL . 86.9 t -92.93 30.64 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.462 1.101 . . . . 74.400000000000006 109.288 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' ASN . . . . . 0.474 ' CB ' ' O ' ' A' ' 126' ' ' ASP . 6.2 t30 -138.47 152.3 48.18 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.437 1.086 . . . . 75.439999999999998 109.296 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 51.35 53.51 27.83 Favored Glycine 0 CA--C 1.53 0.983 0 O-C-N 124.448 1.092 . . . . 31.41 110.982 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 1.2 p -163.4 -179.73 6.74 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.501 0.766 . . . . 74.430000000000007 109.974 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.85 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -104.25 -46.26 4.46 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.524 1.14 . . . . 33.340000000000003 109.29 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.85 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 0.5 OUTLIER -145.51 174.29 11.28 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.567 1.167 . . . . 73.439999999999998 108.042 -179.978 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 135' ' ' THR . . . . . 0.447 HG22 ' CG1' ' A' ' 82' ' ' VAL . 2.4 p -139.22 129.18 25.01 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.497 1.123 . . . . 63.299999999999997 110.387 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.864 ' HB ' HG23 ' A' ' 83' ' ' ILE . 15.0 mm -84.4 95.0 3.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.393 1.058 . . . . 52.439999999999998 109.292 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 13.2 mt -82.69 94.19 7.53 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.486 1.116 . . . . 71.420000000000002 109.344 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.698 HD22 ' HB2' ' A' ' 93' ' ' ALA . 3.3 tp -61.3 97.71 0.07 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.513 1.133 . . . . 62.420000000000002 109.345 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.748 HD11 HD13 ' A' ' 189' ' ' LEU . 2.0 tp -70.22 105.75 3.07 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.478 1.112 . . . . 74.129999999999995 109.296 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 4.8 m -133.63 154.88 50.56 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.471 1.107 . . . . 54.43 110.389 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -49.96 -39.1 39.59 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.546 1.154 . . . . 74.019999999999996 110.302 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -89.0 -53.89 4.38 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.53 1.144 . . . . 55.32 109.318 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.59 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 16.8 t80 -51.19 -20.53 1.59 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.521 1.138 . . . . 73.109999999999999 111.044 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.694 ' C ' HD13 ' A' ' 144' ' ' LEU . 2.0 tm? -60.85 -68.06 0.34 Allowed 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.45 1.094 . . . . 70.549999999999997 109.336 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.544 HH11 HD12 ' A' ' 144' ' ' LEU . 2.0 mpt_? -67.52 -12.21 59.81 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.462 1.101 . . . . 75.040000000000006 110.3 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 146' ' ' ASP . . . . . 0.4 ' O ' ' CG ' ' A' ' 150' ' ' ASN . 27.6 t0 -65.84 -61.45 2.05 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.563 1.164 . . . . 73.430000000000007 109.303 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.666 HG23 ' CZ ' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -88.23 -46.5 9.19 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.554 1.159 . . . . 62.539999999999999 110.407 -179.981 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.519 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 32.1 t-105 -44.52 -34.4 2.09 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.522 1.139 . . . . 61.020000000000003 107.979 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 149' ' ' CYS . . . . . 0.451 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 42.3 t -77.87 -45.43 24.24 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.502 1.126 . . . . 62.130000000000003 108.304 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 150' ' ' ASN . . . . . 0.802 ' HB3' HD11 ' A' ' 125' ' ' LEU . 6.6 m120 -62.51 -16.93 58.41 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.446 1.091 . . . . 74.430000000000007 109.306 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.871 ' CD1' HD21 ' A' ' 157' ' ' LEU . 8.7 m-30 -82.19 -47.8 12.05 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.515 1.135 . . . . 71.409999999999997 111.063 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -48.15 -39.83 21.93 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.499 1.124 . . . . 74.040000000000006 110.291 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -83.96 -23.23 31.18 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.47 1.106 . . . . 74.519999999999996 110.924 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.534 ' CE2' ' HB2' ' A' ' 156' ' ' SER . 5.6 t80 -129.13 97.99 4.78 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.467 1.105 . . . . 63.039999999999999 111.016 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.45 -2.7 57.64 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.523 1.139 . . . . 74.5 110.411 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 156' ' ' SER . . . . . 0.534 ' HB2' ' CE2' ' A' ' 154' ' ' TYR . 1.8 m -53.88 -38.23 64.53 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.513 1.133 . . . . 73.219999999999999 110.01 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.871 HD21 ' CD1' ' A' ' 151' ' ' PHE . 2.3 pp -89.58 -27.66 20.08 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.451 1.094 . . . . 75.109999999999999 109.315 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 158' ' ' MET . . . . . 0.427 ' HE2' ' HA ' ' A' ' 158' ' ' MET . 12.4 tpp -54.66 -26.28 32.28 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.487 1.117 . . . . 64.340000000000003 110.972 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 54.6 m-80 -66.56 -31.17 71.7 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.559 1.162 . . . . 74.120000000000005 109.322 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 160' ' ' SER . . . . . 0.462 ' HB3' ' CG2' ' A' ' 170' ' ' VAL . 0.3 OUTLIER -74.86 -28.15 60.55 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.521 1.138 . . . . 75.030000000000001 110.077 179.922 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 161' ' ' VAL . . . . . 0.771 HG13 HD11 ' A' ' 192' ' ' ILE . 82.4 t -57.39 -17.85 7.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.487 1.117 . . . . 74.310000000000002 109.348 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -91.42 35.71 0.94 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.622 1.201 . . . . 73.299999999999997 109.211 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.457 ' CD ' HG12 ' A' ' 192' ' ' ILE . 0.0 OUTLIER 47.34 32.44 2.22 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.49 1.119 . . . . 70.040000000000006 110.294 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -56.42 129.01 38.8 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.469 1.106 . . . . 71.420000000000002 110.261 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 165' ' ' HIS . . . . . 0.412 ' NE2' HG21 ' A' ' 217' ' ' THR . 59.1 t60 -85.97 48.57 1.63 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.507 1.129 . . . . 74.439999999999998 109.589 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 3.0 tptp -95.63 171.89 8.39 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.506 1.129 . . . . 75.129999999999995 109.204 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 167' ' ' TYR . . . . . 0.787 ' CE2' ' CD1' ' A' ' 222' ' ' TRP . 3.4 t80 -38.45 -64.49 0.42 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.501 1.125 . . . . 64.319999999999993 111.075 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -90.78 133.07 35.47 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.428 1.08 . . . . 70.519999999999996 109.271 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.454 ' N ' ' O ' ' A' ' 133' ' ' ALA . 1.8 t -108.78 177.24 4.83 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.569 1.168 . . . . 65.439999999999998 109.98 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.725 ' C ' HD12 ' A' ' 171' ' ' ILE . 3.2 t -137.36 103.36 2.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.498 1.124 . . . . 75.310000000000002 109.279 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.725 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -121.95 99.95 43.57 Favored Pre-proline 0 C--N 1.324 -0.513 0 O-C-N 124.527 1.142 . . . . 62.200000000000003 109.274 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 172' ' ' PRO . . . . . 0.657 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.3 Cg_endo -75.03 118.85 5.4 Favored 'Trans proline' 0 C--N 1.36 1.178 0 O-C-N 124.444 1.76 . . . . 73.439999999999998 110.98 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 173' ' ' MET . . . . . 0.586 ' HB2' HG23 ' A' ' 136' ' ' ILE . 4.1 ttt -89.09 151.64 22.11 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.471 1.107 . . . . 54.329999999999998 110.962 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 174' ' ' ARG . . . . . 0.555 ' NH2' ' H ' ' A' ' 180' ' ' LEU . 0.2 OUTLIER -105.68 117.52 57.71 Favored Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.469 1.105 . . . . 65.329999999999998 110.286 -179.991 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 175' ' ' PRO . . . . . 0.509 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -75.04 150.0 37.34 Favored 'Trans proline' 0 C--N 1.359 1.112 0 O-C-N 124.515 1.797 . . . . 60.100000000000001 110.99 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 176' ' ' LEU . . . . . 0.797 HD11 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -88.64 -38.86 14.48 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.528 1.142 . . . . 72.129999999999995 109.331 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -72.78 -26.48 61.55 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.459 1.099 . . . . 74.420000000000002 109.255 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 178' ' ' ASN . . . . . 0.437 ' O ' ' NH2' ' A' ' 174' ' ' ARG . 4.0 m-80 -110.76 103.03 53.9 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.55 1.156 . . . . 60.329999999999998 109.297 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.05 115.65 4.34 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.543 1.812 . . . . 71.140000000000001 110.963 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.555 ' H ' ' NH2' ' A' ' 174' ' ' ARG . 0.4 OUTLIER -116.98 97.09 50.28 Favored Pre-proline 0 C--N 1.325 -0.484 0 O-C-N 124.557 1.161 . . . . 52.229999999999997 109.3 179.969 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 164.51 33.22 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.467 1.772 . . . . 75.219999999999999 111.016 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 59.4 mtt180 -67.13 -16.64 64.45 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.544 1.152 . . . . 72.310000000000002 110.335 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -74.81 -17.09 60.67 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.512 1.133 . . . . 65.400000000000006 110.342 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -117.41 16.69 14.71 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.525 1.141 . . . . 73.409999999999997 110.357 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 185' ' ' THR . . . . . 0.498 ' OG1' ' CD1' ' A' ' 180' ' ' LEU . 19.1 m -116.86 143.6 31.82 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.456 1.098 . . . . 73.239999999999995 110.435 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 186' ' ' PRO . . . . . 0.828 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.5 Cg_endo -75.04 155.99 42.77 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.539 1.81 . . . . 73.540000000000006 111.022 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 187' ' ' PHE . . . . . 0.503 ' O ' ' CG2' ' A' ' 191' ' ' THR . 37.9 p90 -69.74 -7.26 37.95 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.516 1.135 . . . . 72.340000000000003 110.956 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.87 -52.74 4.29 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.502 1.126 . . . . 70.299999999999997 109.312 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.875 ' HA ' HD12 ' A' ' 192' ' ' ILE . 43.4 mt -68.45 -42.31 78.99 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.521 1.138 . . . . 73.420000000000002 109.29 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 190' ' ' GLN . . . . . 0.409 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 6.9 pt20 -63.98 -10.76 23.35 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.46 1.1 . . . . 75.400000000000006 110.344 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 191' ' ' THR . . . . . 0.503 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 35.7 p -113.64 19.92 16.37 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.535 1.147 . . . . 75.239999999999995 110.383 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.875 HD12 ' HA ' ' A' ' 189' ' ' LEU . 28.1 mt -113.28 160.64 12.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.486 1.116 . . . . 71.030000000000001 109.262 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 193' ' ' ASN . . . . . 0.533 ' ND2' ' OE1' ' A' ' 205' ' ' GLN . 4.3 t-20 -76.39 62.88 1.89 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.502 1.127 . . . . 71.439999999999998 109.301 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 194' ' ' ALA . . . . . 0.657 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -56.96 143.41 38.03 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.441 1.088 . . . . 53.109999999999999 109.308 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 195' ' ' LEU . . . . . 0.548 HD12 ' CE ' ' A' ' 173' ' ' MET . 0.7 OUTLIER -80.26 123.49 28.01 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.47 1.106 . . . . 71.450000000000003 109.27 -179.926 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 196' ' ' GLU . . . . . 0.407 ' O ' ' HA ' ' A' ' 202' ' ' PHE . 14.1 mt-10 -103.43 137.5 41.44 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.453 1.096 . . . . 73.319999999999993 110.294 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.797 ' HG3' HD11 ' A' ' 176' ' ' LEU . 0.6 OUTLIER -113.71 -24.73 9.02 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.552 1.157 . . . . 74.209999999999994 110.292 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 198' ' ' GLU . . . . . 0.573 ' HG2' HD12 ' A' ' 176' ' ' LEU . 6.5 pt-20 -102.51 21.72 14.75 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.518 1.136 . . . . 62.109999999999999 110.269 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -117.34 162.99 17.02 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 124.513 1.133 . . . . 63.399999999999999 110.014 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 21.5 ttt-85 -64.88 -42.77 94.55 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.499 1.124 . . . . 71.239999999999995 110.316 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -90.9 41.62 2.91 Favored Glycine 0 CA--C 1.531 1.072 0 O-C-N 124.475 1.11 . . . . 71.329999999999998 110.97 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 202' ' ' PHE . . . . . 0.611 ' CD1' ' C ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -77.63 -47.71 2.36 Favored Pre-proline 0 C--N 1.325 -0.495 0 O-C-N 124.555 0.797 . . . . 71.230000000000004 110.974 -179.983 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 203' ' ' PRO . . . . . 0.654 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.5 Cg_endo -75.02 -25.94 11.35 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.528 1.804 . . . . 73.209999999999994 111.053 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 204' ' ' THR . . . . . 0.453 ' O ' ' HB2' ' A' ' 207' ' ' GLU . 0.8 OUTLIER -61.69 -55.45 30.31 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.572 1.17 . . . . 54.030000000000001 110.407 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 205' ' ' GLN . . . . . 0.533 ' OE1' ' ND2' ' A' ' 193' ' ' ASN . 2.1 mt-30 -54.55 -62.43 1.66 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.599 1.187 . . . . 75.109999999999999 110.377 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 206' ' ' VAL . . . . . 0.852 HG21 HD22 ' A' ' 100' ' ' LEU . 3.2 p -40.75 -30.98 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.518 1.136 . . . . 71.439999999999998 109.351 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 207' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 204' ' ' THR . 0.9 OUTLIER -79.56 -65.88 0.94 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.516 1.135 . . . . 72.209999999999994 110.302 179.969 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 208' ' ' ARG . . . . . 0.429 ' HD3' ' O ' ' A' ' 204' ' ' THR . 4.8 mpt_? -46.13 -58.0 4.01 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.507 1.129 . . . . 74.319999999999993 110.264 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 209' ' ' ILE . . . . . 0.575 HG22 ' CD1' ' A' ' 210' ' ' PHE . 15.3 mt -54.57 -66.43 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 O-C-N 124.474 1.109 . . . . 65.040000000000006 109.26 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 210' ' ' PHE . . . . . 0.583 ' CD2' HG23 ' A' ' 206' ' ' VAL . 0.4 OUTLIER -90.06 65.95 6.64 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.493 1.121 . . . . 65.510000000000005 111.024 -179.986 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 211' ' ' GLN . . . . . 0.434 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.1 OUTLIER -110.31 146.35 35.88 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.595 1.184 . . . . 72.230000000000004 110.297 -179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 212' ' ' GLU . . . . . 0.458 ' O ' ' N ' ' A' ' 215' ' ' TYR . 22.8 tt0 -48.88 -55.48 11.6 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 124.441 1.088 . . . . 72.0 110.293 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.41 -24.09 1.14 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.48 1.112 . . . . 74.129999999999995 109.993 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.434 HG23 ' HG2' ' A' ' 211' ' ' GLN . 24.1 t -96.16 -28.46 3.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.559 1.162 . . . . 73.109999999999999 109.297 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 215' ' ' TYR . . . . . 0.458 ' N ' ' O ' ' A' ' 212' ' ' GLU . 12.8 t80 -64.92 -23.41 67.22 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.524 1.14 . . . . 72.209999999999994 111.006 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -66.19 0.58 Allowed 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.525 1.141 . . . . 52.240000000000002 109.264 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 217' ' ' THR . . . . . 0.992 HG22 HD11 ' A' ' 221' ' ' ILE . 25.7 m -41.1 -66.12 0.36 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.514 1.134 . . . . 51.43 110.372 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 218' ' ' GLN . . . . . 0.511 ' HA ' HD12 ' A' ' 221' ' ' ILE . 0.0 OUTLIER -39.66 -53.56 2.15 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.408 1.068 . . . . 61.5 110.292 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 11.8 tp60 -53.92 -53.8 47.63 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.496 1.123 . . . . 64.200000000000003 110.261 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 220' ' ' THR . . . . . 0.428 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 1.3 m -62.87 -19.21 63.92 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.498 1.124 . . . . 64.400000000000006 110.438 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 221' ' ' ILE . . . . . 0.992 HD11 HG22 ' A' ' 217' ' ' THR . 56.3 mt -83.62 -25.36 7.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.525 1.141 . . . . 73.310000000000002 109.328 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 222' ' ' TRP . . . . . 0.787 ' CD1' ' CE2' ' A' ' 167' ' ' TYR . 6.9 t90 -78.13 -43.36 29.06 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.54 1.15 . . . . 73.150000000000006 107.999 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 223' ' ' LYS . . . . . 0.428 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -68.39 -33.57 74.47 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.542 1.151 . . . . 70.019999999999996 109.313 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 224' ' ' GLU . . . . . 0.414 ' N ' ' HD3' ' A' ' 223' ' ' LYS . 1.8 mm-40 . . . . . 0 C--N 1.325 -0.47 0 O-C-N 124.538 1.149 . . . . 71.200000000000003 110.367 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.471 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 4.2 p . . . . . 0 N--CA 1.453 -0.277 0 N-CA-C 109.254 -0.647 . . . . 73.129999999999995 109.254 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.411 ' O ' ' C ' ' A' ' 79' ' ' LEU . 20.0 m-85 -88.39 26.88 1.34 Allowed 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.527 1.142 . . . . 74.310000000000002 110.989 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.618 HD23 ' OG ' ' A' ' 132' ' ' SER . 12.4 tp -39.65 152.05 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.497 1.123 . . . . 73.109999999999999 109.337 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.586 ' NZ ' HG23 ' A' ' 106' ' ' ILE . 1.4 ttpt -90.09 -60.4 1.94 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.553 1.158 . . . . 73.25 109.337 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.668 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.6 OUTLIER -161.28 131.61 5.05 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.515 1.134 . . . . 75.409999999999997 111.014 179.968 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.557 HG11 ' HA ' ' A' ' 128' ' ' ALA . 11.6 p -84.73 162.36 2.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 124.463 1.102 . . . . 65.209999999999994 109.29 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.668 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 4.9 mp -125.41 96.25 3.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.48 1.113 . . . . 71.040000000000006 109.274 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.436 ' O ' ' O ' ' A' ' 136' ' ' ILE . 6.8 mt -69.87 123.55 21.77 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.532 1.145 . . . . 74.430000000000007 109.292 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.743 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -146.15 174.46 11.29 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.513 1.133 . . . . 75.299999999999997 109.59 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.468 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -127.91 152.3 48.03 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.509 1.13 . . . . 74.140000000000001 109.366 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -46.31 -24.25 0.46 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.516 1.135 . . . . 75.349999999999994 110.305 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -63.45 -46.52 85.87 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.469 1.106 . . . . 73.209999999999994 109.267 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.424 ' OD1' ' N ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -134.91 44.81 2.59 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.435 1.085 . . . . 74.409999999999997 109.307 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.628 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -75.18 -26.58 59.15 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.567 1.167 . . . . 73.310000000000002 110.417 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -82.43 -21.44 35.71 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.576 1.172 . . . . 73.200000000000003 109.314 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.3 -54.89 6.13 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.597 1.185 . . . . 71.319999999999993 110.261 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.734 ' HB2' HD22 ' A' ' 138' ' ' LEU . . . -59.06 -30.48 68.09 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.495 1.122 . . . . 52.140000000000001 109.371 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.783 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -78.62 -51.6 9.65 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.481 1.113 . . . . 62.210000000000001 109.326 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.725 ' N ' HD13 ' A' ' 94' ' ' LEU . 2.2 tmt_? -41.19 -43.19 2.26 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.573 1.17 . . . . 74.549999999999997 110.264 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.55 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 0.3 OUTLIER -75.57 -52.96 16.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.479 1.112 . . . . 73.329999999999998 109.259 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.55 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -48.87 -20.89 0.55 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.436 1.085 . . . . 73.400000000000006 110.304 -179.988 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.41 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.1 OUTLIER -79.82 -41.2 26.89 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.555 1.16 . . . . 64.120000000000005 109.235 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.706 HD21 ' HZ ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -77.97 -22.09 49.96 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.44 1.088 . . . . 71.209999999999994 109.29 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.705 ' N ' HD23 ' A' ' 99' ' ' LEU . 36.8 mt -67.62 -44.72 77.35 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.513 1.133 . . . . 73.510000000000005 109.299 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -82.04 49.62 1.42 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.443 1.089 . . . . 65.120000000000005 110.237 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -174.44 -64.95 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.571 1.169 . . . . 74.140000000000001 109.294 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -41.56 -52.4 3.73 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.495 1.122 . . . . 70.129999999999995 109.241 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -111.03 -30.03 7.66 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.537 1.148 . . . . 71.409999999999997 110.995 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.464 ' O ' ' CD ' ' A' ' 107' ' ' LYS . . . 109.1 26.97 5.01 Favored Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.581 1.176 . . . . 55.420000000000002 110.979 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.586 HG23 ' NZ ' ' A' ' 80' ' ' LYS . 25.4 mm -70.82 95.42 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 O-C-N 124.473 0.749 . . . . 74.310000000000002 109.257 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.506 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -142.02 158.48 61.76 Favored Pre-proline 0 C--N 1.326 -0.451 0 O-C-N 124.487 1.117 . . . . 73.120000000000005 109.313 179.968 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.506 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.01 161.68 94.36 Favored 'Cis proline' 0 C--N 1.36 1.171 0 C-N-CA 121.009 -2.496 . . . . 73.530000000000001 111.011 0.057 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -117.29 112.12 2.41 Favored Glycine 0 CA--C 1.529 0.948 0 O-C-N 124.46 1.1 . . . . 73.230000000000004 111.009 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.402 HD11 ' C ' ' A' ' 114' ' ' GLU . 0.1 OUTLIER -135.84 128.81 47.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.44 0.729 . . . . 63.520000000000003 109.289 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ILE . . . . . 0.743 HD12 ' NE2' ' A' ' 85' ' ' HIS . 43.4 pt -91.44 -176.59 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.528 1.143 . . . . 63.509999999999998 109.306 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -81.67 -19.99 40.5 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.474 1.109 . . . . 52.100000000000001 110.942 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -90.49 -3.45 57.63 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.496 1.122 . . . . 75.140000000000001 109.289 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.402 ' C ' HD11 ' A' ' 110' ' ' ILE . 4.4 mm-40 -110.23 -26.58 9.55 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.577 1.173 . . . . 70.540000000000006 110.306 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 26.8 tpp -38.77 110.88 0.6 Allowed Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.512 1.132 . . . . 73.120000000000005 110.995 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 C--N 1.36 1.141 0 O-C-N 124.481 1.78 . . . . 63.520000000000003 110.951 -179.965 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.69 HD13 ' OH ' ' A' ' 154' ' ' TYR . 0.3 OUTLIER . . . . . 0 N--CA 1.454 -0.234 0 N-CA-C 109.287 -0.634 . . . . 74.439999999999998 109.287 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.4 ' C ' ' O ' ' A' ' 125' ' ' LEU . 0.7 OUTLIER -40.14 -30.02 0.09 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.557 1.161 . . . . 53.210000000000001 109.36 179.987 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.434 ' N ' ' C ' ' A' ' 125' ' ' LEU . 1.0 OUTLIER -57.78 -53.42 58.37 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.474 1.109 . . . . 71.510000000000005 109.316 179.919 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.557 ' HA ' HG11 ' A' ' 82' ' ' VAL . . . -67.21 -25.13 65.96 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.573 1.17 . . . . 72.109999999999999 109.298 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.609 ' O ' HG12 ' A' ' 129' ' ' VAL . 67.2 t -89.99 15.62 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.429 1.08 . . . . 73.319999999999993 109.263 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' ASN . . . . . 0.406 ' O ' ' C ' ' A' ' 131' ' ' GLY . 3.9 m-20 -129.85 165.79 21.3 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.519 1.137 . . . . 74.329999999999998 109.276 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' GLY . . . . . 0.406 ' C ' ' O ' ' A' ' 130' ' ' ASN . . . 37.15 54.43 1.56 Allowed Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.448 1.093 . . . . 65.400000000000006 111.027 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' SER . . . . . 0.618 ' OG ' HD23 ' A' ' 79' ' ' LEU . 7.8 m -163.33 174.23 12.26 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.484 0.755 . . . . 73.230000000000004 110.022 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.871 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -105.45 -28.12 11.03 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.537 1.148 . . . . 62.200000000000003 109.258 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.871 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.1 m-90 -161.95 178.71 8.64 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.974 -1.121 . . . . 74.129999999999995 107.974 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 135' ' ' THR . . . . . 0.47 ' OG1' ' HA ' ' A' ' 170' ' ' VAL . 74.8 p -147.64 135.46 21.1 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.464 1.103 . . . . 44.350000000000001 110.359 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.638 ' HB ' HG23 ' A' ' 83' ' ' ILE . 6.9 mm -84.18 97.76 5.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 124.49 1.119 . . . . 73.340000000000003 109.304 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.527 ' O ' HD13 ' A' ' 139' ' ' LEU . 3.0 mm? -77.89 87.41 4.09 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.499 1.125 . . . . 54.439999999999998 109.374 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.734 HD22 ' HB2' ' A' ' 93' ' ' ALA . 2.3 tp -62.07 103.12 0.34 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.514 1.134 . . . . 72.209999999999994 109.318 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.527 HD13 ' O ' ' A' ' 137' ' ' LEU . 0.0 OUTLIER -75.25 106.46 6.78 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.435 1.085 . . . . 74.299999999999997 109.328 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 140' ' ' THR . . . . . 0.503 ' O ' ' CB ' ' A' ' 144' ' ' LEU . 2.5 m -135.24 162.64 31.98 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.344 1.027 . . . . 62.119999999999997 110.459 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -63.44 -34.8 78.54 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.507 1.129 . . . . 73.329999999999998 110.227 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' ASN . . . . . 0.403 ' ND2' ' H ' ' A' ' 143' ' ' PHE . 2.2 p-10 -89.35 -53.34 4.59 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.569 1.168 . . . . 71.340000000000003 109.262 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.592 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 31.2 t80 -53.32 -36.88 61.75 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.528 1.143 . . . . 52.219999999999999 110.958 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.699 HD13 ' C ' ' A' ' 144' ' ' LEU . 2.1 tm? -60.81 -68.15 0.33 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.471 1.107 . . . . 73.120000000000005 109.293 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.517 ' N ' HD13 ' A' ' 144' ' ' LEU . 6.8 mmt85 -55.01 -18.97 5.84 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.461 1.101 . . . . 65.25 110.344 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -75.57 -73.12 0.27 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.504 1.128 . . . . 71.310000000000002 109.253 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.51 ' CG2' ' N ' ' A' ' 148' ' ' TRP . 1.2 t -65.79 -52.02 54.25 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.502 1.126 . . . . 72.120000000000005 110.317 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.585 ' HB2' HD22 ' A' ' 144' ' ' LEU . 22.7 t-105 -43.5 -50.99 6.95 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.578 1.174 . . . . 74.219999999999999 107.971 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 149' ' ' CYS . . . . . 0.404 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 4.6 t -47.31 -45.86 24.74 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.482 1.114 . . . . 75.150000000000006 108.329 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 150' ' ' ASN . . . . . 0.455 ' N ' ' O ' ' A' ' 147' ' ' THR . 23.3 m120 -64.36 -56.66 12.86 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.458 1.099 . . . . 72.099999999999994 109.316 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 1.004 ' CZ ' HD22 ' A' ' 157' ' ' LEU . 8.6 m-30 -42.93 -38.05 2.08 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.492 1.12 . . . . 73.109999999999999 111.005 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -61.29 -45.02 96.2 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.54 1.15 . . . . 72.140000000000001 110.261 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.433 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 1.7 t80 -56.6 -25.68 53.49 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.518 1.136 . . . . 73.420000000000002 110.986 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.69 ' OH ' HD13 ' A' ' 125' ' ' LEU . 20.3 p90 -163.61 125.43 2.43 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.45 1.094 . . . . 75.530000000000001 110.982 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.517 HG23 ' OD1' ' A' ' 159' ' ' ASN . 6.3 t -70.39 -6.07 32.88 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.505 1.128 . . . . 74.439999999999998 110.47 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 1.6 m -39.51 -63.65 0.55 Allowed 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.493 1.121 . . . . 55.310000000000002 109.948 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 1.004 HD22 ' CZ ' ' A' ' 151' ' ' PHE . 2.9 tt -64.89 -40.28 94.84 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.514 1.133 . . . . 74.439999999999998 109.281 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 158' ' ' MET . . . . . 0.567 ' CE ' HG21 ' A' ' 161' ' ' VAL . 3.4 tpt -58.76 -15.18 11.0 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.494 1.121 . . . . 73.420000000000002 111.027 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 159' ' ' ASN . . . . . 0.517 ' OD1' HG23 ' A' ' 155' ' ' THR . 37.7 m-20 -81.59 -44.89 16.63 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.44 1.087 . . . . 72.150000000000006 109.339 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.63 -20.63 61.26 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.466 1.104 . . . . 70.019999999999996 110.069 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 161' ' ' VAL . . . . . 0.812 ' O ' HD13 ' A' ' 192' ' ' ILE . 4.4 t -64.21 -18.01 22.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.571 1.17 . . . . 75.200000000000003 109.34 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -86.48 10.23 15.85 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.467 1.104 . . . . 73.299999999999997 109.3 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.61 ' CZ ' HG23 ' A' ' 192' ' ' ILE . 0.7 OUTLIER 53.29 63.63 2.15 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.54 1.15 . . . . 75.540000000000006 110.32 179.97 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 164' ' ' GLN . . . . . 0.414 ' NE2' ' HB3' ' A' ' 159' ' ' ASN . 19.7 mt-30 -62.35 -174.49 0.06 Allowed 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.552 1.157 . . . . 73.430000000000007 110.222 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -99.77 38.26 1.48 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.52 1.138 . . . . 72.239999999999995 109.567 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -100.9 162.26 13.03 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.586 1.178 . . . . 70.420000000000002 109.284 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 167' ' ' TYR . . . . . 0.527 ' CD1' ' C ' ' A' ' 167' ' ' TYR . 3.2 p90 -66.89 -9.09 34.29 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 124.402 1.064 . . . . 71.140000000000001 111.014 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 168' ' ' ASN . . . . . 0.438 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 0.1 OUTLIER -112.01 130.13 55.97 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.506 1.129 . . . . 75.349999999999994 109.32 -179.967 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.496 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 1.2 m -128.53 172.93 10.7 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.511 1.132 . . . . 74.219999999999999 109.997 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.503 ' O ' HD13 ' A' ' 171' ' ' ILE . 0.9 OUTLIER -151.95 119.87 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.412 1.07 . . . . 73.129999999999995 109.284 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.61 HG22 ' HB2' ' A' ' 195' ' ' LEU . 11.5 mm -111.29 121.0 41.57 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 124.576 1.173 . . . . 51.399999999999999 109.308 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 172' ' ' PRO . . . . . 0.723 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.92 106.9 2.36 Favored 'Trans proline' 0 C--N 1.36 1.139 0 O-C-N 124.479 1.779 . . . . 53.409999999999997 110.997 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 173' ' ' MET . . . . . 0.589 ' HE2' ' HG2' ' A' ' 197' ' ' GLU . 4.0 ttt -94.22 153.5 18.03 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.481 1.113 . . . . 74.030000000000001 110.989 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 174' ' ' ARG . . . . . 0.436 ' N ' ' HG2' ' A' ' 173' ' ' MET . 41.8 ttm-85 -114.39 126.28 28.17 Favored Pre-proline 0 C--N 1.326 -0.448 0 O-C-N 124.477 1.11 . . . . 75.150000000000006 110.345 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 175' ' ' PRO . . . . . 0.446 ' C ' HD23 ' A' ' 176' ' ' LEU . 18.3 Cg_endo -75.0 157.49 42.74 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.443 1.76 . . . . 73.239999999999995 111.034 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 176' ' ' LEU . . . . . 0.944 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.2 OUTLIER -99.58 -50.85 3.93 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.459 1.099 . . . . 62.219999999999999 109.289 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -71.74 -22.13 61.66 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.465 1.103 . . . . 72.120000000000005 109.321 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 178' ' ' ASN . . . . . 0.453 ' ND2' HG23 ' A' ' 140' ' ' THR . 0.5 OUTLIER -107.67 107.79 60.77 Favored Pre-proline 0 C--N 1.325 -0.484 0 O-C-N 124.474 1.109 . . . . 64.030000000000001 109.335 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.96 127.54 10.79 Favored 'Trans proline' 0 C--N 1.36 1.158 0 O-C-N 124.543 1.812 . . . . 64.140000000000001 111.047 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.609 HD13 ' HB2' ' A' ' 184' ' ' ARG . 0.4 OUTLIER -141.27 96.66 7.05 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.524 1.14 . . . . 73.230000000000004 109.274 179.976 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.02 168.96 23.66 Favored 'Trans proline' 0 C--N 1.36 1.166 0 O-C-N 124.495 1.787 . . . . 55.340000000000003 111.021 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 182' ' ' ARG . . . . . 0.424 ' CB ' ' OE1' ' A' ' 190' ' ' GLN . 0.2 OUTLIER -58.45 -28.42 65.28 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.511 1.132 . . . . 73.450000000000003 110.327 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -62.85 -12.74 26.79 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.425 1.078 . . . . 72.450000000000003 110.339 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 184' ' ' ARG . . . . . 0.609 ' HB2' HD13 ' A' ' 180' ' ' LEU . 39.4 mmt180 -112.87 -28.26 7.81 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.467 1.104 . . . . 75.239999999999995 110.255 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 185' ' ' THR . . . . . 0.561 HG23 ' HD2' ' A' ' 186' ' ' PRO . 31.3 m -80.0 144.13 58.64 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.417 1.073 . . . . 73.129999999999995 110.342 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 186' ' ' PRO . . . . . 0.715 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.2 Cg_endo -74.98 147.45 34.01 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.59 1.837 . . . . 74.430000000000007 110.995 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 187' ' ' PHE . . . . . 0.506 ' O ' HG23 ' A' ' 191' ' ' THR . 4.4 p90 -63.21 -11.34 20.28 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.489 1.118 . . . . 74.0 111.039 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 188' ' ' ALA . . . . . 0.675 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -87.96 -54.12 4.39 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.545 1.153 . . . . 73.099999999999994 109.298 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.746 HD23 HG13 ' A' ' 161' ' ' VAL . 24.8 mt -72.61 -19.41 61.47 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.525 1.141 . . . . 70.409999999999997 109.333 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 190' ' ' GLN . . . . . 0.484 ' O ' ' CG ' ' A' ' 190' ' ' GLN . 7.4 tt0 -86.54 -0.52 56.28 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.596 1.185 . . . . 62.299999999999997 110.295 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 191' ' ' THR . . . . . 0.506 HG23 ' O ' ' A' ' 187' ' ' PHE . 69.1 p -130.21 18.59 5.43 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.453 1.095 . . . . 75.0 110.39 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.812 HD13 ' O ' ' A' ' 161' ' ' VAL . 3.1 mt -127.79 154.63 38.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.483 1.114 . . . . 73.099999999999994 109.269 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 193' ' ' ASN . . . . . 0.455 ' ND2' HD11 ' A' ' 209' ' ' ILE . 29.8 t30 -51.52 92.38 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.433 1.083 . . . . 71.319999999999993 109.266 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 194' ' ' ALA . . . . . 0.723 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -90.79 143.54 26.62 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.546 1.153 . . . . 54.229999999999997 109.343 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 195' ' ' LEU . . . . . 0.61 ' HB2' HG22 ' A' ' 171' ' ' ILE . 0.2 OUTLIER -76.56 150.0 36.57 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 65.299999999999997 109.331 -179.971 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 196' ' ' GLU . . . . . 0.454 ' H ' HD13 ' A' ' 195' ' ' LEU . 64.1 mt-10 -143.42 132.98 23.58 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.499 1.124 . . . . 65.319999999999993 110.271 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.944 ' HG3' HD21 ' A' ' 176' ' ' LEU . 0.6 OUTLIER -113.86 -16.81 12.17 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 124.487 1.117 . . . . 62.299999999999997 110.248 -179.998 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 198' ' ' GLU . . . . . 0.834 ' HB3' HD22 ' A' ' 176' ' ' LEU . 0.3 OUTLIER -95.71 5.07 52.3 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.436 1.085 . . . . 73.099999999999994 110.266 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.92 172.91 6.93 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.523 1.139 . . . . 72.109999999999999 110.034 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -85.4 -18.39 33.82 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.468 1.105 . . . . 51.439999999999998 110.279 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -104.42 24.05 29.94 Favored Glycine 0 CA--C 1.53 1.024 0 O-C-N 124.464 1.102 . . . . 63.409999999999997 111.088 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 202' ' ' PHE . . . . . 0.849 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.2 OUTLIER -59.2 -43.01 96.26 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.521 0.777 . . . . 71.510000000000005 110.987 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 203' ' ' PRO . . . . . 0.623 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.2 Cg_endo -75.04 -35.55 3.04 Favored 'Trans proline' 0 C--N 1.36 1.158 0 O-C-N 124.566 1.824 . . . . 71.510000000000005 111.018 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.92 -57.03 12.48 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.527 1.142 . . . . 71.439999999999998 110.433 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 205' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' A' ' 209' ' ' ILE . 3.0 mt-30 -61.92 -48.73 79.15 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.543 1.152 . . . . 73.310000000000002 110.357 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 206' ' ' VAL . . . . . 0.849 HG23 ' O ' ' A' ' 202' ' ' PHE . 92.7 t -57.25 -29.97 33.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 124.473 1.108 . . . . 65.120000000000005 109.284 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -79.42 -41.12 28.37 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.457 1.098 . . . . 74.439999999999998 110.266 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -75.45 -68.09 0.6 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.514 1.134 . . . . 71.140000000000001 110.311 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 209' ' ' ILE . . . . . 0.752 HG22 ' CD1' ' A' ' 210' ' ' PHE . 98.0 mt -40.42 -48.03 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.447 1.092 . . . . 74.109999999999999 109.261 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 210' ' ' PHE . . . . . 0.752 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.9 m-85 -105.71 75.7 1.15 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.492 1.12 . . . . 65.120000000000005 110.981 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 211' ' ' GLN . . . . . 0.486 ' CG ' ' HB ' ' A' ' 214' ' ' VAL . 10.3 pt20 -111.32 141.7 44.52 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.512 1.132 . . . . 70.230000000000004 110.277 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 212' ' ' GLU . . . . . 0.565 ' HA ' ' CD2' ' A' ' 215' ' ' TYR . 16.1 tt0 -53.08 -48.38 67.79 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.448 1.093 . . . . 62.25 110.265 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.4 t -52.58 -18.61 1.82 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.421 1.076 . . . . 64.239999999999995 109.969 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.486 ' HB ' ' CG ' ' A' ' 211' ' ' GLN . 2.3 t -97.66 -44.52 12.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 124.534 1.146 . . . . 74.439999999999998 109.276 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 215' ' ' TYR . . . . . 0.565 ' CD2' ' HA ' ' A' ' 212' ' ' GLU . 9.5 m-30 -37.39 -32.36 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.452 1.095 . . . . 75.299999999999997 110.964 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 216' ' ' LYS . . . . . 0.513 ' N ' ' CD ' ' A' ' 216' ' ' LYS . 5.6 mmtt -68.51 -54.59 15.87 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.482 1.113 . . . . 73.450000000000003 109.324 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 217' ' ' THR . . . . . 0.446 ' N ' ' O ' ' A' ' 214' ' ' VAL . 1.5 m -40.24 -66.41 0.31 Allowed 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.559 1.162 . . . . 70.209999999999994 110.46 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 218' ' ' GLN . . . . . 0.582 ' HA ' HD12 ' A' ' 221' ' ' ILE . 2.8 mp0 -46.76 -59.94 2.72 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.492 1.12 . . . . 74.200000000000003 110.272 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 219' ' ' GLN . . . . . 0.471 ' O ' ' N ' ' A' ' 223' ' ' LYS . 5.3 tp-100 -41.34 -61.12 1.09 Allowed 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.556 1.16 . . . . 74.239999999999995 110.357 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.1 m -46.22 -45.94 17.32 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.528 1.142 . . . . 72.25 110.369 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 221' ' ' ILE . . . . . 0.582 HD12 ' HA ' ' A' ' 218' ' ' GLN . 6.5 mt -66.95 -29.59 46.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.46 1.1 . . . . 74.540000000000006 109.334 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 222' ' ' TRP . . . . . 0.471 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 14.3 t90 -81.63 -19.44 41.78 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.574 1.171 . . . . 74.340000000000003 108.07 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 223' ' ' LYS . . . . . 0.471 ' N ' ' O ' ' A' ' 219' ' ' GLN . 0.0 OUTLIER -91.86 -20.06 21.85 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.486 1.116 . . . . 63.329999999999998 109.386 179.93 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 . . . . . 0 C--N 1.325 -0.482 0 O-C-N 124.526 1.141 . . . . 72.230000000000004 110.276 -179.959 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.468 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 6.3 p . . . . . 0 N--CA 1.453 -0.314 0 N-CA-C 109.32 -0.622 . . . . 71.129999999999995 109.32 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.558 ' CG ' ' O ' ' A' ' 78' ' ' PHE . 28.7 t80 -86.63 22.02 2.02 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.492 1.12 . . . . 73.430000000000007 110.937 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.406 ' C ' ' O ' ' A' ' 78' ' ' PHE . 6.6 tp -39.91 151.55 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.519 1.137 . . . . 74.239999999999995 109.198 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.433 ' HD3' HG23 ' A' ' 106' ' ' ILE . 8.3 ttmt -91.04 -60.65 1.85 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.535 1.147 . . . . 75.010000000000005 109.307 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.676 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.3 OUTLIER -161.44 136.46 7.42 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.424 1.078 . . . . 70.310000000000002 110.974 179.966 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.551 HG11 ' HA ' ' A' ' 128' ' ' ALA . 4.0 p -89.36 167.71 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 O-C-N 124.515 1.135 . . . . 70.420000000000002 109.35 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.792 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.2 mp -131.35 96.76 2.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.466 1.104 . . . . 62.039999999999999 109.308 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.437 ' HG ' ' CB ' ' A' ' 128' ' ' ALA . 3.1 mt -72.92 118.9 16.43 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.505 1.128 . . . . 70.120000000000005 109.296 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.742 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -141.18 174.46 10.51 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.425 1.078 . . . . 62.039999999999999 109.529 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.612 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -105.14 156.46 18.07 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.493 1.12 . . . . 71.510000000000005 109.254 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.71 -14.54 21.62 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.517 1.135 . . . . 75.530000000000001 110.317 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -84.52 -46.3 11.74 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.499 1.124 . . . . 75.450000000000003 109.316 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.728 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.5 OUTLIER -112.1 43.72 1.54 Allowed 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.519 1.137 . . . . 74.219999999999999 109.311 179.976 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.601 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -80.09 -22.25 42.41 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.55 1.156 . . . . 72.129999999999995 110.418 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -83.36 -27.21 29.83 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.425 1.078 . . . . 70.299999999999997 109.241 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -70.78 -55.56 8.3 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.529 1.143 . . . . 74.219999999999999 110.363 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.742 ' HB3' ' HD2' ' A' ' 85' ' ' HIS . . . -58.79 -34.74 71.82 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.483 1.114 . . . . 75.409999999999997 109.261 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.983 ' HB2' HD13 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -73.57 -41.6 62.69 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.532 1.145 . . . . 73.120000000000005 109.315 -179.994 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.644 ' N ' HD13 ' A' ' 94' ' ' LEU . 27.0 tpt180 -51.03 -31.17 17.54 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.479 1.112 . . . . 50.039999999999999 110.314 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.813 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.0 t -82.88 -63.69 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.437 1.085 . . . . 65.349999999999994 109.221 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.584 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -41.49 -26.27 0.06 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.473 1.108 . . . . 71.430000000000007 110.34 -180.0 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.447 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.5 t-20 -71.68 -49.69 37.4 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.496 1.123 . . . . 63.340000000000003 109.347 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.845 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -73.79 -22.88 59.67 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.463 1.102 . . . . 73.219999999999999 109.267 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.845 ' N ' HD23 ' A' ' 99' ' ' LEU . 37.2 mt -63.27 -55.26 26.25 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.528 1.143 . . . . 75.129999999999995 109.291 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.67 59.35 1.16 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.459 1.099 . . . . 71.150000000000006 110.224 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.4 t70 175.87 -65.99 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.552 1.158 . . . . 60.43 109.254 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -42.77 -55.07 3.8 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.434 1.084 . . . . 60.030000000000001 109.25 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.592 ' CZ ' HG11 ' A' ' 206' ' ' VAL . 1.9 m-85 -111.92 -20.22 12.09 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.488 1.118 . . . . 71.140000000000001 110.976 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.54 45.92 3.6 Favored Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.512 1.133 . . . . 64.230000000000004 110.997 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.433 HG23 ' HD3' ' A' ' 80' ' ' LYS . 7.2 mm -88.0 90.45 3.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.517 0.775 . . . . 74.150000000000006 109.279 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.517 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -137.7 158.24 72.06 Favored Pre-proline 0 C--N 1.324 -0.507 0 O-C-N 124.496 1.122 . . . . 74.329999999999998 109.29 -179.969 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.517 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -74.96 150.3 95.24 Favored 'Cis proline' 0 C--N 1.36 1.14 0 C-N-CA 121.0 -2.5 . . . . 71.409999999999997 110.983 -0.046 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -119.69 132.38 9.44 Favored Glycine 0 CA--C 1.531 1.061 0 O-C-N 124.491 1.12 . . . . 74.519999999999996 110.885 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.453 ' CD1' ' HA ' ' A' ' 115' ' ' MET . 0.4 OUTLIER -151.41 144.09 16.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.581 0.812 . . . . 71.230000000000004 109.255 179.95 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ILE . . . . . 0.983 HD13 ' HB2' ' A' ' 94' ' ' LEU . 38.6 pt -97.17 177.02 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 O-C-N 124.528 1.143 . . . . 74.329999999999998 109.273 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.459 ' CD1' ' SD ' ' A' ' 115' ' ' MET . 1.8 t80 -76.13 -18.7 59.03 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.555 1.159 . . . . 75.310000000000002 110.975 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -95.97 -2.32 47.26 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.556 1.16 . . . . 63.210000000000001 109.303 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.427 ' HB2' ' CG1' ' A' ' 111' ' ' ILE . 5.5 mt-10 -111.35 -26.56 9.06 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.458 1.099 . . . . 65.310000000000002 110.234 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.459 ' SD ' ' CD1' ' A' ' 112' ' ' PHE . 1.2 ptp -70.88 134.89 85.6 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.532 1.145 . . . . 75.129999999999995 110.977 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo . . . . . 0 C--N 1.36 1.149 0 O-C-N 124.498 1.788 . . . . 72.150000000000006 111.034 179.919 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.685 HD11 ' HE1' ' A' ' 151' ' ' PHE . 0.9 OUTLIER . . . . . 0 N--CA 1.453 -0.28 0 N-CA-C 109.363 -0.606 . . . . 55.25 109.363 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.404 ' O ' ' N ' ' A' ' 129' ' ' VAL . 0.7 OUTLIER -41.23 -30.01 0.15 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.502 1.126 . . . . 74.409999999999997 109.345 179.928 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.414 ' N ' ' C ' ' A' ' 125' ' ' LEU . 3.8 t0 -44.35 -51.66 8.32 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.484 1.115 . . . . 55.109999999999999 109.266 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.551 ' HA ' HG11 ' A' ' 82' ' ' VAL . . . -66.12 -34.42 78.01 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.514 1.134 . . . . 75.030000000000001 109.288 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.745 ' O ' HG12 ' A' ' 129' ' ' VAL . 70.2 t -92.99 30.64 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.501 1.126 . . . . 71.299999999999997 109.382 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -131.75 130.47 41.93 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.479 1.112 . . . . 73.099999999999994 109.36 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 48.5 72.62 0.43 Allowed Glycine 0 CA--C 1.531 1.063 0 O-C-N 124.488 1.118 . . . . 43.530000000000001 110.985 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.3 m -160.71 167.82 26.11 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.578 0.811 . . . . 74.530000000000001 110.047 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.809 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -100.07 -33.89 10.29 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.428 1.08 . . . . 61.130000000000003 109.317 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.809 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.0 OUTLIER -161.87 151.74 16.66 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.608 1.192 . . . . 71.439999999999998 107.965 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 47.2 p -120.22 145.37 47.08 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.466 1.104 . . . . 73.25 110.419 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.831 ' O ' HD13 ' A' ' 137' ' ' LEU . 20.6 mm -99.25 131.01 47.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.495 1.122 . . . . 62.539999999999999 109.351 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.831 HD13 ' O ' ' A' ' 136' ' ' ILE . 0.4 OUTLIER -124.74 99.65 6.26 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.493 1.121 . . . . 64.319999999999993 109.328 -179.973 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.728 HD23 ' HB2' ' A' ' 89' ' ' ASP . 0.1 OUTLIER -62.22 90.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.425 1.078 . . . . 73.140000000000001 109.243 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.53 HD11 HD13 ' A' ' 189' ' ' LEU . 0.9 OUTLIER -60.34 103.01 0.2 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.527 1.142 . . . . 71.549999999999997 109.312 179.976 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 140' ' ' THR . . . . . 0.604 HG22 ' H ' ' A' ' 141' ' ' GLU . 6.7 m -130.49 179.95 5.63 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.426 1.079 . . . . 52.009999999999998 110.427 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 141' ' ' GLU . . . . . 0.604 ' H ' HG22 ' A' ' 140' ' ' THR . 33.9 mt-10 -75.54 -39.55 58.11 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.466 1.104 . . . . 75.230000000000004 110.313 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -89.46 -50.85 5.86 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.556 1.16 . . . . 73.200000000000003 109.352 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.612 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 52.9 t80 -50.26 -21.24 1.29 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 71.239999999999995 110.94 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.706 HD13 ' C ' ' A' ' 144' ' ' LEU . 1.8 tm? -64.45 -67.84 0.4 Allowed 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.53 1.143 . . . . 71.140000000000001 109.253 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.619 ' N ' HD13 ' A' ' 144' ' ' LEU . 0.0 OUTLIER -60.18 -15.29 22.81 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.521 1.138 . . . . 74.340000000000003 110.247 -179.957 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -67.5 -64.57 0.83 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.467 1.104 . . . . 72.099999999999994 109.277 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.515 HG23 ' CE2' ' A' ' 151' ' ' PHE . 1.0 OUTLIER -85.43 -48.18 9.25 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.502 1.126 . . . . 34.420000000000002 110.41 179.961 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.622 ' HB2' HD22 ' A' ' 144' ' ' LEU . 26.0 t-105 -42.51 -48.34 5.26 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.577 1.173 . . . . 65.310000000000002 108.022 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 149' ' ' CYS . . . . . 0.445 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 27.0 t -65.14 -44.98 86.87 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.495 1.122 . . . . 53.409999999999997 108.242 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 150' ' ' ASN . . . . . 0.624 ' OD1' HD22 ' A' ' 125' ' ' LEU . 6.1 t-20 -48.13 -41.28 26.12 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.589 1.18 . . . . 75.329999999999998 109.331 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.685 ' HE1' HD11 ' A' ' 125' ' ' LEU . 14.4 m-30 -66.99 -35.85 80.86 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.482 1.114 . . . . 64.299999999999997 111.01 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -49.25 -46.44 46.13 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.486 1.116 . . . . 61.329999999999998 110.332 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -85.33 -15.19 44.09 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.532 1.145 . . . . 61.310000000000002 111.04 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -132.9 85.66 2.24 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.501 1.125 . . . . 74.310000000000002 111.036 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.58 -14.25 40.47 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 124.526 1.141 . . . . 75.239999999999995 110.402 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 23.2 m -53.68 -22.89 9.84 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.471 1.107 . . . . 61.100000000000001 109.978 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.562 HD12 ' CE1' ' A' ' 151' ' ' PHE . 0.6 OUTLIER -82.89 -45.89 13.66 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.467 1.105 . . . . 72.409999999999997 109.251 -179.95 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 158' ' ' MET . . . . . 0.544 ' CE ' HG21 ' A' ' 161' ' ' VAL . 26.6 mmt -42.34 -32.74 0.55 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.507 1.129 . . . . 71.510000000000005 111.026 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -65.27 -49.77 68.29 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.524 1.14 . . . . 73.209999999999994 109.313 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 160' ' ' SER . . . . . 0.718 ' HB2' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -68.66 -29.04 67.43 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.527 1.142 . . . . 61.450000000000003 109.994 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 161' ' ' VAL . . . . . 0.544 HG21 ' CE ' ' A' ' 158' ' ' MET . 6.2 t -55.06 -19.49 4.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.543 1.152 . . . . 71.209999999999994 109.344 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 162' ' ' ASN . . . . . 0.468 ' O ' ' N ' ' A' ' 164' ' ' GLN . 6.6 t-20 -91.05 20.84 4.62 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.539 1.149 . . . . 74.450000000000003 109.321 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.43 ' C ' ' O ' ' A' ' 162' ' ' ASN . 0.5 OUTLIER 35.6 33.55 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.514 1.133 . . . . 75.530000000000001 110.297 -179.956 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 164' ' ' GLN . . . . . 0.468 ' N ' ' O ' ' A' ' 162' ' ' ASN . 2.6 mt-30 -48.22 176.74 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.49 1.118 . . . . 54.210000000000001 110.291 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 4.8 p-80 -93.42 71.96 4.41 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.425 1.078 . . . . 62.140000000000001 109.586 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.554 ' HG3' ' CD2' ' A' ' 167' ' ' TYR . 2.2 tppt? -123.13 157.12 33.61 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.551 1.157 . . . . 72.439999999999998 109.306 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 167' ' ' TYR . . . . . 0.723 ' CE1' ' ND2' ' A' ' 168' ' ' ASN . 45.0 p90 -38.75 -45.94 1.19 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.501 1.126 . . . . 74.420000000000002 110.99 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 168' ' ' ASN . . . . . 0.723 ' ND2' ' CE1' ' A' ' 167' ' ' TYR . 10.4 p30 -99.34 129.92 45.59 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.482 1.114 . . . . 75.319999999999993 109.237 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.483 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 14.0 m -110.73 158.35 18.75 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.457 1.098 . . . . 61.439999999999998 109.968 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.718 HG21 ' HB2' ' A' ' 160' ' ' SER . 42.9 t -116.56 111.35 34.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.481 1.113 . . . . 63.329999999999998 109.323 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.502 HG22 ' HB2' ' A' ' 195' ' ' LEU . 21.9 mm -122.86 93.75 48.06 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.514 1.134 . . . . 60.210000000000001 109.325 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 172' ' ' PRO . . . . . 0.953 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 17.9 Cg_endo -75.01 107.65 2.53 Favored 'Trans proline' 0 C--N 1.36 1.142 0 O-C-N 124.566 1.824 . . . . 72.310000000000002 110.976 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 173' ' ' MET . . . . . 0.813 ' HE1' HG21 ' A' ' 96' ' ' VAL . 4.1 ttt -83.65 152.8 24.59 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.475 1.109 . . . . 65.540000000000006 110.996 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 174' ' ' ARG . . . . . 0.414 ' N ' ' HG2' ' A' ' 173' ' ' MET . 25.5 mmm-85 -110.88 118.21 48.77 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.453 1.096 . . . . 71.340000000000003 110.32 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 175' ' ' PRO . . . . . 0.644 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -75.0 154.96 42.86 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.508 1.794 . . . . 71.349999999999994 111.012 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 176' ' ' LEU . . . . . 0.866 HD21 ' CG ' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -95.58 -38.09 10.56 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 124.53 1.144 . . . . 70.430000000000007 109.372 179.951 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -72.8 -22.38 60.83 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.461 1.101 . . . . 75.109999999999999 109.35 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -110.42 108.35 58.44 Favored Pre-proline 0 C--N 1.326 -0.441 0 O-C-N 124.44 1.087 . . . . 51.210000000000001 109.275 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.96 124.06 8.37 Favored 'Trans proline' 0 C--N 1.36 1.149 0 O-C-N 124.5 1.789 . . . . 74.340000000000003 110.987 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -139.94 96.98 8.09 Favored Pre-proline 0 C--N 1.324 -0.525 0 O-C-N 124.49 1.119 . . . . 72.450000000000003 109.354 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.02 155.43 42.82 Favored 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.474 1.776 . . . . 75.340000000000003 111.012 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.2 -28.3 39.9 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 124.541 1.151 . . . . 71.230000000000004 110.232 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -53.55 -29.33 36.5 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.496 1.122 . . . . 74.319999999999993 110.346 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 27.4 mmt180 -99.42 -16.72 18.28 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.492 1.12 . . . . 64.230000000000004 110.282 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 185' ' ' THR . . . . . 0.485 HG22 ' HD2' ' A' ' 186' ' ' PRO . 20.8 m -80.08 144.02 58.12 Favored Pre-proline 0 C--N 1.325 -0.458 0 O-C-N 124.534 1.146 . . . . 72.200000000000003 110.382 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 186' ' ' PRO . . . . . 0.788 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -74.96 155.58 43.12 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.466 1.771 . . . . 75.439999999999998 110.974 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 187' ' ' PHE . . . . . 0.509 ' O ' ' CG2' ' A' ' 191' ' ' THR . 7.7 p90 -69.44 -7.09 34.71 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.462 1.101 . . . . 72.439999999999998 110.972 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 188' ' ' ALA . . . . . 0.453 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -94.08 -52.88 4.19 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.484 1.115 . . . . 73.430000000000007 109.314 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.788 HD12 ' CG ' ' A' ' 186' ' ' PRO . 48.3 mt -68.48 -42.28 78.93 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.494 1.121 . . . . 72.329999999999998 109.365 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 190' ' ' GLN . . . . . 0.411 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 6.7 pt20 -64.04 -10.46 22.15 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 124.45 1.094 . . . . 72.329999999999998 110.306 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 191' ' ' THR . . . . . 0.509 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 33.5 p -113.4 17.74 18.24 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 124.525 1.141 . . . . 72.299999999999997 110.396 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.476 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 4.8 mt -117.57 157.87 18.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.54 1.15 . . . . 52.310000000000002 109.334 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 193' ' ' ASN . . . . . 0.407 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 9.8 t-20 -78.58 70.33 4.91 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.551 1.157 . . . . 63.32 109.305 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 194' ' ' ALA . . . . . 0.953 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -61.76 178.21 0.35 Allowed 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.494 1.121 . . . . 72.299999999999997 109.267 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 195' ' ' LEU . . . . . 0.642 HD23 HD12 ' A' ' 209' ' ' ILE . 0.8 OUTLIER -105.88 122.99 47.25 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.465 1.103 . . . . 74.299999999999997 109.314 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -102.27 141.82 34.5 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.423 1.077 . . . . 74.230000000000004 110.332 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.866 ' CG ' HD21 ' A' ' 176' ' ' LEU . 15.5 tp10 -111.67 -22.27 11.27 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.488 1.118 . . . . 63.130000000000003 110.292 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 198' ' ' GLU . . . . . 0.403 ' HB3' HD12 ' A' ' 176' ' ' LEU . 2.4 pp20? -106.2 11.24 31.45 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.548 1.155 . . . . 74.439999999999998 110.268 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 32.8 t -94.68 171.5 8.75 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.523 1.139 . . . . 41.130000000000003 110.028 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -77.74 -42.16 35.2 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.511 1.132 . . . . 65.540000000000006 110.34 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -90.33 16.74 56.81 Favored Glycine 0 CA--C 1.53 1.009 0 O-C-N 124.442 1.089 . . . . 63.340000000000003 111.018 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 202' ' ' PHE . . . . . 0.619 ' C ' ' CD1' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -48.75 -47.58 71.89 Favored Pre-proline 0 C--N 1.326 -0.454 0 O-C-N 124.532 0.784 . . . . 61.240000000000002 111.013 -179.991 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 203' ' ' PRO . . . . . 0.642 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.0 Cg_endo -75.04 -28.11 9.38 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.533 1.807 . . . . 74.230000000000004 110.969 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.88 -48.01 80.85 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.412 1.07 . . . . 74.150000000000006 110.439 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 205' ' ' GLN . . . . . 0.473 ' HB2' ' CD2' ' A' ' 195' ' ' LEU . 9.3 mt-30 -60.89 -61.91 2.24 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.477 1.111 . . . . 72.430000000000007 110.299 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 206' ' ' VAL . . . . . 0.693 HG21 ' CD2' ' A' ' 100' ' ' LEU . 2.7 p -39.58 -34.05 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 124.547 1.154 . . . . 74.450000000000003 109.298 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 207' ' ' GLU . . . . . 0.404 ' N ' ' C ' ' A' ' 205' ' ' GLN . 3.2 mm-40 -75.06 -65.06 0.92 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.486 1.116 . . . . 75.140000000000001 110.265 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -49.62 -59.58 3.65 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.567 1.167 . . . . 74.239999999999995 110.337 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 209' ' ' ILE . . . . . 0.731 HG22 ' CD1' ' A' ' 210' ' ' PHE . 64.5 mt -50.04 -68.82 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.436 1.085 . . . . 53.149999999999999 109.335 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 210' ' ' PHE . . . . . 0.731 ' CD1' HG22 ' A' ' 209' ' ' ILE . 0.4 OUTLIER -89.42 66.92 7.57 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.491 1.12 . . . . 73.200000000000003 110.999 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 211' ' ' GLN . . . . . 0.532 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.2 OUTLIER -110.48 148.19 32.58 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.539 1.149 . . . . 61.210000000000001 110.261 -179.992 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 212' ' ' GLU . . . . . 0.426 ' O ' ' HB3' ' A' ' 215' ' ' TYR . 5.8 tt0 -53.75 -52.38 60.38 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.566 1.166 . . . . 72.420000000000002 110.285 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 213' ' ' SER . . . . . 0.405 ' N ' ' HG3' ' A' ' 211' ' ' GLN . 0.6 OUTLIER -50.42 -21.3 1.39 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.449 1.093 . . . . 74.430000000000007 109.97 -179.993 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.532 HG23 ' HG2' ' A' ' 211' ' ' GLN . 21.7 t -95.21 -37.5 7.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.533 1.145 . . . . 74.430000000000007 109.339 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 215' ' ' TYR . . . . . 0.469 ' HH ' ' HZ ' ' A' ' 78' ' ' PHE . 5.1 t80 -51.7 -47.55 63.87 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.43 1.081 . . . . 74.329999999999998 110.967 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 2.8 mtmt -43.17 -55.28 4.01 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.467 1.104 . . . . 65.230000000000004 109.259 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 217' ' ' THR . . . . . 1.09 HG22 HD11 ' A' ' 221' ' ' ILE . 33.9 m -56.11 -66.43 0.43 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.435 1.085 . . . . 73.150000000000006 110.392 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 218' ' ' GLN . . . . . 0.448 ' HA ' HD12 ' A' ' 221' ' ' ILE . 41.5 mm-40 -47.99 -23.53 0.82 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.438 1.086 . . . . 74.439999999999998 110.278 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 219' ' ' GLN . . . . . 0.443 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 19.9 tp60 -82.36 -37.76 25.19 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.51 1.131 . . . . 73.200000000000003 110.312 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 220' ' ' THR . . . . . 0.418 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 1.2 m -78.57 -21.42 48.67 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.493 1.121 . . . . 65.230000000000004 110.343 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 221' ' ' ILE . . . . . 1.09 HD11 HG22 ' A' ' 217' ' ' THR . 12.7 mt -83.81 -37.17 12.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.477 1.111 . . . . 75.150000000000006 109.346 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 222' ' ' TRP . . . . . 0.468 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 27.3 t90 -66.84 -44.44 81.06 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.548 1.155 . . . . 71.239999999999995 107.963 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 223' ' ' LYS . . . . . 0.418 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -68.13 -23.01 64.84 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.516 1.135 . . . . 63.100000000000001 109.283 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 . . . . . 0 C--N 1.326 -0.422 0 O-C-N 124.399 1.062 . . . . 73.219999999999999 110.359 179.93 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.591 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 9.0 p . . . . . 0 N--CA 1.453 -0.295 0 N-CA-C 109.333 -0.617 . . . . 74.310000000000002 109.333 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.477 ' CE2' ' OH ' ' A' ' 215' ' ' TYR . 3.3 t80 -87.48 20.73 2.76 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.463 1.102 . . . . 73.329999999999998 111.038 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.407 ' C ' ' O ' ' A' ' 78' ' ' PHE . 6.3 tp -39.31 156.84 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.416 1.072 . . . . 74.409999999999997 109.286 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 1.099 ' NZ ' HG22 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -104.47 -57.28 2.05 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.516 1.135 . . . . 64.340000000000003 109.293 -179.973 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.807 ' CE1' HD11 ' A' ' 83' ' ' ILE . 0.1 OUTLIER -161.92 150.7 15.45 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.559 1.162 . . . . 55.030000000000001 110.945 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.417 ' CG1' HG22 ' A' ' 135' ' ' THR . 3.9 p -103.13 159.48 4.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.484 1.115 . . . . 75.329999999999998 109.331 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.832 HG23 ' HB ' ' A' ' 136' ' ' ILE . 4.2 mp -122.36 88.29 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.439 1.087 . . . . 65.109999999999999 109.336 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.055 HD11 ' HB1' ' A' ' 128' ' ' ALA . 5.1 mp -70.01 114.88 8.6 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.452 1.095 . . . . 64.010000000000005 109.245 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.726 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -131.52 174.79 9.74 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.466 1.104 . . . . 74.120000000000005 109.529 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -111.21 157.3 20.25 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.489 1.118 . . . . 75.329999999999998 109.322 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.17 -11.27 19.41 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.426 1.079 . . . . 64.540000000000006 110.225 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -84.25 -40.28 18.23 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.556 1.16 . . . . 64.430000000000007 109.288 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.704 ' HB2' HD12 ' A' ' 138' ' ' LEU . 1.3 p30 -127.25 41.0 3.6 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.409 1.068 . . . . 73.549999999999997 109.303 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.613 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -74.28 -53.61 9.37 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.578 1.174 . . . . 45.130000000000003 110.36 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.18 -17.85 21.68 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.476 1.11 . . . . 72.340000000000003 109.252 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -78.84 -55.84 4.85 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.521 1.138 . . . . 75.310000000000002 110.247 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 1.011 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -65.15 -20.24 66.36 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.597 1.185 . . . . 54.149999999999999 109.29 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.623 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -86.13 -52.9 5.38 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.482 1.114 . . . . 73.129999999999995 109.35 179.964 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.617 ' N ' HD13 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -43.47 -36.2 1.91 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.445 1.091 . . . . 65.340000000000003 110.249 179.986 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.59 HG13 ' N ' ' A' ' 97' ' ' GLN . 11.0 p -80.34 -55.84 7.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 124.526 1.141 . . . . 73.219999999999999 109.296 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.59 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -47.77 -23.43 0.72 Allowed 'General case' 0 C--N 1.323 -0.547 0 O-C-N 124.493 1.12 . . . . 75.209999999999994 110.323 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.24 -38.91 55.69 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.494 1.121 . . . . 74.230000000000004 109.359 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.741 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -80.66 -23.13 39.86 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.503 1.127 . . . . 71.540000000000006 109.261 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.741 ' N ' HD23 ' A' ' 99' ' ' LEU . 32.5 mt -62.76 -44.38 96.36 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.475 1.11 . . . . 73.310000000000002 109.288 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLN . . . . . 0.522 ' HB2' ' CD ' ' A' ' 107' ' ' LYS . 1.2 pp0? -85.76 55.44 3.52 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.521 1.138 . . . . 73.420000000000002 110.302 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -178.18 -63.46 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.513 1.133 . . . . 44.530000000000001 109.273 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -43.79 -56.04 4.09 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.481 1.113 . . . . 65.430000000000007 109.378 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -109.43 -28.12 9.1 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.496 1.122 . . . . 73.109999999999999 110.998 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 101.02 39.52 3.08 Favored Glycine 0 CA--C 1.53 0.982 0 O-C-N 124.561 1.163 . . . . 61.509999999999998 111.023 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 1.099 HG22 ' NZ ' ' A' ' 80' ' ' LYS . 8.2 mm -83.37 90.05 2.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 O-C-N 124.5 0.765 . . . . 74.420000000000002 109.33 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.522 ' CD ' ' HB2' ' A' ' 101' ' ' GLN . 0.0 OUTLIER -142.72 161.82 47.3 Favored Pre-proline 0 C--N 1.325 -0.484 0 O-C-N 124.48 1.112 . . . . 65.109999999999999 109.332 179.98 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.51 ' HA ' ' CB ' ' A' ' 107' ' ' LYS . 18.6 Cg_endo -74.98 149.43 93.83 Favored 'Cis proline' 0 C--N 1.36 1.177 0 C-N-CA 120.983 -2.507 . . . . 71.439999999999998 111.043 -0.047 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -121.95 131.07 8.29 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.456 1.098 . . . . 60.509999999999998 111.039 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -142.76 148.01 20.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 O-C-N 124.513 0.772 . . . . 71.549999999999997 109.327 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ILE . . . . . 0.726 HD12 ' NE2' ' A' ' 85' ' ' HIS . 32.2 pt -102.09 -177.16 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.477 1.11 . . . . 65.299999999999997 109.259 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.517 ' CD1' ' HG ' ' A' ' 84' ' ' LEU . 2.6 t80 -81.81 -23.21 36.65 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.569 1.168 . . . . 53.409999999999997 110.973 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -86.71 -5.32 59.16 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.465 1.103 . . . . 50.520000000000003 109.329 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -109.44 -26.61 9.89 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.507 1.129 . . . . 74.209999999999994 110.273 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.412 ' CE ' HG21 ' A' ' 82' ' ' VAL . 13.0 ttm -41.84 110.69 0.81 Allowed Pre-proline 0 C--N 1.325 -0.482 0 O-C-N 124.456 1.098 . . . . 72.450000000000003 110.996 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo . . . . . 0 C--N 1.361 1.185 0 O-C-N 124.481 1.78 . . . . 75.420000000000002 110.985 179.994 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.648 ' O ' ' HB3' ' A' ' 128' ' ' ALA . 4.0 pp . . . . . 0 N--CA 1.452 -0.355 0 N-CA-C 109.25 -0.648 . . . . 73.310000000000002 109.25 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.443 ' O ' ' N ' ' A' ' 129' ' ' VAL . 1.7 t70 -42.22 -65.27 0.48 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.582 1.176 . . . . 72.239999999999995 109.298 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -46.49 -40.66 12.81 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.398 1.061 . . . . 72.400000000000006 109.326 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 1.055 ' HB1' HD11 ' A' ' 84' ' ' LEU . . . -58.47 -38.96 78.66 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.501 1.126 . . . . 72.430000000000007 109.294 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.699 ' O ' HG12 ' A' ' 129' ' ' VAL . 77.1 t -90.45 18.41 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.54 1.15 . . . . 74.439999999999998 109.35 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -127.55 152.11 48.03 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.535 1.147 . . . . 64.129999999999995 109.322 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 47.5 56.17 8.56 Favored Glycine 0 CA--C 1.529 0.954 0 O-C-N 124.522 1.139 . . . . 71.329999999999998 111.031 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.9 p -163.76 163.73 23.95 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.473 0.749 . . . . 72.140000000000001 109.979 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.607 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -103.58 -23.78 13.46 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.451 1.094 . . . . 60.329999999999998 109.327 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.607 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.6 m-90 -161.79 157.5 24.27 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.026 -1.102 . . . . 72.5 108.026 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 135' ' ' THR . . . . . 0.512 ' HB ' HD13 ' A' ' 84' ' ' LEU . 33.8 p -131.15 127.02 37.17 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.464 1.103 . . . . 50.439999999999998 110.381 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.867 ' O ' HD23 ' A' ' 137' ' ' LEU . 4.3 mm -84.32 141.53 14.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.51 1.132 . . . . 73.329999999999998 109.301 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.867 HD23 ' O ' ' A' ' 136' ' ' ILE . 34.0 mt -134.97 110.66 9.24 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.457 1.098 . . . . 63.420000000000002 109.268 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 1.011 HD21 ' HB2' ' A' ' 93' ' ' ALA . 1.1 mm? -63.06 88.58 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.51 1.131 . . . . 61.219999999999999 109.27 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.51 HD12 ' HA ' ' A' ' 139' ' ' LEU . 6.7 tp -60.43 100.64 0.11 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.538 1.149 . . . . 71.010000000000005 109.304 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 140' ' ' THR . . . . . 0.671 HG22 ' H ' ' A' ' 141' ' ' GLU . 11.0 m -129.68 -177.55 4.32 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 72.319999999999993 110.417 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 141' ' ' GLU . . . . . 0.671 ' H ' HG22 ' A' ' 140' ' ' THR . 59.4 mt-10 -79.24 -35.95 40.71 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.485 1.116 . . . . 75.219999999999999 110.31 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 17.6 p30 -89.51 -34.49 16.37 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.503 1.127 . . . . 71.439999999999998 109.295 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.578 ' CE1' HG21 ' A' ' 147' ' ' THR . 6.6 t80 -71.63 -39.34 70.48 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.566 1.166 . . . . 73.420000000000002 111.048 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.8 HD13 ' N ' ' A' ' 145' ' ' ARG . 1.1 tm? -51.32 -67.47 0.25 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.47 1.106 . . . . 73.319999999999993 109.336 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.8 ' N ' HD13 ' A' ' 144' ' ' LEU . 0.0 OUTLIER -54.6 -19.14 5.4 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.56 1.163 . . . . 72.400000000000006 110.321 179.946 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -74.66 -43.13 56.81 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.582 1.177 . . . . 74.530000000000001 109.311 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.578 HG21 ' CE1' ' A' ' 143' ' ' PHE . 9.4 p -93.69 -7.57 43.36 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.453 1.096 . . . . 71.430000000000007 110.445 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.436 ' N ' ' O ' ' A' ' 144' ' ' LEU . 2.7 t-105 -86.53 -27.08 24.2 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.554 1.159 . . . . 62.439999999999998 108.01 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 13.2 t -83.57 -45.16 13.84 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.494 1.121 . . . . 51.200000000000003 108.366 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -63.27 -42.49 99.15 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.53 1.144 . . . . 61.32 109.35 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.632 ' CE1' HD12 ' A' ' 157' ' ' LEU . 5.1 m-30 -62.9 -34.66 77.89 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.542 1.151 . . . . 70.329999999999998 111.027 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -55.34 -48.76 73.72 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.515 1.135 . . . . 64.310000000000002 110.268 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.485 ' CG ' ' O ' ' A' ' 153' ' ' PHE . 11.5 t80 -86.78 0.28 55.06 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.476 1.11 . . . . 74.219999999999999 110.978 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.524 ' CE1' ' HB3' ' A' ' 156' ' ' SER . 0.4 OUTLIER -134.13 86.69 2.3 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.512 1.132 . . . . 70.120000000000005 111.003 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -67.26 -16.12 64.09 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.467 1.105 . . . . 71.549999999999997 110.412 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 156' ' ' SER . . . . . 0.524 ' HB3' ' CE1' ' A' ' 154' ' ' TYR . 1.8 t -61.85 -22.99 65.98 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.5 1.125 . . . . 63.009999999999998 110.004 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.632 HD12 ' CE1' ' A' ' 151' ' ' PHE . 2.4 mm? -87.93 -26.35 22.74 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.52 1.137 . . . . 52.210000000000001 109.274 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 158' ' ' MET . . . . . 0.509 ' O ' ' CG2' ' A' ' 161' ' ' VAL . 25.2 mmt -66.23 -22.25 66.33 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.563 1.164 . . . . 74.230000000000004 111.041 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 9.9 m-20 -93.88 -17.79 22.66 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.486 1.116 . . . . 73.129999999999995 109.294 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 160' ' ' SER . . . . . 0.478 ' HB2' ' CG2' ' A' ' 170' ' ' VAL . 69.4 p -81.2 -34.6 32.17 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.485 1.116 . . . . 71.310000000000002 110.028 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 161' ' ' VAL . . . . . 0.638 ' O ' HD13 ' A' ' 192' ' ' ILE . 1.5 m -51.07 -21.51 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.601 1.188 . . . . 54.240000000000002 109.267 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 162' ' ' ASN . . . . . 0.415 ' O ' ' C ' ' A' ' 163' ' ' ARG . 75.1 m-20 -90.09 25.75 2.06 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.538 1.149 . . . . 64.010000000000005 109.297 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 160' ' ' SER . 0.1 OUTLIER 37.91 34.22 0.06 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.478 1.111 . . . . 74.340000000000003 110.313 -179.948 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 164' ' ' GLN . . . . . 0.402 ' C ' ' O ' ' A' ' 163' ' ' ARG . 37.5 mt-30 -38.7 126.88 1.52 Allowed 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.495 1.122 . . . . 65.409999999999997 110.339 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 39.5 m-70 -72.03 68.52 0.69 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.56 1.163 . . . . 70.349999999999994 109.654 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.452 ' O ' ' NE2' ' A' ' 218' ' ' GLN . 0.1 OUTLIER -122.54 -174.39 2.9 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.486 1.116 . . . . 72.310000000000002 109.281 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 167' ' ' TYR . . . . . 0.749 ' CE1' ' CD1' ' A' ' 222' ' ' TRP . 8.2 t80 -45.56 -39.6 7.72 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.428 1.08 . . . . 74.010000000000005 110.992 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 168' ' ' ASN . . . . . 0.486 ' ND2' ' O ' ' A' ' 129' ' ' VAL . 4.8 p30 -128.17 149.02 50.62 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.569 1.168 . . . . 75.400000000000006 109.273 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.426 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 1.5 t -126.56 168.38 14.36 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.502 1.126 . . . . 65.219999999999999 110.034 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.478 ' CG2' ' HB2' ' A' ' 160' ' ' SER . 2.0 t -129.52 117.06 41.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 O-C-N 124.557 1.161 . . . . 73.310000000000002 109.285 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.563 HG22 ' HB2' ' A' ' 195' ' ' LEU . 17.1 mm -124.25 99.91 36.53 Favored Pre-proline 0 C--N 1.326 -0.441 0 O-C-N 124.446 1.091 . . . . 60.439999999999998 109.287 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 172' ' ' PRO . . . . . 0.877 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.95 106.95 2.37 Favored 'Trans proline' 0 C--N 1.361 1.199 0 O-C-N 124.446 1.761 . . . . 70.140000000000001 111.017 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 173' ' ' MET . . . . . 0.529 ' HE1' ' HB2' ' A' ' 197' ' ' GLU . 3.5 ttt -87.77 152.44 22.12 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.442 1.088 . . . . 75.519999999999996 111.017 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 174' ' ' ARG . . . . . 0.428 ' N ' ' HG2' ' A' ' 173' ' ' MET . 60.0 mtp180 -106.43 123.9 37.39 Favored Pre-proline 0 C--N 1.325 -0.499 0 O-C-N 124.495 1.122 . . . . 74.450000000000003 110.293 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 175' ' ' PRO . . . . . 0.673 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.3 Cg_endo -74.94 155.0 43.19 Favored 'Trans proline' 0 C--N 1.36 1.175 0 O-C-N 124.528 1.804 . . . . 72.219999999999999 110.974 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 176' ' ' LEU . . . . . 0.975 HD21 ' HG2' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -96.0 -38.0 10.41 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.487 1.117 . . . . 72.530000000000001 109.304 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -72.9 -23.92 60.77 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.438 1.086 . . . . 71.040000000000006 109.336 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -110.38 110.24 58.12 Favored Pre-proline 0 C--N 1.325 -0.491 0 O-C-N 124.518 1.137 . . . . 65.349999999999994 109.313 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.93 115.5 4.31 Favored 'Trans proline' 0 C--N 1.359 1.094 0 O-C-N 124.525 1.802 . . . . 74.120000000000005 111.031 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.5 ' CD1' ' OG1' ' A' ' 185' ' ' THR . 0.7 OUTLIER -118.11 96.98 50.41 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.535 1.147 . . . . 71.549999999999997 109.331 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.02 169.38 22.76 Favored 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.479 1.778 . . . . 63.049999999999997 110.996 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 12.3 ptt180 -70.55 -16.06 62.84 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.49 1.119 . . . . 63.32 110.374 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -78.74 -2.41 39.28 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.556 1.16 . . . . 64.329999999999998 110.318 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -128.4 8.04 5.93 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.473 1.108 . . . . 70.319999999999993 110.289 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 185' ' ' THR . . . . . 0.5 ' OG1' ' CD1' ' A' ' 180' ' ' LEU . 19.6 m -110.03 143.69 28.49 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.585 1.178 . . . . 74.510000000000005 110.371 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 186' ' ' PRO . . . . . 0.709 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -74.95 155.87 43.18 Favored 'Trans proline' 0 C--N 1.36 1.146 0 O-C-N 124.545 1.813 . . . . 64.439999999999998 110.983 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 187' ' ' PHE . . . . . 0.503 ' O ' ' CG2' ' A' ' 191' ' ' THR . 28.9 p90 -69.34 -7.38 36.78 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.488 1.118 . . . . 71.310000000000002 111.008 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.76 -53.17 4.13 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.449 1.093 . . . . 64.430000000000007 109.29 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.76 HD22 ' HG3' ' A' ' 172' ' ' PRO . 61.1 mt -68.27 -42.33 79.75 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.484 1.115 . . . . 53.32 109.328 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 190' ' ' GLN . . . . . 0.413 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 6.8 pt20 -63.77 -11.04 23.15 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.563 1.164 . . . . 65.030000000000001 110.279 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 191' ' ' THR . . . . . 0.503 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 34.4 p -113.0 -3.9 13.97 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.518 1.136 . . . . 71.230000000000004 110.411 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.638 HD13 ' O ' ' A' ' 161' ' ' VAL . 7.9 mt -93.18 157.07 3.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 O-C-N 124.406 1.066 . . . . 64.439999999999998 109.301 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 193' ' ' ASN . . . . . 0.549 ' ND2' ' OE1' ' A' ' 205' ' ' GLN . 26.2 t-20 -76.97 56.95 1.27 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.417 1.073 . . . . 54.32 109.31 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 194' ' ' ALA . . . . . 0.877 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -50.99 163.18 0.21 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.58 1.175 . . . . 63.539999999999999 109.364 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 195' ' ' LEU . . . . . 0.638 HD23 ' CD1' ' A' ' 209' ' ' ILE . 0.2 OUTLIER -86.65 127.87 34.96 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 74.420000000000002 109.29 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -108.35 128.84 55.11 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.543 1.152 . . . . 62.299999999999997 110.345 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.975 ' HG2' HD21 ' A' ' 176' ' ' LEU . 5.6 tp10 -109.74 -22.09 12.08 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.482 1.114 . . . . 74.25 110.322 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 198' ' ' GLU . . . . . 0.537 ' HB3' HD12 ' A' ' 176' ' ' LEU . 2.2 pt-20 -94.82 19.12 10.59 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.495 1.122 . . . . 60.329999999999998 110.279 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -127.59 146.81 50.41 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.51 1.131 . . . . 61.310000000000002 110.001 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 12.6 tpp85 -63.18 -12.16 26.04 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.467 1.104 . . . . 72.439999999999998 110.298 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -93.76 16.43 60.82 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.545 1.153 . . . . 60.310000000000002 111.007 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 202' ' ' PHE . . . . . 0.802 ' O ' HG23 ' A' ' 206' ' ' VAL . 5.3 t80 -67.83 -38.35 14.37 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.533 0.784 . . . . 74.230000000000004 110.986 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 203' ' ' PRO . . . . . 0.701 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.5 Cg_endo -74.98 -30.13 7.52 Favored 'Trans proline' 0 C--N 1.361 1.187 0 O-C-N 124.5 1.789 . . . . 62.350000000000001 111.073 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -64.08 -65.46 0.68 Allowed 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.521 1.138 . . . . 61.030000000000001 110.392 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 205' ' ' GLN . . . . . 0.549 ' OE1' ' ND2' ' A' ' 193' ' ' ASN . 6.4 mt-30 -51.1 -42.28 60.55 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.423 1.077 . . . . 74.319999999999993 110.244 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 206' ' ' VAL . . . . . 0.802 HG23 ' O ' ' A' ' 202' ' ' PHE . 55.2 t -58.85 -28.41 37.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.487 1.117 . . . . 65.109999999999999 109.331 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -82.88 -47.6 11.66 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.521 1.138 . . . . 64.299999999999997 110.27 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 208' ' ' ARG . . . . . 0.442 ' N ' ' HD2' ' A' ' 208' ' ' ARG . 1.9 mpt_? -64.25 -64.01 0.99 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.459 1.099 . . . . 71.439999999999998 110.278 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 209' ' ' ILE . . . . . 0.71 HG22 ' CD1' ' A' ' 210' ' ' PHE . 54.2 mt -48.35 -53.01 6.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.515 1.135 . . . . 63.439999999999998 109.297 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 210' ' ' PHE . . . . . 0.71 ' CD1' HG22 ' A' ' 209' ' ' ILE . 0.8 OUTLIER -101.84 66.15 1.03 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.526 1.142 . . . . 75.25 111.016 179.993 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 211' ' ' GLN . . . . . 0.443 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.1 OUTLIER -110.92 146.37 36.69 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.504 1.128 . . . . 75.420000000000002 110.271 179.974 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 212' ' ' GLU . . . . . 0.452 ' O ' ' N ' ' A' ' 215' ' ' TYR . 63.9 tt0 -48.86 -55.62 11.13 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.503 1.127 . . . . 51.119999999999997 110.275 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -48.24 -24.03 1.06 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.522 1.138 . . . . 73.430000000000007 110.011 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.443 HG23 ' HG2' ' A' ' 211' ' ' GLN . 22.6 t -95.86 -29.02 3.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.493 1.121 . . . . 71.430000000000007 109.281 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 215' ' ' TYR . . . . . 0.477 ' OH ' ' CE2' ' A' ' 78' ' ' PHE . 12.3 t80 -65.1 -20.26 66.39 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 124.535 1.147 . . . . 72.409999999999997 110.922 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 216' ' ' LYS . . . . . 0.46 ' O ' ' CB ' ' A' ' 220' ' ' THR . 5.9 mmpt? -69.23 -57.3 5.52 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.57 1.169 . . . . 62.43 109.372 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 1.2 m -47.87 -53.66 15.03 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.505 1.128 . . . . 73.349999999999994 110.41 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 218' ' ' GLN . . . . . 0.452 ' NE2' ' O ' ' A' ' 166' ' ' LYS . 94.5 mm-40 -55.78 -66.94 0.34 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.455 1.097 . . . . 73.150000000000006 110.325 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 219' ' ' GLN . . . . . 0.456 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 40.2 tp60 -54.57 -18.79 4.83 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.547 1.154 . . . . 71.450000000000003 110.304 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 220' ' ' THR . . . . . 0.46 ' CB ' ' O ' ' A' ' 216' ' ' LYS . 2.9 m -83.27 -28.41 29.16 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.565 1.165 . . . . 34.240000000000002 110.399 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 221' ' ' ILE . . . . . 0.442 HG22 ' HB2' ' A' ' 167' ' ' TYR . 14.0 mt -83.81 -17.66 10.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.453 1.096 . . . . 73.209999999999994 109.263 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 222' ' ' TRP . . . . . 0.749 ' CD1' ' CE1' ' A' ' 167' ' ' TYR . 7.9 t90 -89.09 -59.63 2.17 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.957 -1.127 . . . . 72.140000000000001 107.957 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.14 -20.45 6.7 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.496 1.123 . . . . 73.420000000000002 109.327 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 . . . . . 0 C--N 1.325 -0.49 0 O-C-N 124.48 1.113 . . . . 74.129999999999995 110.286 -179.928 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.554 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 5.9 p . . . . . 0 N--CA 1.455 -0.222 0 N-CA-C 109.272 -0.64 . . . . 73.239999999999995 109.272 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.479 ' N ' HG22 ' A' ' 77' ' ' VAL . 1.5 t80 -87.36 20.92 2.62 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.486 1.116 . . . . 74.209999999999994 110.985 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.469 ' HB2' HG13 ' A' ' 77' ' ' VAL . 6.5 tp -41.2 160.9 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.445 1.091 . . . . 63.340000000000003 109.341 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.616 ' O ' ' HB3' ' A' ' 133' ' ' ALA . 6.5 ptmt -111.08 -49.58 3.01 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 124.499 1.125 . . . . 75.209999999999994 109.308 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.925 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.2 OUTLIER -165.62 136.69 3.82 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.571 1.169 . . . . 74.010000000000005 111.04 -179.955 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.539 HG22 ' N ' ' A' ' 83' ' ' ILE . 8.0 p -91.09 169.25 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.509 1.131 . . . . 71.299999999999997 109.293 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.925 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 4.7 mp -133.04 96.97 2.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.478 1.111 . . . . 74.239999999999995 109.319 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.843 HD11 ' HB3' ' A' ' 128' ' ' ALA . 8.0 mt -69.59 124.15 23.19 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.468 1.105 . . . . 73.140000000000001 109.348 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.797 ' NE2' HD12 ' A' ' 111' ' ' ILE . 2.8 p80 -146.06 174.72 11.04 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.447 1.092 . . . . 74.049999999999997 109.658 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.467 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -131.8 164.65 25.56 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.442 1.089 . . . . 64.340000000000003 109.336 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -55.62 -17.29 5.33 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.47 1.106 . . . . 72.340000000000003 110.268 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -76.47 -46.53 26.46 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.529 1.143 . . . . 41.439999999999998 109.313 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.442 ' OD2' ' ND2' ' A' ' 178' ' ' ASN . 21.8 m-20 -125.35 45.14 2.64 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.492 1.12 . . . . 60.020000000000003 109.318 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.619 ' HG1' ' CE1' ' A' ' 85' ' ' HIS . 0.9 OUTLIER -75.05 -37.59 61.65 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 72.329999999999998 110.378 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.82 -19.99 43.45 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.467 1.104 . . . . 54.439999999999998 109.295 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.42 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -75.46 -59.97 2.51 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.436 1.085 . . . . 74.099999999999994 110.24 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.753 ' HB2' ' CD2' ' A' ' 138' ' ' LEU . . . -60.56 -23.17 64.42 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.581 1.176 . . . . 64.209999999999994 109.287 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.848 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -85.8 -41.42 15.07 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.498 1.123 . . . . 73.549999999999997 109.279 -179.992 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -53.19 -34.78 58.42 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.496 1.122 . . . . 74.420000000000002 110.347 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.589 HG13 ' N ' ' A' ' 97' ' ' GLN . 9.5 p -83.19 -56.08 6.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.49 1.119 . . . . 74.239999999999995 109.308 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.593 ' HA ' HD12 ' A' ' 100' ' ' LEU . 0.1 OUTLIER -47.67 -23.27 0.65 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.466 1.104 . . . . 62.399999999999999 110.273 -179.955 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -77.24 -43.33 33.91 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.472 1.108 . . . . 40.219999999999999 109.308 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.72 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -75.53 -22.28 57.22 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.519 1.137 . . . . 72.340000000000003 109.321 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.72 ' N ' HD23 ' A' ' 99' ' ' LEU . 73.4 mt -65.02 -49.67 69.25 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.483 1.114 . . . . 64.120000000000005 109.326 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -78.7 53.24 1.31 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.527 1.142 . . . . 71.230000000000004 110.321 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -176.91 -66.56 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.526 1.141 . . . . 74.329999999999998 109.336 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -41.54 -48.53 3.96 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.579 1.175 . . . . 74.310000000000002 109.276 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -115.8 -29.96 6.25 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.512 1.132 . . . . 75.409999999999997 110.993 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 106.61 35.92 2.73 Favored Glycine 0 CA--C 1.53 0.972 0 O-C-N 124.474 1.109 . . . . 73.439999999999998 111.011 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.56 HG22 ' HD3' ' A' ' 80' ' ' LYS . 23.5 mm -75.84 87.77 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.539 0.788 . . . . 74.219999999999999 109.3 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.514 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -137.75 158.32 71.87 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.529 1.143 . . . . 71.400000000000006 109.292 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.514 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.4 Cg_endo -74.94 158.25 99.1 Favored 'Cis proline' 0 C--N 1.36 1.177 0 C-N-CA 121.023 -2.49 . . . . 70.219999999999999 111.038 -0.071 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -114.97 134.25 11.52 Favored Glycine 0 CA--C 1.53 1.005 0 O-C-N 124.524 1.14 . . . . 54.25 111.02 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -154.09 128.26 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.531 0.783 . . . . 42.0 109.277 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ILE . . . . . 0.797 HD12 ' NE2' ' A' ' 85' ' ' HIS . 44.6 pt -89.68 -171.63 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 124.469 1.105 . . . . 72.409999999999997 109.26 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -81.33 -40.01 24.26 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.522 1.139 . . . . 74.109999999999999 111.037 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.5 ' HB2' ' HE1' ' A' ' 85' ' ' HIS . . . -73.97 -4.45 35.27 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.539 1.15 . . . . 72.010000000000005 109.261 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -106.69 -26.57 11.27 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.515 1.135 . . . . 73.420000000000002 110.298 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 31.9 tpp -44.48 110.88 1.1 Allowed Pre-proline 0 C--N 1.326 -0.443 0 O-C-N 124.386 1.054 . . . . 65.519999999999996 110.996 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 C--N 1.359 1.118 0 O-C-N 124.515 1.797 . . . . 64.109999999999999 111.043 179.941 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.625 HD21 ' OD1' ' A' ' 150' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.279 0 N-CA-C 109.336 -0.616 . . . . 61.210000000000001 109.336 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.446 ' H ' HD12 ' A' ' 125' ' ' LEU . 7.7 p-10 -46.54 -25.96 0.79 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.55 1.156 . . . . 73.519999999999996 109.307 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.408 ' N ' ' C ' ' A' ' 125' ' ' LEU . 2.1 t70 -65.27 -55.46 18.27 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.506 1.129 . . . . 73.010000000000005 109.27 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.843 ' HB3' HD11 ' A' ' 84' ' ' LEU . . . -61.02 -15.24 29.74 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.479 1.112 . . . . 61.329999999999998 109.313 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.677 HG21 ' CD2' ' A' ' 157' ' ' LEU . 89.9 t -86.6 10.53 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.496 1.123 . . . . 70.140000000000001 109.258 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 14.5 t30 -127.61 158.97 36.08 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.494 1.121 . . . . 44.25 109.311 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 42.67 55.43 4.64 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 124.489 1.118 . . . . 65.230000000000004 111.028 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -162.53 165.54 25.94 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.532 0.784 . . . . 54.119999999999997 110.036 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.616 ' HB3' ' O ' ' A' ' 80' ' ' LYS . . . -110.08 -25.49 10.19 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.493 1.121 . . . . 74.129999999999995 109.355 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.598 ' CD1' ' O ' ' A' ' 133' ' ' ALA . 4.0 m-90 -158.45 150.61 21.66 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.477 1.111 . . . . 72.230000000000004 108.062 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 135' ' ' THR . . . . . 0.845 HG23 ' O ' ' A' ' 169' ' ' SER . 7.0 p -125.94 154.8 42.32 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.529 1.143 . . . . 75.150000000000006 110.411 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.663 ' HB ' HG23 ' A' ' 83' ' ' ILE . 15.7 mm -105.42 91.65 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.461 1.1 . . . . 65.549999999999997 109.263 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.405 ' CB ' ' HA ' ' A' ' 172' ' ' PRO . 0.6 OUTLIER -73.59 87.08 1.63 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.534 1.146 . . . . 70.439999999999998 109.3 179.959 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.753 ' CD2' ' HB2' ' A' ' 93' ' ' ALA . 1.4 tp -62.1 96.2 0.07 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.495 1.122 . . . . 71.140000000000001 109.324 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.504 HD11 HD13 ' A' ' 189' ' ' LEU . 0.1 OUTLIER -71.98 121.46 19.16 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.496 1.122 . . . . 74.430000000000007 109.303 -179.984 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 140' ' ' THR . . . . . 0.719 HG22 ' H ' ' A' ' 141' ' ' GLU . 7.0 m -137.9 -173.64 3.56 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.49 1.119 . . . . 63.43 110.394 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 141' ' ' GLU . . . . . 0.719 ' H ' HG22 ' A' ' 140' ' ' THR . 4.0 mt-10 -84.93 -40.62 16.77 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 72.230000000000004 110.317 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 142' ' ' ASN . . . . . 0.409 ' ND2' ' N ' ' A' ' 143' ' ' PHE . 3.8 p-10 -89.67 -49.67 6.52 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.506 1.129 . . . . 60.140000000000001 109.32 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.749 ' O ' HG23 ' A' ' 147' ' ' THR . 43.1 t80 -50.39 -28.04 7.42 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.473 1.108 . . . . 64.530000000000001 111.008 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.444 HD13 ' C ' ' A' ' 144' ' ' LEU . 3.0 tm? -63.68 -67.85 0.39 Allowed 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.488 1.118 . . . . 62.149999999999999 109.263 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -48.59 -28.75 3.65 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.535 1.147 . . . . 75.239999999999995 110.389 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' ASP . . . . . 0.541 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 5.3 m-20 -71.48 -71.63 0.26 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.491 1.119 . . . . 71.519999999999996 109.35 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.749 HG23 ' O ' ' A' ' 143' ' ' PHE . 65.7 p -49.08 -55.87 10.83 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.49 1.119 . . . . 72.430000000000007 110.404 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.561 ' CZ2' ' HB3' ' A' ' 186' ' ' PRO . 0.0 OUTLIER -46.39 -31.77 2.82 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.545 1.153 . . . . 74.120000000000005 108.009 -179.963 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 149' ' ' CYS . . . . . 0.541 ' CB ' ' O ' ' A' ' 146' ' ' ASP . 1.8 t -57.86 -46.21 85.17 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.546 1.154 . . . . 52.049999999999997 108.288 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 150' ' ' ASN . . . . . 0.625 ' OD1' HD21 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -67.05 -41.6 86.22 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.525 1.14 . . . . 73.409999999999997 109.288 -179.996 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.879 ' CZ ' HD12 ' A' ' 157' ' ' LEU . 13.1 m-85 -55.34 -21.75 16.43 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.61 1.194 . . . . 75.430000000000007 111.064 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -85.49 -33.01 21.93 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.549 1.156 . . . . 72.519999999999996 110.366 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.525 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 2.5 t80 -110.25 21.19 17.02 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.513 1.133 . . . . 63.43 111.035 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.452 ' N ' ' O ' ' A' ' 150' ' ' ASN . 2.3 t80 -163.75 106.0 0.95 Allowed 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.52 1.137 . . . . 74.340000000000003 111.011 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 6.3 t -85.92 -10.75 54.72 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.478 1.111 . . . . 72.540000000000006 110.456 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 3.1 t -62.55 -23.11 66.82 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.536 1.148 . . . . 75.120000000000005 110.007 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.879 HD12 ' CZ ' ' A' ' 151' ' ' PHE . 0.2 OUTLIER -77.11 -37.86 53.33 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.526 1.141 . . . . 65.319999999999993 109.302 -179.993 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 158' ' ' MET . . . . . 0.47 ' CE ' ' HA ' ' A' ' 158' ' ' MET . 17.0 mmt -57.0 -35.83 69.67 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.439 1.087 . . . . 70.420000000000002 111.0 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 33.9 m-80 -71.23 -38.01 72.0 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.527 1.142 . . . . 52.340000000000003 109.342 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 160' ' ' SER . . . . . 0.633 ' OG ' HG11 ' A' ' 170' ' ' VAL . 1.3 p -67.19 -35.34 79.43 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.496 1.122 . . . . 71.319999999999993 109.995 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 161' ' ' VAL . . . . . 0.882 ' O ' HD13 ' A' ' 192' ' ' ILE . 64.7 t -58.56 -22.92 21.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.474 1.108 . . . . 73.540000000000006 109.302 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 68.9 m-20 -83.18 -22.71 33.16 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.459 1.1 . . . . 75.129999999999995 109.306 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 54.47 35.16 22.63 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.571 1.169 . . . . 74.409999999999997 110.271 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -52.56 -173.5 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.488 1.117 . . . . 72.340000000000003 110.316 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 12.2 p-80 -73.21 66.79 0.9 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.49 1.119 . . . . 73.239999999999995 109.622 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.32 160.39 26.8 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.485 1.116 . . . . 75.150000000000006 109.308 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 167' ' ' TYR . . . . . 0.74 ' HB3' HG22 ' A' ' 221' ' ' ILE . 4.6 p90 -70.0 -6.12 31.13 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.456 1.098 . . . . 72.239999999999995 110.89 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 168' ' ' ASN . . . . . 0.516 ' ND2' ' CZ ' ' A' ' 167' ' ' TYR . 0.3 OUTLIER -122.81 137.44 54.93 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 124.493 1.12 . . . . 54.399999999999999 109.31 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.845 ' O ' HG23 ' A' ' 135' ' ' THR . 0.7 OUTLIER -143.01 150.79 40.09 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.552 1.158 . . . . 45.409999999999997 110.024 179.997 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.633 HG11 ' OG ' ' A' ' 160' ' ' SER . 1.0 OUTLIER -126.18 150.5 31.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.474 1.109 . . . . 70.310000000000002 109.287 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.643 HG22 ' HB2' ' A' ' 195' ' ' LEU . 12.1 mm -139.65 112.51 7.71 Favored Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 124.532 1.145 . . . . 75.409999999999997 109.27 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 172' ' ' PRO . . . . . 0.813 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -75.0 106.9 2.37 Favored 'Trans proline' 0 C--N 1.36 1.183 0 O-C-N 124.548 1.815 . . . . 70.299999999999997 111.034 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 173' ' ' MET . . . . . 0.575 ' CE ' HD12 ' A' ' 195' ' ' LEU . 3.9 ttt -96.39 154.0 17.51 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.501 1.126 . . . . 70.129999999999995 110.974 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 174' ' ' ARG . . . . . 0.442 ' N ' ' HG2' ' A' ' 173' ' ' MET . 57.8 mtm180 -110.66 121.53 40.86 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.476 1.11 . . . . 54.020000000000003 110.319 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 175' ' ' PRO . . . . . 0.473 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.2 Cg_endo -74.97 151.66 39.96 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.458 1.767 . . . . 72.299999999999997 111.037 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 176' ' ' LEU . . . . . 0.913 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -85.15 -43.54 13.75 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.458 1.099 . . . . 72.010000000000005 109.318 -179.996 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -71.82 -28.34 63.52 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.496 1.123 . . . . 53.25 109.28 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 178' ' ' ASN . . . . . 0.67 ' OD1' HG23 ' A' ' 140' ' ' THR . 2.6 m-80 -110.44 99.63 41.57 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.547 1.155 . . . . 73.120000000000005 109.242 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.98 115.09 4.18 Favored 'Trans proline' 0 C--N 1.359 1.122 0 O-C-N 124.512 1.796 . . . . 73.400000000000006 110.99 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.608 HD13 ' HB2' ' A' ' 184' ' ' ARG . 0.6 OUTLIER -122.81 96.91 44.71 Favored Pre-proline 0 C--N 1.324 -0.518 0 O-C-N 124.528 1.143 . . . . 74.519999999999996 109.325 179.964 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 181' ' ' PRO . . . . . 0.444 ' HG2' ' CG ' ' A' ' 183' ' ' GLU . 18.4 Cg_endo -74.99 169.13 23.31 Favored 'Trans proline' 0 C--N 1.36 1.159 0 O-C-N 124.502 1.79 . . . . 62.039999999999999 111.013 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 182' ' ' ARG . . . . . 0.428 ' CG ' ' N ' ' A' ' 183' ' ' GLU . 23.1 ptt180 -53.1 -39.34 63.32 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.518 1.136 . . . . 63.130000000000003 110.3 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 183' ' ' GLU . . . . . 0.444 ' CG ' ' HG2' ' A' ' 181' ' ' PRO . 5.4 pt-20 -52.01 -36.09 48.9 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.439 1.087 . . . . 73.299999999999997 110.375 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 184' ' ' ARG . . . . . 0.608 ' HB2' HD13 ' A' ' 180' ' ' LEU . 35.3 mmt180 -89.58 -18.43 26.58 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.427 1.079 . . . . 75.109999999999999 110.278 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 185' ' ' THR . . . . . 0.493 HG22 ' HD2' ' A' ' 186' ' ' PRO . 20.7 m -82.2 143.91 49.61 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.494 1.121 . . . . 60.210000000000001 110.361 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 186' ' ' PRO . . . . . 0.751 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -74.96 155.15 43.12 Favored 'Trans proline' 0 C--N 1.36 1.134 0 O-C-N 124.5 1.79 . . . . 70.409999999999997 111.022 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 187' ' ' PHE . . . . . 0.505 ' O ' ' CG2' ' A' ' 191' ' ' THR . 23.3 p90 -68.93 -7.09 31.76 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.582 1.176 . . . . 73.140000000000001 111.006 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 188' ' ' ALA . . . . . 0.567 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -93.92 -53.11 4.12 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.592 1.182 . . . . 62.32 109.283 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.751 HD12 ' CG ' ' A' ' 186' ' ' PRO . 51.7 mt -68.54 -42.36 78.55 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.542 1.151 . . . . 73.209999999999994 109.326 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 190' ' ' GLN . . . . . 0.41 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 6.5 pt20 -63.62 -11.36 24.46 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.518 1.136 . . . . 72.340000000000003 110.316 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 191' ' ' THR . . . . . 0.505 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 29.1 p -111.81 19.55 17.87 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.48 1.113 . . . . 55.310000000000002 110.396 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.882 HD13 ' O ' ' A' ' 161' ' ' VAL . 5.3 mt -138.21 139.33 42.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 O-C-N 124.5 1.125 . . . . 73.140000000000001 109.306 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 193' ' ' ASN . . . . . 0.505 ' ND2' HD11 ' A' ' 209' ' ' ILE . 12.5 t30 -47.26 97.06 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.525 1.141 . . . . 73.099999999999994 109.315 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 194' ' ' ALA . . . . . 0.813 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -88.83 141.29 28.62 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.52 1.137 . . . . 45.119999999999997 109.31 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 195' ' ' LEU . . . . . 0.643 ' HB2' HG22 ' A' ' 171' ' ' ILE . 0.2 OUTLIER -61.47 136.09 57.91 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.51 1.131 . . . . 71.200000000000003 109.297 179.991 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -116.54 129.7 56.33 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.459 1.1 . . . . 63.450000000000003 110.349 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.913 ' HG3' HD21 ' A' ' 176' ' ' LEU . 41.6 tp10 -113.16 -29.12 7.4 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.493 1.12 . . . . 71.099999999999994 110.335 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.1 21.24 6.01 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.521 1.138 . . . . 55.32 110.317 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 1.2 t -128.63 145.4 51.16 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.555 1.16 . . . . 62.219999999999999 109.997 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.17 -14.05 44.28 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.475 1.11 . . . . 73.219999999999999 110.258 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -92.82 16.22 60.82 Favored Glycine 0 CA--C 1.531 1.04 0 O-C-N 124.542 1.151 . . . . 51.32 111.004 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 202' ' ' PHE . . . . . 0.81 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.5 OUTLIER -61.15 -41.67 81.97 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.447 0.733 . . . . 74.019999999999996 110.997 -179.996 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 203' ' ' PRO . . . . . 0.642 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.05 -34.71 3.57 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.445 1.76 . . . . 52.100000000000001 111.013 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.09 -55.43 31.12 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.495 1.122 . . . . 61.0 110.407 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -65.51 -40.05 92.55 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.495 1.122 . . . . 73.310000000000002 110.34 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 206' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 202' ' ' PHE . 72.9 t -64.45 -28.83 45.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.544 1.153 . . . . 73.120000000000005 109.239 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -83.07 -38.74 22.1 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.5 1.125 . . . . 72.430000000000007 110.305 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 79.3 mtt-85 -74.05 -65.49 0.83 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.545 1.153 . . . . 75.530000000000001 110.354 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 209' ' ' ILE . . . . . 0.645 HG22 ' CD1' ' A' ' 210' ' ' PHE . 90.8 mt -46.26 -50.03 5.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 124.447 1.092 . . . . 71.230000000000004 109.358 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 210' ' ' PHE . . . . . 0.645 ' CD1' HG22 ' A' ' 209' ' ' ILE . 0.9 OUTLIER -100.98 71.82 1.44 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.483 1.114 . . . . 72.140000000000001 111.006 179.943 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 211' ' ' GLN . . . . . 0.477 ' CG ' ' HB ' ' A' ' 214' ' ' VAL . 11.1 pt20 -110.9 138.64 47.05 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.49 1.119 . . . . 73.310000000000002 110.261 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 212' ' ' GLU . . . . . 0.422 ' C ' ' N ' ' A' ' 214' ' ' VAL . 6.8 tt0 -51.49 -50.97 58.87 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 63.049999999999997 110.339 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.4 t -47.26 -21.55 0.29 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.554 1.159 . . . . 74.0 110.009 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.477 ' HB ' ' CG ' ' A' ' 211' ' ' GLN . 2.0 t -96.95 -43.07 12.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.544 1.153 . . . . 63.119999999999997 109.269 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 215' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -46.0 -40.05 9.95 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.526 1.141 . . . . 64.109999999999999 111.026 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -54.13 -66.31 0.42 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.491 1.119 . . . . 72.310000000000002 109.249 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 217' ' ' THR . . . . . 0.548 HG22 HD11 ' A' ' 221' ' ' ILE . 2.0 m -46.1 -66.54 0.39 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.51 1.131 . . . . 73.120000000000005 110.367 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 218' ' ' GLN . . . . . 0.89 ' HA ' HD12 ' A' ' 221' ' ' ILE . 18.5 mm-40 -39.55 -64.47 0.47 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.561 1.163 . . . . 74.439999999999998 110.284 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 219' ' ' GLN . . . . . 0.416 ' NE2' ' HB2' ' A' ' 223' ' ' LYS . 25.6 tp60 -44.14 -52.42 7.3 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.501 1.126 . . . . 64.030000000000001 110.304 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.83 -33.03 47.47 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.549 1.156 . . . . 55.340000000000003 110.42 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 221' ' ' ILE . . . . . 0.89 HD12 ' HA ' ' A' ' 218' ' ' GLN . 12.5 mt -74.67 -48.32 34.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.519 1.137 . . . . 71.129999999999995 109.299 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 222' ' ' TRP . . . . . 0.554 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 78.3 t90 -67.32 -17.96 64.98 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.032 -1.099 . . . . 73.010000000000005 108.032 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 223' ' ' LYS . . . . . 0.416 ' HB2' ' NE2' ' A' ' 219' ' ' GLN . 0.0 OUTLIER -84.63 -49.42 8.56 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.453 1.096 . . . . 61.549999999999997 109.284 -179.994 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 . . . . . 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 75.530000000000001 110.372 179.983 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.595 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 2.7 p . . . . . 0 N--CA 1.453 -0.324 0 N-CA-C 109.291 -0.633 . . . . 75.310000000000002 109.291 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.407 ' CE2' ' HG3' ' A' ' 108' ' ' PRO . 51.3 p90 -89.61 31.33 0.94 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.481 1.113 . . . . 73.409999999999997 111.035 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.488 HD11 HG22 ' A' ' 110' ' ' ILE . 9.3 tp -40.23 139.1 0.77 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.506 1.129 . . . . 71.400000000000006 109.338 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.657 ' HZ1' HD12 ' A' ' 106' ' ' ILE . 2.4 mtpt -76.54 -63.43 1.34 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.492 1.12 . . . . 64.109999999999999 109.29 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.975 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.8 OUTLIER -160.81 127.9 4.21 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.562 1.164 . . . . 71.319999999999993 110.918 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.657 ' CG1' HG22 ' A' ' 135' ' ' THR . 12.3 p -84.55 169.59 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.549 1.155 . . . . 55.340000000000003 109.281 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.975 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 1.7 mp -129.65 94.41 2.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.514 1.134 . . . . 74.120000000000005 109.246 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.831 HD11 ' HB3' ' A' ' 128' ' ' ALA . 3.0 mt -71.71 93.64 1.29 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.473 1.108 . . . . 70.439999999999998 109.299 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.695 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -115.05 174.51 5.94 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.487 1.117 . . . . 74.409999999999997 109.602 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -100.68 164.09 12.03 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.564 1.165 . . . . 54.299999999999997 109.316 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.47 ' CG ' ' O ' ' A' ' 87' ' ' GLU . 13.4 tt0 -71.23 -5.6 33.28 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.496 1.123 . . . . 71.319999999999993 110.3 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -91.06 -45.46 8.68 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.466 1.103 . . . . 63.32 109.296 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.722 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -114.7 44.23 1.79 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.48 1.113 . . . . 63.520000000000003 109.31 179.954 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.607 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -76.91 -34.69 57.7 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.515 1.134 . . . . 61.229999999999997 110.396 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.52 -19.54 59.29 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.493 1.121 . . . . 72.340000000000003 109.33 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -78.53 -57.07 3.96 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.444 1.09 . . . . 71.120000000000005 110.336 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.775 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -63.13 -16.46 60.11 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 73.140000000000001 109.3 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.715 HD13 ' N ' ' A' ' 95' ' ' ARG . 0.1 OUTLIER -89.51 -53.75 4.39 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.486 1.116 . . . . 74.230000000000004 109.345 179.976 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.715 ' N ' HD13 ' A' ' 94' ' ' LEU . 20.3 tpp180 -44.1 -29.62 0.64 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.5 1.125 . . . . 72.140000000000001 110.306 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.594 HG13 ' N ' ' A' ' 97' ' ' GLN . 10.6 p -86.13 -56.23 5.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 O-C-N 124.403 1.064 . . . . 71.010000000000005 109.286 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.67 HE21 HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -47.44 -23.74 0.67 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.454 1.096 . . . . 71.349999999999994 110.309 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.75 -39.19 57.58 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.515 1.135 . . . . 74.230000000000004 109.318 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.751 ' C ' HD23 ' A' ' 99' ' ' LEU . 0.0 OUTLIER -83.73 -19.52 35.03 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.505 1.128 . . . . 72.109999999999999 109.344 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.907 HD22 HG11 ' A' ' 206' ' ' VAL . 87.7 mt -79.33 -20.17 48.52 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.477 1.111 . . . . 51.509999999999998 109.234 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' GLN . . . . . 0.512 ' O ' ' CD ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -89.47 -11.98 41.45 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.475 1.109 . . . . 64.510000000000005 110.247 -179.96 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ASP . . . . . 0.468 ' O ' ' C ' ' A' ' 103' ' ' ASP . 29.2 t70 -116.07 -57.21 2.24 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.434 1.084 . . . . 73.150000000000006 109.342 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.542 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 7.2 t0 -34.41 -65.68 0.19 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.516 1.135 . . . . 70.129999999999995 109.347 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.455 ' HE1' HD23 ' A' ' 100' ' ' LEU . 4.3 m-85 -102.63 -31.88 10.16 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.475 1.109 . . . . 64.439999999999998 111.02 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.473 ' O ' ' N ' ' A' ' 107' ' ' LYS . . . 108.57 28.47 4.55 Favored Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.488 1.118 . . . . 62.119999999999997 110.987 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.657 HD12 ' HZ1' ' A' ' 80' ' ' LYS . 24.1 mm -65.29 73.89 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.479 0.752 . . . . 70.299999999999997 109.325 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.539 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.8 OUTLIER -127.45 156.34 75.26 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.504 1.127 . . . . 73.420000000000002 109.295 -179.936 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.1 Cg_endo -75.05 132.14 26.57 Favored 'Cis proline' 0 C--N 1.361 1.192 0 C-N-CA 120.98 -2.508 . . . . 74.409999999999997 110.991 0.091 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' GLY . . . . . 0.434 ' N ' ' HA ' ' A' ' 107' ' ' LYS . . . -107.02 117.19 5.23 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.444 1.09 . . . . 74.230000000000004 110.959 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.488 HG22 HD11 ' A' ' 79' ' ' LEU . 1.0 OUTLIER -131.38 150.3 34.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 O-C-N 124.484 0.756 . . . . 71.319999999999993 109.307 179.957 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ILE . . . . . 0.695 HD12 ' NE2' ' A' ' 85' ' ' HIS . 45.3 pt -99.2 -175.56 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.499 1.125 . . . . 72.109999999999999 109.322 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.839 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 0.4 OUTLIER -81.82 -18.7 43.08 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.542 1.151 . . . . 71.319999999999993 111.059 179.994 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.87 -3.61 51.51 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.481 1.113 . . . . 74.129999999999995 109.266 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.422 ' CB ' HG12 ' A' ' 110' ' ' ILE . 3.6 mt-10 -106.82 -24.85 11.93 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.532 1.145 . . . . 63.210000000000001 110.321 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 15.0 ttm -55.9 110.97 2.64 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.509 1.13 . . . . 71.439999999999998 110.993 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo . . . . . 0 C--N 1.361 1.188 0 O-C-N 124.497 1.788 . . . . 64.239999999999995 110.935 -179.927 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.788 HD12 ' N ' ' A' ' 126' ' ' ASP . 0.9 OUTLIER . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 109.26 -0.644 . . . . 64.109999999999999 109.26 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.788 ' N ' HD12 ' A' ' 125' ' ' LEU . 7.4 p-10 -78.85 -14.55 59.18 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.486 1.116 . . . . 73.230000000000004 109.322 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -58.15 -52.59 64.91 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.51 1.131 . . . . 54.0 109.309 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.839 ' HB2' ' CE1' ' A' ' 112' ' ' PHE . . . -67.4 -14.52 63.0 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.48 1.112 . . . . 44.149999999999999 109.304 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.647 HG12 ' O ' ' A' ' 129' ' ' VAL . 52.0 t -87.46 11.67 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.539 1.149 . . . . 61.399999999999999 109.25 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -141.09 124.51 16.67 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.556 1.16 . . . . 63.299999999999997 109.288 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 90.84 41.57 5.29 Favored Glycine 0 CA--C 1.53 0.987 0 O-C-N 124.608 1.193 . . . . 74.010000000000005 111.003 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.77 166.23 24.5 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.491 0.759 . . . . 51.439999999999998 110.021 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.77 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -87.58 -56.46 3.34 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.464 1.102 . . . . 73.209999999999994 109.296 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.77 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.8 m-90 -131.21 177.23 7.62 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.973 -1.121 . . . . 71.140000000000001 107.973 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 135' ' ' THR . . . . . 0.657 HG22 ' CG1' ' A' ' 82' ' ' VAL . 25.9 p -152.4 132.62 13.58 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.462 1.101 . . . . 62.130000000000003 110.454 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.647 ' O ' HD22 ' A' ' 137' ' ' LEU . 1.3 mp -84.32 140.78 15.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.464 1.102 . . . . 75.129999999999995 109.274 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.647 HD22 ' O ' ' A' ' 136' ' ' ILE . 2.8 mm? -126.73 96.71 4.74 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.609 1.193 . . . . 44.219999999999999 109.283 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.775 HD21 ' HB2' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.65 97.85 0.11 Allowed 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.47 1.106 . . . . 74.150000000000006 109.302 179.988 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.609 HD21 HG23 ' A' ' 185' ' ' THR . 3.2 tp -66.84 103.72 1.19 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.577 1.173 . . . . 65.540000000000006 109.321 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 140' ' ' THR . . . . . 0.598 ' C ' HD23 ' A' ' 180' ' ' LEU . 2.7 m -121.39 177.85 5.03 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.482 1.114 . . . . 62.420000000000002 110.409 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 141' ' ' GLU . . . . . 0.483 ' H ' HG22 ' A' ' 140' ' ' THR . 2.2 mp0 -83.83 -35.9 23.88 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.431 1.082 . . . . 75.519999999999996 110.298 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 142' ' ' ASN . . . . . 0.44 ' OD1' ' N ' ' A' ' 143' ' ' PHE . 15.3 p30 -85.79 -41.92 14.64 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.47 1.106 . . . . 74.340000000000003 109.286 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.52 ' CE1' HG21 ' A' ' 147' ' ' THR . 61.3 t80 -63.67 -21.39 66.36 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.462 1.102 . . . . 70.010000000000005 110.974 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.699 ' C ' HD13 ' A' ' 144' ' ' LEU . 2.0 tm? -63.88 -67.52 0.42 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.504 1.127 . . . . 65.420000000000002 109.337 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 52.6 mmm-85 -56.71 -17.41 8.84 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.558 1.161 . . . . 72.150000000000006 110.292 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.19 -66.5 0.72 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.482 1.113 . . . . 74.129999999999995 109.296 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.562 ' HB ' ' CZ ' ' A' ' 151' ' ' PHE . 2.5 p -68.29 -53.94 20.93 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.494 1.121 . . . . 73.099999999999994 110.376 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 3.6 t-105 -43.31 -41.99 4.28 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.482 1.114 . . . . 64.329999999999998 108.025 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 149' ' ' CYS . . . . . 0.453 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 41.7 t -71.94 -45.43 61.13 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.53 1.144 . . . . 72.329999999999998 108.244 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 150' ' ' ASN . . . . . 0.434 ' HB3' HD21 ' A' ' 125' ' ' LEU . 27.9 m120 -52.42 -30.83 31.4 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.427 1.079 . . . . 64.329999999999998 109.299 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 1.09 ' CE1' HD12 ' A' ' 157' ' ' LEU . 7.7 m-30 -73.14 -36.11 66.62 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.546 1.153 . . . . 74.099999999999994 110.969 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -65.05 -29.95 70.88 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.519 1.137 . . . . 61.439999999999998 110.317 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -93.64 -32.05 14.23 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.452 1.095 . . . . 73.200000000000003 111.029 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.42 ' CD2' ' HB3' ' A' ' 156' ' ' SER . 1.6 t80 -132.76 97.92 4.18 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.537 1.148 . . . . 75.25 111.037 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 2.9 t -65.64 -10.99 40.86 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.468 1.105 . . . . 73.530000000000001 110.409 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 156' ' ' SER . . . . . 0.42 ' HB3' ' CD2' ' A' ' 154' ' ' TYR . 3.4 t -52.02 -36.01 48.67 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.46 1.1 . . . . 74.439999999999998 110.042 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 1.09 HD12 ' CE1' ' A' ' 151' ' ' PHE . 1.7 tm? -87.66 -28.92 21.54 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.467 1.105 . . . . 70.5 109.21 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 158' ' ' MET . . . . . 0.769 ' HE2' HG21 ' A' ' 161' ' ' VAL . 1.6 tpt -62.85 -16.52 58.93 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.498 1.124 . . . . 74.530000000000001 110.992 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -90.63 -10.8 41.96 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.546 1.154 . . . . 74.430000000000007 109.311 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 160' ' ' SER . . . . . 0.641 ' CB ' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -81.46 -38.57 26.18 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.529 1.143 . . . . 74.129999999999995 110.008 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 161' ' ' VAL . . . . . 0.769 HG21 ' HE2' ' A' ' 158' ' ' MET . 4.1 m -59.85 -18.28 15.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.485 1.116 . . . . 71.019999999999996 109.317 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -63.91 -13.16 43.28 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.521 1.138 . . . . 70.030000000000001 109.258 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.64 ' HG3' HG23 ' A' ' 192' ' ' ILE . 4.8 mmm180 63.02 39.79 9.81 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.467 1.104 . . . . 54.520000000000003 110.344 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -52.51 -174.1 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.553 1.158 . . . . 72.540000000000006 110.333 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -127.34 50.7 1.97 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.49 1.119 . . . . 74.040000000000006 109.618 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.424 ' HA ' HG21 ' A' ' 221' ' ' ILE . 0.7 OUTLIER -98.43 -174.37 2.8 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.55 1.156 . . . . 70.019999999999996 109.344 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 167' ' ' TYR . . . . . 0.603 ' CD1' ' N ' ' A' ' 168' ' ' ASN . 26.4 p90 -54.81 -42.68 72.15 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.543 1.152 . . . . 70.299999999999997 111.024 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 168' ' ' ASN . . . . . 0.603 ' N ' ' CD1' ' A' ' 167' ' ' TYR . 11.9 p30 -98.05 134.94 40.44 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.411 1.07 . . . . 73.450000000000003 109.272 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.445 ' N ' ' O ' ' A' ' 133' ' ' ALA . 16.1 m -123.55 146.76 47.87 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.459 1.099 . . . . 63.130000000000003 109.968 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.641 HG21 ' CB ' ' A' ' 160' ' ' SER . 43.5 t -103.33 137.94 29.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 O-C-N 124.44 1.088 . . . . 61.140000000000001 109.314 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.612 HD13 ' O ' ' A' ' 170' ' ' VAL . 15.9 mm -141.86 104.99 5.76 Favored Pre-proline 0 C--N 1.325 -0.463 0 O-C-N 124.542 1.151 . . . . 53.43 109.283 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 172' ' ' PRO . . . . . 0.755 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.3 Cg_endo -74.96 106.2 2.23 Favored 'Trans proline' 0 C--N 1.36 1.167 0 O-C-N 124.478 1.778 . . . . 72.329999999999998 111.015 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 173' ' ' MET . . . . . 0.477 ' HE3' HD12 ' A' ' 195' ' ' LEU . 4.4 ttt -94.06 154.27 17.71 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.437 1.086 . . . . 62.039999999999999 111.034 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 174' ' ' ARG . . . . . 0.442 ' N ' ' HG2' ' A' ' 173' ' ' MET . 0.5 OUTLIER -113.66 116.46 45.68 Favored Pre-proline 0 C--N 1.325 -0.475 0 O-C-N 124.533 1.145 . . . . 73.420000000000002 110.265 -179.952 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 175' ' ' PRO . . . . . 0.572 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.4 Cg_endo -74.98 153.65 42.0 Favored 'Trans proline' 0 C--N 1.359 1.129 0 O-C-N 124.476 1.777 . . . . 64.019999999999996 110.948 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 176' ' ' LEU . . . . . 0.837 ' N ' HD13 ' A' ' 176' ' ' LEU . 0.0 OUTLIER -91.25 -39.32 12.15 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.508 1.13 . . . . 72.430000000000007 109.293 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -72.61 -23.38 60.93 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.509 1.13 . . . . 65.140000000000001 109.258 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 178' ' ' ASN . . . . . 0.491 ' OD1' HG23 ' A' ' 140' ' ' THR . 1.1 m-80 -110.75 108.21 57.95 Favored Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.493 1.121 . . . . 73.319999999999993 109.339 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.96 125.23 9.21 Favored 'Trans proline' 0 C--N 1.36 1.134 0 O-C-N 124.511 1.795 . . . . 63.329999999999998 110.971 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.598 HD23 ' C ' ' A' ' 140' ' ' THR . 1.2 tm? -140.68 97.02 7.41 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.455 1.097 . . . . 72.430000000000007 109.327 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.02 153.77 41.94 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.567 1.825 . . . . 51.340000000000003 111.004 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.44 -29.06 61.19 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.577 1.173 . . . . 74.030000000000001 110.323 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -58.71 -31.62 68.42 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.555 1.159 . . . . 73.049999999999997 110.306 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 -99.41 13.24 33.95 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.463 1.102 . . . . 64.25 110.298 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 185' ' ' THR . . . . . 0.609 HG23 HD21 ' A' ' 139' ' ' LEU . 46.5 m -106.53 144.13 28.39 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.537 1.148 . . . . 70.040000000000006 110.384 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 186' ' ' PRO . . . . . 0.683 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -75.04 146.04 32.04 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.527 1.804 . . . . 74.230000000000004 111.012 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 187' ' ' PHE . . . . . 0.433 ' O ' HG23 ' A' ' 191' ' ' THR . 14.0 p90 -62.4 -11.94 18.64 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.475 1.109 . . . . 72.409999999999997 110.994 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 188' ' ' ALA . . . . . 0.474 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -87.2 -53.79 4.66 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.586 1.179 . . . . 64.349999999999994 109.23 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.683 HD12 ' CG ' ' A' ' 186' ' ' PRO . 22.4 mt -74.19 -17.67 60.87 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.496 1.123 . . . . 73.329999999999998 109.267 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 190' ' ' GLN . . . . . 0.48 ' CG ' ' O ' ' A' ' 190' ' ' GLN . 6.8 tt0 -86.41 0.69 53.54 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.443 1.089 . . . . 60.350000000000001 110.331 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 191' ' ' THR . . . . . 0.433 HG23 ' O ' ' A' ' 187' ' ' PHE . 34.1 p -127.87 16.18 6.86 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.488 1.117 . . . . 71.409999999999997 110.383 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.64 HG23 ' HG3' ' A' ' 163' ' ' ARG . 19.1 mt -117.08 152.12 18.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.481 1.113 . . . . 64.010000000000005 109.335 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 21.9 t30 -61.73 97.86 0.08 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.478 1.111 . . . . 73.310000000000002 109.343 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 194' ' ' ALA . . . . . 0.755 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -89.39 164.85 14.7 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.465 1.103 . . . . 45.329999999999998 109.28 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 195' ' ' LEU . . . . . 0.756 HD23 HD12 ' A' ' 209' ' ' ILE . 0.3 OUTLIER -103.09 126.4 50.25 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.429 1.081 . . . . 63.530000000000001 109.368 179.952 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -103.54 128.98 50.67 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.503 1.127 . . . . 73.239999999999995 110.289 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.754 ' HG2' HD21 ' A' ' 176' ' ' LEU . 4.2 tt0 -106.75 -30.48 8.92 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.499 1.124 . . . . 63.509999999999998 110.256 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 198' ' ' GLU . . . . . 0.613 ' HG2' HD12 ' A' ' 176' ' ' LEU . 4.0 pt-20 -92.51 25.24 3.1 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.511 1.132 . . . . 73.209999999999994 110.342 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.24 151.28 51.64 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.561 1.163 . . . . 63.409999999999997 109.987 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 9.9 tpt85 -67.62 -11.88 59.19 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.461 1.101 . . . . 72.219999999999999 110.312 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -93.62 15.37 63.2 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.503 1.127 . . . . 73.109999999999999 110.966 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 202' ' ' PHE . . . . . 0.791 ' CZ ' HD21 ' A' ' 100' ' ' LEU . 8.5 t80 -66.29 -38.84 23.27 Favored Pre-proline 0 C--N 1.325 -0.463 0 O-C-N 124.443 0.731 . . . . 64.400000000000006 111.046 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 203' ' ' PRO . . . . . 0.683 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -74.95 -42.04 0.58 Allowed 'Trans proline' 0 C--N 1.36 1.162 0 O-C-N 124.556 1.819 . . . . 74.140000000000001 110.944 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -48.38 -63.13 1.16 Allowed 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.529 1.143 . . . . 74.400000000000006 110.406 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 205' ' ' GLN . . . . . 0.448 ' O ' ' N ' ' A' ' 209' ' ' ILE . 7.7 mt-30 -55.46 -55.48 31.22 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.468 1.105 . . . . 64.040000000000006 110.312 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 206' ' ' VAL . . . . . 0.907 HG11 HD22 ' A' ' 100' ' ' LEU . 75.4 t -47.24 -31.07 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.541 1.151 . . . . 70.129999999999995 109.256 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -81.15 -39.05 26.15 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.515 1.134 . . . . 51.119999999999997 110.266 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -77.03 -66.64 0.8 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.475 1.11 . . . . 72.319999999999993 110.34 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 209' ' ' ILE . . . . . 0.756 HD12 HD23 ' A' ' 195' ' ' LEU . 92.9 mt -44.53 -47.23 2.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.487 1.117 . . . . 74.329999999999998 109.301 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 210' ' ' PHE . . . . . 0.713 ' CD1' HG22 ' A' ' 209' ' ' ILE . 0.7 OUTLIER -107.66 66.87 0.67 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.466 1.104 . . . . 75.439999999999998 110.985 179.99 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 211' ' ' GLN . . . . . 0.541 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.4 OUTLIER -110.8 146.3 36.64 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.547 1.154 . . . . 65.349999999999994 110.318 179.953 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 212' ' ' GLU . . . . . 0.441 ' O ' ' N ' ' A' ' 215' ' ' TYR . 29.6 tt0 -48.85 -55.18 12.4 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.552 1.157 . . . . 52.229999999999997 110.351 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.04 -24.6 1.63 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.449 1.093 . . . . 52.340000000000003 109.995 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.541 HG23 ' HG2' ' A' ' 211' ' ' GLN . 40.3 t -96.22 -26.45 4.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.585 1.178 . . . . 75.310000000000002 109.29 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 215' ' ' TYR . . . . . 0.441 ' N ' ' O ' ' A' ' 212' ' ' GLU . 4.2 t80 -67.46 -34.18 76.66 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.549 1.155 . . . . 73.340000000000003 111.021 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 216' ' ' LYS . . . . . 0.419 ' O ' ' CB ' ' A' ' 220' ' ' THR . 41.3 mmtt -54.32 -59.45 4.66 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.493 1.121 . . . . 74.319999999999993 109.255 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 217' ' ' THR . . . . . 0.868 HG22 HD11 ' A' ' 221' ' ' ILE . 7.6 m -52.78 -66.51 0.37 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.444 1.09 . . . . 73.549999999999997 110.406 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 218' ' ' GLN . . . . . 0.406 ' HA ' HD12 ' A' ' 221' ' ' ILE . 2.0 mp0 -39.74 -65.33 0.4 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.508 1.13 . . . . 73.319999999999993 110.271 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -55.51 -30.44 60.69 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.491 1.12 . . . . 65.329999999999998 110.249 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 220' ' ' THR . . . . . 0.432 ' N ' ' O ' ' A' ' 217' ' ' THR . 2.1 m -76.63 -20.59 56.54 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.49 1.119 . . . . 71.530000000000001 110.393 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 221' ' ' ILE . . . . . 0.868 HD11 HG22 ' A' ' 217' ' ' THR . 15.2 mt -90.15 -28.46 5.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.523 1.14 . . . . 61.299999999999997 109.317 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 222' ' ' TRP . . . . . 0.595 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 23.9 t90 -69.62 -29.22 66.66 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.514 1.134 . . . . 75.430000000000007 107.972 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 223' ' ' LYS . . . . . 0.446 ' HG3' ' N ' ' A' ' 224' ' ' GLU . 0.5 OUTLIER -86.85 -27.91 23.2 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.473 1.108 . . . . 71.329999999999998 109.302 -179.976 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 224' ' ' GLU . . . . . 0.446 ' N ' ' HG3' ' A' ' 223' ' ' LYS . 1.6 mm-40 . . . . . 0 C--N 1.326 -0.443 0 O-C-N 124.5 1.125 . . . . 54.539999999999999 110.273 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.587 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.2 p . . . . . 0 N--CA 1.454 -0.234 0 N-CA-C 109.249 -0.648 . . . . 73.409999999999997 109.249 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.482 ' CE2' ' OH ' ' A' ' 215' ' ' TYR . 13.7 t80 -88.71 25.41 1.75 Allowed 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.47 1.106 . . . . 72.019999999999996 111.019 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.676 HD11 HG22 ' A' ' 110' ' ' ILE . 4.7 tp -39.79 158.33 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.474 1.109 . . . . 75.0 109.298 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.633 ' NZ ' HG23 ' A' ' 106' ' ' ILE . 6.9 ttpt -104.97 -51.86 2.96 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.597 1.185 . . . . 70.349999999999994 109.261 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.621 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.4 OUTLIER -165.46 132.69 2.91 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.461 1.101 . . . . 75.109999999999999 111.039 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.533 HG22 ' N ' ' A' ' 83' ' ' ILE . 2.7 p -86.25 166.8 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.489 1.118 . . . . 71.319999999999993 109.324 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.766 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.0 mp -129.64 93.18 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.51 1.132 . . . . 71.519999999999996 109.27 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.913 HD11 ' HB3' ' A' ' 128' ' ' ALA . 5.0 mt -70.16 116.19 10.23 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.513 1.133 . . . . 73.5 109.396 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.596 ' CE1' ' OG1' ' A' ' 90' ' ' THR . 0.0 OUTLIER -134.15 174.36 10.59 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.492 1.12 . . . . 74.450000000000003 109.578 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.454 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -113.22 164.4 13.58 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.609 1.193 . . . . 75.129999999999995 109.263 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.451 ' CG ' ' O ' ' A' ' 87' ' ' GLU . 16.7 tt0 -68.41 -7.64 33.38 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.584 1.177 . . . . 72.549999999999997 110.318 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -89.54 -26.74 20.7 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.522 1.139 . . . . 73.219999999999999 109.286 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.502 ' O ' ' CD2' ' A' ' 138' ' ' LEU . 1.3 m-20 -142.56 44.25 1.62 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.526 1.142 . . . . 74.030000000000001 109.314 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.596 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -76.82 -33.69 57.95 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.435 1.085 . . . . 73.040000000000006 110.385 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -73.89 -41.33 62.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.479 1.112 . . . . 54.439999999999998 109.31 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.405 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 4.8 tp10 -58.65 -52.36 66.03 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.566 1.167 . . . . 73.409999999999997 110.355 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.953 ' HB2' ' CD2' ' A' ' 138' ' ' LEU . . . -59.25 -25.79 64.35 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.527 1.142 . . . . 73.129999999999995 109.296 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.952 HD22 ' O ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -82.26 -34.57 28.7 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.533 1.145 . . . . 71.209999999999994 109.321 179.919 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.614 ' N ' HD13 ' A' ' 94' ' ' LEU . 6.0 tpt180 -55.58 -29.6 59.34 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.486 1.116 . . . . 70.5 110.294 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.885 HG21 ' HE1' ' A' ' 173' ' ' MET . 1.7 t -83.1 -65.1 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.547 1.155 . . . . 51.329999999999998 109.33 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.73 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -40.27 -27.69 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.47 1.106 . . . . 64.030000000000001 110.29 179.995 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.449 ' N ' ' C ' ' A' ' 96' ' ' VAL . 2.0 t-20 -70.53 -54.57 11.65 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.469 1.106 . . . . 72.239999999999995 109.253 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.846 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -67.74 -22.88 65.21 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.464 1.102 . . . . 64.329999999999998 109.334 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.846 ' N ' HD23 ' A' ' 99' ' ' LEU . 28.5 mt -61.43 -57.96 10.09 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.539 1.149 . . . . 73.140000000000001 109.305 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -75.27 59.97 1.06 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.489 1.118 . . . . 74.109999999999999 110.341 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.4 t70 177.99 -65.46 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.528 1.143 . . . . 73.409999999999997 109.298 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.565 ' OD1' ' CE1' ' A' ' 104' ' ' PHE . 9.2 t70 -47.24 -50.26 21.56 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.484 1.115 . . . . 73.120000000000005 109.312 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.566 ' CZ ' HG11 ' A' ' 206' ' ' VAL . 2.0 m-85 -114.55 -26.51 7.88 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.416 1.073 . . . . 64.239999999999995 111.069 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.47 45.92 2.65 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.523 1.139 . . . . 33.140000000000001 110.99 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.633 HG23 ' NZ ' ' A' ' 80' ' ' LYS . 4.9 mm -86.91 84.13 2.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.436 0.727 . . . . 72.239999999999995 109.379 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.538 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -132.71 156.7 79.79 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.444 1.09 . . . . 74.040000000000006 109.271 179.999 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.538 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.95 152.45 98.23 Favored 'Cis proline' 0 C--N 1.36 1.152 0 C-N-CA 120.948 -2.522 . . . . 70.329999999999998 111.006 -0.053 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.82 138.34 10.23 Favored Glycine 0 CA--C 1.529 0.921 0 O-C-N 124.531 1.145 . . . . 73.439999999999998 111.038 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.676 HG22 HD11 ' A' ' 79' ' ' LEU . 1.8 tt -156.01 150.54 10.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.415 0.715 . . . . 73.129999999999995 109.338 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ILE . . . . . 0.923 HD13 ' HB2' ' A' ' 94' ' ' LEU . 9.8 pt -101.35 168.7 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.525 1.141 . . . . 64.319999999999993 109.293 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.505 ' HE1' ' HB2' ' A' ' 128' ' ' ALA . 1.8 t80 -67.18 -19.8 65.63 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.513 1.133 . . . . 74.439999999999998 111.073 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.626 ' HB3' HD12 ' A' ' 111' ' ' ILE . . . -87.2 -14.29 41.54 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.519 1.137 . . . . 64.129999999999995 109.292 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -102.85 -19.11 14.79 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.446 1.091 . . . . 71.040000000000006 110.287 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.461 ' CG ' ' HD2' ' A' ' 116' ' ' PRO . 6.5 ttm -46.56 144.05 3.67 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.512 1.132 . . . . 54.409999999999997 111.042 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.461 ' HD2' ' CG ' ' A' ' 115' ' ' MET . 18.4 Cg_endo . . . . . 0 C--N 1.359 1.119 0 O-C-N 124.462 1.77 . . . . 62.039999999999999 111.0 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.773 HD11 ' CD2' ' A' ' 157' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.453 -0.305 0 N-CA-C 109.349 -0.612 . . . . 73.310000000000002 109.349 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.423 ' OD2' ' N ' ' A' ' 127' ' ' ASP . 6.9 p-10 -55.99 -21.57 21.92 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.46 1.1 . . . . 71.420000000000002 109.321 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.423 ' N ' ' OD2' ' A' ' 126' ' ' ASP . 1.0 OUTLIER -53.97 -52.89 59.28 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.455 1.097 . . . . 72.349999999999994 109.275 179.984 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.913 ' HB3' HD11 ' A' ' 84' ' ' LEU . . . -62.94 -26.77 68.98 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.438 1.086 . . . . 74.430000000000007 109.323 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.757 ' HA ' HG21 ' A' ' 135' ' ' THR . 3.0 t -78.26 -0.56 3.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.51 1.131 . . . . 71.430000000000007 109.263 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -126.27 126.02 43.3 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.535 1.147 . . . . 64.329999999999998 109.282 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 87.29 49.65 3.89 Favored Glycine 0 CA--C 1.53 0.978 0 O-C-N 124.489 1.118 . . . . 52.229999999999997 111.002 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' SER . . . . . 0.403 ' O ' ' O ' ' A' ' 167' ' ' TYR . 0.3 OUTLIER -163.71 177.39 8.73 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.498 0.763 . . . . 70.209999999999994 109.988 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.81 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -104.42 -25.58 12.76 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.519 1.137 . . . . 71.209999999999994 109.268 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.81 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 4.1 m-90 -160.68 153.67 21.39 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.548 1.155 . . . . 70.140000000000001 107.995 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 135' ' ' THR . . . . . 0.757 HG21 ' HA ' ' A' ' 129' ' ' VAL . 2.0 p -123.03 128.13 49.74 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.484 1.115 . . . . 72.150000000000006 110.338 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.766 ' HB ' HG23 ' A' ' 83' ' ' ILE . 23.9 mm -84.19 134.2 27.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.528 1.143 . . . . 74.409999999999997 109.296 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.51 HD23 ' O ' ' A' ' 136' ' ' ILE . 20.0 mt -127.91 97.69 4.89 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.49 1.119 . . . . 75.439999999999998 109.307 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.953 ' CD2' ' HB2' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -62.33 99.3 0.13 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.465 1.103 . . . . 65.219999999999999 109.329 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.647 HD11 HD13 ' A' ' 189' ' ' LEU . 0.2 OUTLIER -70.76 105.05 3.06 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.405 1.066 . . . . 74.219999999999999 109.311 -179.977 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 140' ' ' THR . . . . . 0.691 HG22 ' H ' ' A' ' 141' ' ' GLU . 13.6 m -132.01 -177.58 4.51 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.498 1.124 . . . . 73.329999999999998 110.357 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 141' ' ' GLU . . . . . 0.691 ' H ' HG22 ' A' ' 140' ' ' THR . 3.8 mp0 -81.67 -44.44 17.15 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.511 1.132 . . . . 75.129999999999995 110.323 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -82.87 -16.8 46.19 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.536 1.147 . . . . 51.439999999999998 109.327 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.454 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 16.2 t80 -90.06 -19.74 24.02 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.491 1.119 . . . . 71.439999999999998 110.978 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.7 ' C ' HD13 ' A' ' 144' ' ' LEU . 2.0 tm? -61.33 -67.87 0.37 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.537 1.148 . . . . 62.109999999999999 109.298 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.45 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 10.9 mmt85 -62.87 -13.29 32.25 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.5 1.125 . . . . 72.209999999999994 110.253 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -68.84 -53.98 18.36 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.497 1.123 . . . . 71.140000000000001 109.252 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.471 ' HB ' ' CE1' ' A' ' 151' ' ' PHE . 2.7 p -88.66 -50.57 6.17 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.508 1.13 . . . . 65.109999999999999 110.348 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.62 ' CH2' ' CB ' ' A' ' 186' ' ' PRO . 3.4 t-105 -44.02 -32.39 1.15 Allowed 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.496 1.122 . . . . 73.439999999999998 108.004 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 149' ' ' CYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 42.2 t -81.48 -45.48 15.93 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.535 1.147 . . . . 71.450000000000003 108.32 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 150' ' ' ASN . . . . . 0.601 ' O ' ' CD2' ' A' ' 154' ' ' TYR . 50.5 m-20 -62.99 -14.17 44.41 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.559 1.162 . . . . 73.010000000000005 109.304 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.561 ' CZ ' ' HG ' ' A' ' 157' ' ' LEU . 3.6 m-30 -80.16 -57.21 3.73 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.461 1.1 . . . . 74.450000000000003 110.934 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -47.8 -32.39 5.99 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.466 1.104 . . . . 70.530000000000001 110.253 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.446 ' HB3' ' CD1' ' A' ' 154' ' ' TYR . 0.4 OUTLIER -83.97 -37.08 22.71 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.456 1.097 . . . . 71.340000000000003 110.994 179.973 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.601 ' CD2' ' O ' ' A' ' 150' ' ' ASN . 1.0 OUTLIER -119.16 70.78 0.84 Allowed 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.44 1.088 . . . . 75.019999999999996 111.022 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 11.7 t -43.85 -26.5 0.27 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.544 1.152 . . . . 74.140000000000001 110.4 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 156' ' ' SER . . . . . 0.415 ' N ' ' C ' ' A' ' 154' ' ' TYR . 3.0 t -45.07 -44.42 10.27 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.507 1.129 . . . . 70.430000000000007 109.99 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.773 ' CD2' HD11 ' A' ' 125' ' ' LEU . 2.2 tp -69.04 -38.62 79.26 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.55 1.156 . . . . 61.329999999999998 109.31 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 158' ' ' MET . . . . . 0.593 ' O ' HG22 ' A' ' 161' ' ' VAL . 0.0 OUTLIER -62.57 -16.6 57.03 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.455 1.097 . . . . 74.409999999999997 110.991 -179.978 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 159' ' ' ASN . . . . . 0.46 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 82.6 m-20 -93.54 -9.66 37.48 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.425 1.078 . . . . 41.32 109.357 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 160' ' ' SER . . . . . 0.948 ' OG ' HG21 ' A' ' 170' ' ' VAL . 1.2 p -82.49 -24.11 34.34 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.5 1.125 . . . . 71.430000000000007 109.965 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 161' ' ' VAL . . . . . 0.798 ' O ' HD11 ' A' ' 192' ' ' ILE . 3.6 m -69.38 -15.7 19.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.497 1.123 . . . . 73.239999999999995 109.249 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 162' ' ' ASN . . . . . 0.45 ' CB ' ' OE1' ' A' ' 164' ' ' GLN . 4.6 m120 -65.87 -9.8 32.45 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 75.519999999999996 109.326 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.476 ' HD3' HG23 ' A' ' 192' ' ' ILE . 5.3 mmm180 67.87 53.88 0.65 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.471 1.107 . . . . 74.450000000000003 110.313 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 164' ' ' GLN . . . . . 0.693 ' H ' ' NE2' ' A' ' 164' ' ' GLN . 1.8 mp0 -51.26 -176.55 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.503 1.127 . . . . 51.130000000000003 110.371 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 20.6 m80 -134.76 19.69 3.54 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.424 1.078 . . . . 74.109999999999999 109.603 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.411 ' HA ' HG21 ' A' ' 221' ' ' ILE . 0.0 OUTLIER -78.71 -155.94 0.09 Allowed 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.488 1.117 . . . . 64.400000000000006 109.274 -179.944 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 167' ' ' TYR . . . . . 0.53 ' CD2' ' OD1' ' A' ' 168' ' ' ASN . 55.3 p90 -88.86 37.41 0.84 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.527 1.142 . . . . 75.299999999999997 110.944 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 168' ' ' ASN . . . . . 0.53 ' OD1' ' CD2' ' A' ' 167' ' ' TYR . 9.7 m120 -170.09 122.19 0.67 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.495 1.122 . . . . 73.310000000000002 109.333 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.522 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 2.9 m -114.84 173.84 6.27 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.508 1.13 . . . . 61.140000000000001 110.057 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.948 HG21 ' OG ' ' A' ' 160' ' ' SER . 51.1 t -128.53 119.94 51.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.516 1.135 . . . . 64.439999999999998 109.343 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.671 HD13 ' O ' ' A' ' 170' ' ' VAL . 35.2 mm -134.18 93.44 19.62 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.485 1.116 . . . . 63.25 109.271 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 172' ' ' PRO . . . . . 0.818 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.07 107.93 2.6 Favored 'Trans proline' 0 C--N 1.361 1.209 0 O-C-N 124.468 1.773 . . . . 64.099999999999994 110.967 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 173' ' ' MET . . . . . 0.885 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.0 ttt -80.66 160.09 25.13 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.534 1.146 . . . . 64.030000000000001 110.985 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 174' ' ' ARG . . . . . 0.417 ' N ' ' HG2' ' A' ' 173' ' ' MET . 69.4 mtt180 -116.68 128.44 26.01 Favored Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.513 1.133 . . . . 73.150000000000006 110.292 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 175' ' ' PRO . . . . . 0.646 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.4 Cg_endo -74.98 152.25 40.63 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.566 1.824 . . . . 74.239999999999995 111.013 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 176' ' ' LEU . . . . . 0.822 ' N ' HD13 ' A' ' 176' ' ' LEU . 0.0 OUTLIER -93.93 -44.54 8.03 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.482 1.114 . . . . 74.409999999999997 109.34 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -72.78 -26.8 61.66 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.479 1.112 . . . . 74.219999999999999 109.361 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -107.12 103.45 48.06 Favored Pre-proline 0 C--N 1.325 -0.474 0 O-C-N 124.462 1.101 . . . . 74.230000000000004 109.311 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 121.33 6.52 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.468 1.772 . . . . 43.229999999999997 110.997 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.478 HD22 ' HA ' ' A' ' 180' ' ' LEU . 0.8 OUTLIER -131.22 98.68 18.39 Favored Pre-proline 0 C--N 1.325 -0.481 0 O-C-N 124.532 1.145 . . . . 52.43 109.35 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 181' ' ' PRO . . . . . 0.447 ' HG2' ' CG ' ' A' ' 183' ' ' GLU . 18.2 Cg_endo -75.01 163.41 35.36 Favored 'Trans proline' 0 C--N 1.359 1.129 0 O-C-N 124.46 1.769 . . . . 60.509999999999998 110.983 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.47 -33.95 66.43 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.528 1.142 . . . . 71.510000000000005 110.278 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 183' ' ' GLU . . . . . 0.447 ' CG ' ' HG2' ' A' ' 181' ' ' PRO . 2.5 pt-20 -50.0 -23.23 1.91 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.529 1.143 . . . . 73.5 110.306 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 184' ' ' ARG . . . . . 0.458 ' HD3' ' N ' ' A' ' 184' ' ' ARG . 1.9 mpt_? -105.22 -28.75 10.77 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.526 1.141 . . . . 74.239999999999995 110.309 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 185' ' ' THR . . . . . 0.573 HG23 ' CD2' ' A' ' 139' ' ' LEU . 17.7 m -71.2 143.84 88.92 Favored Pre-proline 0 C--N 1.325 -0.481 0 O-C-N 124.522 1.139 . . . . 60.210000000000001 110.44 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 186' ' ' PRO . . . . . 0.835 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.2 Cg_endo -75.03 155.88 42.83 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.446 1.761 . . . . 44.229999999999997 110.994 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 187' ' ' PHE . . . . . 0.512 ' O ' ' CG2' ' A' ' 191' ' ' THR . 36.3 p90 -69.79 -6.62 33.49 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.509 1.131 . . . . 45.32 111.038 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 188' ' ' ALA . . . . . 0.755 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -94.61 -53.09 4.02 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.592 1.182 . . . . 52.130000000000003 109.263 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.835 HD12 ' CG ' ' A' ' 186' ' ' PRO . 40.3 mt -68.49 -42.29 78.84 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.496 1.123 . . . . 70.109999999999999 109.278 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 190' ' ' GLN . . . . . 0.402 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 6.8 pt20 -64.38 -10.12 22.56 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.498 1.124 . . . . 73.340000000000003 110.321 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 191' ' ' THR . . . . . 0.512 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 25.5 p -112.64 12.49 19.78 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.435 1.084 . . . . 71.349999999999994 110.44 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.798 HD11 ' O ' ' A' ' 161' ' ' VAL . 3.1 mt -115.92 154.11 17.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.491 1.12 . . . . 71.120000000000005 109.309 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -65.39 76.28 0.06 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.508 1.13 . . . . 72.439999999999998 109.303 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 194' ' ' ALA . . . . . 0.818 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -70.78 161.91 30.08 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.533 1.145 . . . . 64.439999999999998 109.336 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 195' ' ' LEU . . . . . 0.677 HD12 ' CE ' ' A' ' 173' ' ' MET . 0.2 OUTLIER -96.57 128.91 43.95 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.561 1.163 . . . . 72.109999999999999 109.271 -179.981 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 196' ' ' GLU . . . . . 0.433 ' CB ' ' HB2' ' A' ' 199' ' ' SER . 0.7 OUTLIER -118.28 136.71 53.53 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.449 1.093 . . . . 74.010000000000005 110.313 179.994 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.819 ' OE2' HD21 ' A' ' 176' ' ' LEU . 0.7 OUTLIER -103.22 -37.34 7.73 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.434 1.084 . . . . 75.420000000000002 110.308 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 198' ' ' GLU . . . . . 0.644 ' HG3' HD12 ' A' ' 176' ' ' LEU . 3.4 mt-10 -80.19 -15.2 57.56 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 124.48 1.112 . . . . 73.349999999999994 110.313 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 199' ' ' SER . . . . . 0.433 ' HB2' ' CB ' ' A' ' 196' ' ' GLU . 7.5 t -68.21 159.57 30.9 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.527 1.142 . . . . 71.140000000000001 109.941 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -66.67 -48.37 69.55 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.477 1.11 . . . . 74.019999999999996 110.289 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -89.62 29.49 6.23 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.547 1.155 . . . . 65.129999999999995 110.994 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 202' ' ' PHE . . . . . 0.615 ' CD1' ' C ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -52.33 -47.36 93.01 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.487 0.757 . . . . 73.209999999999994 111.032 179.968 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 203' ' ' PRO . . . . . 0.658 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.2 Cg_endo -75.06 -27.48 9.88 Favored 'Trans proline' 0 C--N 1.36 1.143 0 O-C-N 124.432 1.754 . . . . 74.420000000000002 110.955 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -59.26 -53.9 52.99 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.49 1.118 . . . . 75.409999999999997 110.412 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 205' ' ' GLN . . . . . 0.407 ' O ' ' C ' ' A' ' 206' ' ' VAL . 13.3 mt-30 -56.02 -64.03 0.99 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.512 1.132 . . . . 70.5 110.274 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 206' ' ' VAL . . . . . 0.693 HG21 ' CD2' ' A' ' 100' ' ' LEU . 3.0 p -39.75 -40.43 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.442 1.089 . . . . 74.200000000000003 109.255 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.83 -63.96 0.96 Allowed 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.521 1.138 . . . . 74.140000000000001 110.227 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -54.68 -64.09 0.95 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.498 1.124 . . . . 72.239999999999995 110.305 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 209' ' ' ILE . . . . . 0.674 HD12 HD23 ' A' ' 195' ' ' LEU . 3.7 mt -42.44 -60.64 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.506 1.128 . . . . 71.340000000000003 109.336 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 210' ' ' PHE . . . . . 0.617 ' CD2' HG23 ' A' ' 206' ' ' VAL . 0.4 OUTLIER -101.05 70.09 1.33 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.524 1.14 . . . . 61.409999999999997 110.989 179.981 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.71 143.53 41.06 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.492 1.12 . . . . 74.239999999999995 110.331 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 212' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 215' ' ' TYR . 19.1 tt0 -49.03 -55.15 12.89 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.513 1.133 . . . . 74.239999999999995 110.322 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -46.38 -25.19 0.6 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.411 1.069 . . . . 71.409999999999997 109.966 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 8.6 t -94.81 -32.92 4.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.484 1.115 . . . . 70.219999999999999 109.341 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 215' ' ' TYR . . . . . 0.556 ' CE1' ' HG3' ' A' ' 80' ' ' LYS . 29.9 t80 -61.25 -19.65 61.94 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.552 1.158 . . . . 73.439999999999998 110.975 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 216' ' ' LYS . . . . . 0.423 ' N ' ' HD2' ' A' ' 216' ' ' LYS . 3.7 mmmt -62.5 -66.13 0.59 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.523 1.139 . . . . 62.130000000000003 109.33 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 217' ' ' THR . . . . . 0.84 HG22 HD11 ' A' ' 221' ' ' ILE . 1.9 m -48.93 -64.31 0.84 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.501 1.126 . . . . 70.239999999999995 110.379 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 218' ' ' GLN . . . . . 0.658 ' HA ' HD12 ' A' ' 221' ' ' ILE . 7.8 mp0 -43.02 -63.64 0.77 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.478 1.111 . . . . 70.540000000000006 110.279 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -50.41 -29.92 11.27 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.467 1.104 . . . . 61.210000000000001 110.29 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 220' ' ' THR . . . . . 0.406 ' HB ' ' O ' ' A' ' 217' ' ' THR . 0.9 OUTLIER -79.27 -29.77 42.71 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.531 1.144 . . . . 72.420000000000002 110.417 179.971 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 221' ' ' ILE . . . . . 0.84 HD11 HG22 ' A' ' 217' ' ' THR . 14.1 mt -76.83 -27.66 16.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.593 1.183 . . . . 71.209999999999994 109.301 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 222' ' ' TRP . . . . . 0.587 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 23.0 t90 -77.94 -55.3 5.42 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.564 1.165 . . . . 72.549999999999997 108.002 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -20.91 22.86 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.518 1.136 . . . . 71.400000000000006 109.34 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 81.5 mt-10 . . . . . 0 C--N 1.325 -0.463 0 O-C-N 124.559 1.162 . . . . 70.239999999999995 110.352 179.988 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 2.8 p . . . . . 0 N--CA 1.453 -0.287 0 N-CA-C 109.321 -0.622 . . . . 55.329999999999998 109.321 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -89.19 31.09 0.9 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.563 1.164 . . . . 73.200000000000003 111.032 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 24.6 tp -39.73 147.12 0.09 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.488 1.117 . . . . 52.210000000000001 109.28 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.44 ' CD ' ' O ' ' A' ' 107' ' ' LYS . 0.5 OUTLIER -89.82 -62.74 1.4 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.555 1.16 . . . . 75.109999999999999 109.321 179.945 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 1.076 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.9 OUTLIER -165.5 129.94 2.37 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.568 1.168 . . . . 51.539999999999999 110.992 179.953 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.676 ' CG1' HG22 ' A' ' 135' ' ' THR . 11.0 p -85.37 166.9 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.48 1.112 . . . . 75.049999999999997 109.298 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 1.076 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 1.7 mp -128.26 92.76 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.482 1.114 . . . . 65.430000000000007 109.311 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.899 HD11 ' HB3' ' A' ' 128' ' ' ALA . 3.3 mt -70.53 98.93 1.54 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.556 1.16 . . . . 72.340000000000003 109.216 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.631 ' CD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -120.32 174.4 6.54 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.448 1.093 . . . . 73.209999999999994 109.639 179.895 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.714 ' HB2' ' CD1' ' A' ' 143' ' ' PHE . . . -111.84 164.22 13.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.473 1.108 . . . . 62.43 109.263 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.442 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 14.4 tt0 -68.27 -8.78 42.36 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.488 1.118 . . . . 65.040000000000006 110.267 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -80.37 -38.45 30.39 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.516 1.135 . . . . 72.510000000000005 109.344 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.564 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -137.7 44.23 2.22 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.482 1.114 . . . . 44.109999999999999 109.349 -179.961 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.596 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -77.62 -30.09 52.15 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.465 1.103 . . . . 75.219999999999999 110.403 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.78 -25.53 61.2 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.555 1.159 . . . . 63.310000000000002 109.291 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.484 ' CG ' ' ND2' ' A' ' 177' ' ' ASN . 0.2 OUTLIER -76.62 -58.4 3.31 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.476 1.11 . . . . 73.040000000000006 110.277 -179.976 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.99 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -54.88 -19.56 6.87 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.479 1.112 . . . . 43.439999999999998 109.353 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.818 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -89.8 -50.07 6.26 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.501 1.125 . . . . 73.299999999999997 109.234 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.695 ' N ' HD13 ' A' ' 94' ' ' LEU . 38.4 tpt85 -46.8 -31.48 3.05 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.53 1.144 . . . . 75.129999999999995 110.326 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.588 HG13 ' N ' ' A' ' 97' ' ' GLN . 10.9 p -83.16 -55.85 6.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.525 1.141 . . . . 75.310000000000002 109.284 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.723 HE21 ' C ' ' A' ' 97' ' ' GLN . 0.0 OUTLIER -47.61 -24.08 0.81 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.497 1.123 . . . . 72.200000000000003 110.315 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.402 ' O ' ' HG3' ' A' ' 101' ' ' GLN . 0.1 OUTLIER -75.48 -38.56 59.47 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.464 1.102 . . . . 63.140000000000001 109.345 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.737 HD23 ' C ' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -84.63 -19.3 33.16 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.418 1.074 . . . . 74.510000000000005 109.353 179.951 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.873 HD22 HG11 ' A' ' 206' ' ' VAL . 90.3 mt -79.76 -20.22 46.84 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.465 1.103 . . . . 52.119999999999997 109.243 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' GLN . . . . . 0.535 ' O ' ' HD3' ' A' ' 107' ' ' LYS . 0.7 OUTLIER -88.98 -11.93 42.92 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.523 1.14 . . . . 73.150000000000006 110.324 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ASP . . . . . 0.467 ' O ' ' C ' ' A' ' 103' ' ' ASP . 30.6 t70 -116.2 -57.15 2.24 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.426 1.078 . . . . 74.140000000000001 109.304 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.537 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 51.5 t0 -34.78 -64.78 0.24 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.528 1.142 . . . . 71.329999999999998 109.321 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.534 ' CZ ' ' OD1' ' A' ' 103' ' ' ASP . 4.4 m-85 -104.08 -32.31 9.25 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.508 1.13 . . . . 70.5 110.959 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.482 ' O ' ' N ' ' A' ' 107' ' ' LYS . . . 109.51 27.08 4.85 Favored Glycine 0 CA--C 1.529 0.939 0 O-C-N 124.581 1.175 . . . . 61.350000000000001 110.974 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.521 HG22 ' CE1' ' A' ' 81' ' ' PHE . 28.4 mm -63.98 75.63 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.408 0.711 . . . . 74.109999999999999 109.358 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.535 ' HD3' ' O ' ' A' ' 101' ' ' GLN . 0.3 OUTLIER -129.07 157.14 76.84 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.493 1.121 . . . . 74.319999999999993 109.317 -179.927 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.532 ' HA ' ' HB3' ' A' ' 107' ' ' LYS . 18.4 Cg_endo -75.04 132.0 26.11 Favored 'Cis proline' 0 C--N 1.36 1.166 0 C-N-CA 120.953 -2.52 . . . . 72.150000000000006 110.983 0.02 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' GLY . . . . . 0.442 ' N ' ' HA ' ' A' ' 107' ' ' LYS . . . -105.17 116.67 5.33 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.54 1.15 . . . . 75.010000000000005 111.009 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -129.69 148.26 33.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.503 0.766 . . . . 75.349999999999994 109.332 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ILE . . . . . 0.741 HD13 ' HB2' ' A' ' 94' ' ' LEU . 41.8 pt -98.73 -175.76 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.515 1.134 . . . . 62.030000000000001 109.328 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.709 ' HE1' ' HB2' ' A' ' 128' ' ' ALA . 0.6 OUTLIER -82.14 -18.55 42.49 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.526 1.141 . . . . 74.040000000000006 110.93 -179.986 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -94.49 -3.08 50.62 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.559 1.162 . . . . 52.439999999999998 109.352 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -104.65 -26.63 12.24 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.501 1.126 . . . . 55.25 110.317 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 4.8 ttm -48.28 141.14 9.09 Favored Pre-proline 0 C--N 1.326 -0.444 0 O-C-N 124.511 1.132 . . . . 72.129999999999995 110.984 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo . . . . . 0 C--N 1.361 1.191 0 O-C-N 124.562 1.822 . . . . 72.430000000000007 111.071 179.996 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.584 HD21 ' OD1' ' A' ' 150' ' ' ASN . 1.6 mm? . . . . . 0 N--CA 1.454 -0.257 0 N-CA-C 109.318 -0.623 . . . . 75.340000000000003 109.318 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.478 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 7.6 t70 -54.96 -19.74 7.43 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.537 1.148 . . . . 75.450000000000003 109.271 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -59.25 -70.32 0.16 Allowed 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.517 1.136 . . . . 73.209999999999994 109.308 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.899 ' HB3' HD11 ' A' ' 84' ' ' LEU . . . -74.66 -17.48 60.68 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.534 1.147 . . . . 50.539999999999999 109.304 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.783 HG21 HD11 ' A' ' 157' ' ' LEU . 86.9 t -93.07 30.8 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.456 1.098 . . . . 74.310000000000002 109.302 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' ASN . . . . . 0.478 ' CB ' ' O ' ' A' ' 126' ' ' ASP . 23.5 t30 -147.47 133.37 19.1 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.445 1.091 . . . . 72.409999999999997 109.244 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 71.82 55.51 7.27 Favored Glycine 0 CA--C 1.53 1.005 0 O-C-N 124.474 1.109 . . . . 64.120000000000005 111.018 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.46 173.8 12.68 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.444 0.732 . . . . 45.149999999999999 109.992 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.79 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -101.73 -30.76 11.13 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.487 1.117 . . . . 72.439999999999998 109.287 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.79 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 2.5 m-90 -158.86 177.15 11.47 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.953 -1.129 . . . . 75.150000000000006 107.953 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' THR . . . . . 0.676 HG22 ' CG1' ' A' ' 82' ' ' VAL . 25.3 p -151.45 124.02 8.43 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.479 1.112 . . . . 54.420000000000002 110.435 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 1.01 ' O ' HD23 ' A' ' 137' ' ' LEU . 1.1 mp -84.09 140.66 15.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 O-C-N 124.533 1.146 . . . . 64.409999999999997 109.304 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 1.01 HD23 ' O ' ' A' ' 136' ' ' ILE . 9.0 mt -131.17 100.66 5.28 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.577 1.173 . . . . 71.019999999999996 109.26 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.99 HD21 ' HB2' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -62.67 107.21 0.91 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.533 1.145 . . . . 74.230000000000004 109.31 179.985 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.53 HD13 ' HA ' ' A' ' 139' ' ' LEU . 0.5 OUTLIER -68.91 108.63 3.56 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.495 1.122 . . . . 73.329999999999998 109.241 -179.977 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 140' ' ' THR . . . . . 0.756 HG23 ' OD1' ' A' ' 178' ' ' ASN . 2.8 m -123.87 162.06 24.06 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.431 1.082 . . . . 70.340000000000003 110.395 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -62.37 -37.81 87.13 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.534 1.146 . . . . 72.140000000000001 110.248 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -89.67 -52.9 4.77 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.519 1.137 . . . . 73.400000000000006 109.279 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.714 ' CD1' ' HB2' ' A' ' 86' ' ' ALA . 49.7 t80 -49.13 -24.5 1.68 Allowed 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.534 1.147 . . . . 74.430000000000007 111.02 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.646 HD13 ' C ' ' A' ' 144' ' ' LEU . 2.2 tm? -58.16 -68.37 0.26 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.514 1.134 . . . . 61.140000000000001 109.26 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.602 ' N ' HD13 ' A' ' 144' ' ' LEU . 0.6 OUTLIER -57.64 -16.67 11.24 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.46 1.1 . . . . 74.349999999999994 110.298 -179.984 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -75.17 -38.12 60.98 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.485 1.115 . . . . 74.120000000000005 109.324 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.541 ' O ' ' CG ' ' A' ' 151' ' ' PHE . 2.3 p -101.14 -7.61 23.0 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.437 1.086 . . . . 72.310000000000002 110.449 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.425 ' HA ' ' CE3' ' A' ' 148' ' ' TRP . 1.0 OUTLIER -94.68 -25.14 16.85 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.959 -1.126 . . . . 74.150000000000006 107.959 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 42.7 t -88.57 -45.46 9.87 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.502 1.126 . . . . 62.420000000000002 108.253 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 150' ' ' ASN . . . . . 0.584 ' OD1' HD21 ' A' ' 125' ' ' LEU . 2.7 t-20 -61.83 -54.2 45.46 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.441 1.088 . . . . 62.109999999999999 109.316 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.541 ' CG ' ' O ' ' A' ' 147' ' ' THR . 4.9 m-30 -53.41 -52.88 57.95 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.507 1.129 . . . . 64.5 110.95 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -39.39 -48.69 1.95 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.518 1.137 . . . . 62.219999999999999 110.334 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -81.33 -28.23 34.62 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.372 1.045 . . . . 70.030000000000001 111.03 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.431 ' N ' ' O ' ' A' ' 151' ' ' PHE . 4.5 m-85 -113.6 86.57 2.42 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 124.464 1.103 . . . . 73.340000000000003 111.035 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 155' ' ' THR . . . . . 0.413 ' O ' ' N ' ' A' ' 158' ' ' MET . 1.1 t -61.25 -14.14 23.85 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.481 1.113 . . . . 72.049999999999997 110.36 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 12.5 t -46.64 -34.56 5.15 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.464 1.103 . . . . 72.040000000000006 109.993 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.783 HD11 HG21 ' A' ' 129' ' ' VAL . 0.4 OUTLIER -88.44 -29.32 20.27 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.403 1.064 . . . . 72.329999999999998 109.267 -179.992 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 158' ' ' MET . . . . . 0.456 ' CE ' ' HA ' ' A' ' 158' ' ' MET . 23.1 mmt -62.07 -24.25 66.99 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.491 1.12 . . . . 75.319999999999993 110.984 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 159' ' ' ASN . . . . . 0.43 ' OD1' ' N ' ' A' ' 160' ' ' SER . 24.8 p30 -92.92 -19.37 21.71 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.466 1.104 . . . . 64.230000000000004 109.289 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 160' ' ' SER . . . . . 0.601 ' HB2' HG21 ' A' ' 170' ' ' VAL . 1.4 m -81.29 -34.31 32.07 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.522 1.139 . . . . 72.310000000000002 110.017 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 161' ' ' VAL . . . . . 0.585 ' O ' HD11 ' A' ' 192' ' ' ILE . 7.6 m -60.65 -17.98 16.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.584 1.177 . . . . 75.340000000000003 109.346 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 162' ' ' ASN . . . . . 0.429 ' CB ' ' HG3' ' A' ' 164' ' ' GLN . 49.3 m-20 -66.94 -10.37 48.39 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.53 1.144 . . . . 75.430000000000007 109.299 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.477 ' CD ' HG12 ' A' ' 192' ' ' ILE . 21.6 mtp180 65.06 18.67 11.58 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.442 1.089 . . . . 75.150000000000006 110.285 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 164' ' ' GLN . . . . . 0.429 ' HG3' ' CB ' ' A' ' 162' ' ' ASN . 85.2 mt-30 -45.94 171.82 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.511 1.132 . . . . 74.439999999999998 110.291 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 15.7 p80 -86.14 59.24 5.52 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.467 1.104 . . . . 72.299999999999997 109.579 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.551 ' HG3' ' CD1' ' A' ' 167' ' ' TYR . 0.8 OUTLIER -107.96 144.06 35.77 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.493 1.121 . . . . 71.439999999999998 109.284 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 167' ' ' TYR . . . . . 0.743 ' CE2' ' ND2' ' A' ' 168' ' ' ASN . 16.2 p90 -38.42 -47.59 1.27 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.462 1.101 . . . . 70.319999999999993 110.932 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 168' ' ' ASN . . . . . 0.743 ' ND2' ' CE2' ' A' ' 167' ' ' TYR . 12.2 p30 -92.67 132.09 37.2 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.533 1.146 . . . . 74.120000000000005 109.235 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.485 ' HB3' ' CD1' ' A' ' 134' ' ' TRP . 13.9 t -124.04 145.13 49.43 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.45 1.093 . . . . 63.520000000000003 110.003 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.831 ' O ' HD12 ' A' ' 171' ' ' ILE . 4.8 t -106.21 123.72 61.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.518 1.136 . . . . 64.340000000000003 109.292 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.831 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.6 mp -131.37 109.61 14.95 Favored Pre-proline 0 C--N 1.325 -0.474 0 O-C-N 124.452 1.095 . . . . 63.539999999999999 109.309 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 172' ' ' PRO . . . . . 0.645 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.99 110.68 3.16 Favored 'Trans proline' 0 C--N 1.36 1.16 0 O-C-N 124.49 1.784 . . . . 63.329999999999998 111.035 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 173' ' ' MET . . . . . 0.683 ' CE ' HD12 ' A' ' 195' ' ' LEU . 4.0 ttt -94.83 156.66 16.27 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.455 1.097 . . . . 54.450000000000003 110.973 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 174' ' ' ARG . . . . . 0.441 ' N ' ' HG2' ' A' ' 173' ' ' MET . 17.0 mmt85 -111.9 118.85 45.72 Favored Pre-proline 0 C--N 1.325 -0.458 0 O-C-N 124.528 1.142 . . . . 71.540000000000006 110.256 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 175' ' ' PRO . . . . . 0.478 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.3 Cg_endo -74.95 152.03 40.5 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.502 1.791 . . . . 73.319999999999993 110.997 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 176' ' ' LEU . . . . . 0.609 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.1 OUTLIER -85.26 -44.13 13.14 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.536 1.147 . . . . 71.150000000000006 109.353 179.946 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 177' ' ' ASN . . . . . 0.484 ' ND2' ' CG ' ' A' ' 92' ' ' GLU . 4.9 p30 -71.14 -28.05 64.0 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.524 1.14 . . . . 54.329999999999998 109.259 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 178' ' ' ASN . . . . . 0.756 ' OD1' HG23 ' A' ' 140' ' ' THR . 1.4 m-80 -110.79 98.58 38.51 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.48 1.113 . . . . 60.140000000000001 109.27 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.97 116.36 4.57 Favored 'Trans proline' 0 C--N 1.36 1.133 0 O-C-N 124.556 1.819 . . . . 74.209999999999994 111.012 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.544 HD13 ' HB2' ' A' ' 184' ' ' ARG . 0.5 OUTLIER -127.57 96.45 32.92 Favored Pre-proline 0 C--N 1.325 -0.48 0 O-C-N 124.5 1.125 . . . . 72.109999999999999 109.312 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.97 171.67 17.87 Favored 'Trans proline' 0 C--N 1.36 1.162 0 O-C-N 124.509 1.794 . . . . 73.109999999999999 111.031 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 -60.04 -23.69 63.94 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.48 1.113 . . . . 71.230000000000004 110.346 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -68.85 -15.49 63.51 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.443 1.089 . . . . 72.439999999999998 110.31 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 184' ' ' ARG . . . . . 0.544 ' HB2' HD13 ' A' ' 180' ' ' LEU . 35.0 mmt180 -111.1 -28.45 8.29 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.462 1.101 . . . . 72.209999999999994 110.36 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 185' ' ' THR . . . . . 0.497 HG23 ' HD2' ' A' ' 186' ' ' PRO . 54.1 m -72.86 143.72 84.68 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.407 1.067 . . . . 74.010000000000005 110.413 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 186' ' ' PRO . . . . . 0.563 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -75.01 148.39 35.18 Favored 'Trans proline' 0 C--N 1.36 1.17 0 O-C-N 124.503 1.791 . . . . 72.040000000000006 110.977 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 187' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -60.85 -12.4 10.83 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.453 1.096 . . . . 74.299999999999997 111.05 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 188' ' ' ALA . . . . . 0.701 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -88.56 -53.93 4.41 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.474 1.109 . . . . 53.450000000000003 109.391 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.563 HD12 ' CG ' ' A' ' 186' ' ' PRO . 37.1 mt -74.4 -14.91 60.92 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.51 1.131 . . . . 64.430000000000007 109.321 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -85.66 -11.4 53.91 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.56 1.163 . . . . 75.329999999999998 110.31 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 191' ' ' THR . . . . . . . . . . . . . 21.9 p -113.87 1.47 14.77 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.556 1.16 . . . . 64.109999999999999 110.385 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.701 HD12 ' O ' ' A' ' 188' ' ' ALA . 3.1 mt -99.37 163.74 2.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.465 1.103 . . . . 73.319999999999993 109.299 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 193' ' ' ASN . . . . . 0.49 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 13.5 t-20 -66.65 73.41 0.09 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.539 1.149 . . . . 61.25 109.306 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 194' ' ' ALA . . . . . 0.645 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -66.69 143.66 56.83 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.592 1.182 . . . . 63.409999999999997 109.293 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 195' ' ' LEU . . . . . 0.683 HD12 ' CE ' ' A' ' 173' ' ' MET . 0.2 OUTLIER -84.66 129.98 34.77 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.529 1.143 . . . . 71.420000000000002 109.266 179.995 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -104.88 117.4 33.95 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.531 1.145 . . . . 71.200000000000003 110.336 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.482 ' HG2' ' CD2' ' A' ' 176' ' ' LEU . 1.3 tt0 -101.82 -33.23 9.89 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.533 1.146 . . . . 72.340000000000003 110.285 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 198' ' ' GLU . . . . . 0.469 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -90.0 23.04 2.93 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.527 1.142 . . . . 63.539999999999999 110.303 -179.979 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -128.57 147.34 50.7 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.492 1.12 . . . . 73.219999999999999 110.009 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.81 -19.5 65.88 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.459 1.099 . . . . 63.039999999999999 110.264 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -89.13 21.27 28.71 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 124.448 1.093 . . . . 64.5 110.988 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 202' ' ' PHE . . . . . 0.826 ' O ' HG23 ' A' ' 206' ' ' VAL . 5.6 t80 -65.21 -39.32 34.75 Favored Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.509 0.77 . . . . 75.439999999999998 110.977 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 203' ' ' PRO . . . . . 0.686 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.05 -38.71 1.45 Allowed 'Trans proline' 0 C--N 1.359 1.116 0 O-C-N 124.505 1.792 . . . . 72.530000000000001 110.956 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -50.9 -59.9 3.65 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.483 1.114 . . . . 75.200000000000003 110.387 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -59.02 -47.55 84.8 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.484 1.115 . . . . 73.129999999999995 110.313 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 206' ' ' VAL . . . . . 0.873 HG11 HD22 ' A' ' 100' ' ' LEU . 82.6 t -57.27 -29.69 33.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.463 1.102 . . . . 71.409999999999997 109.257 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.08 -35.75 49.02 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.521 1.138 . . . . 74.420000000000002 110.365 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 64.8 mtt-85 -81.26 -68.23 0.71 Allowed 'General case' 0 C--N 1.327 -0.412 0 O-C-N 124.459 1.1 . . . . 50.200000000000003 110.299 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 209' ' ' ILE . . . . . 0.827 HG22 ' CE1' ' A' ' 210' ' ' PHE . 73.3 mt -41.47 -43.32 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.527 1.142 . . . . 64.439999999999998 109.313 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 210' ' ' PHE . . . . . 0.827 ' CE1' HG22 ' A' ' 209' ' ' ILE . 1.5 m-85 -112.02 66.89 0.64 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.538 1.148 . . . . 71.329999999999998 110.962 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -110.65 147.39 34.39 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.537 1.148 . . . . 75.219999999999999 110.286 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 212' ' ' GLU . . . . . 0.449 ' O ' ' N ' ' A' ' 215' ' ' TYR . 27.9 tt0 -49.14 -55.52 12.07 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.537 1.148 . . . . 72.420000000000002 110.274 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -48.38 -23.93 1.08 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.437 1.086 . . . . 61.409999999999997 109.976 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.528 ' O ' ' NE2' ' A' ' 218' ' ' GLN . 13.4 t -95.9 -29.31 3.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.449 1.093 . . . . 63.119999999999997 109.28 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 215' ' ' TYR . . . . . 0.449 ' N ' ' O ' ' A' ' 212' ' ' GLU . 17.2 t80 -63.78 -33.89 76.67 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.619 1.199 . . . . 74.129999999999995 111.059 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 51.3 mmtt -57.33 -66.32 0.48 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.548 1.155 . . . . 72.430000000000007 109.253 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 217' ' ' THR . . . . . 1.084 HG22 HD11 ' A' ' 221' ' ' ILE . 17.3 m -45.3 -66.56 0.38 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.497 1.123 . . . . 63.009999999999998 110.378 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 218' ' ' GLN . . . . . 0.638 ' HA ' HD12 ' A' ' 221' ' ' ILE . 2.6 mp0 -42.01 -45.7 3.94 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.473 1.108 . . . . 74.329999999999998 110.32 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 219' ' ' GLN . . . . . 0.444 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 18.9 tp60 -62.85 -39.41 94.31 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.504 1.127 . . . . 75.420000000000002 110.315 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 220' ' ' THR . . . . . 0.46 ' O ' ' CG ' ' A' ' 224' ' ' GLU . 1.0 OUTLIER -77.66 -17.71 57.44 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.57 1.169 . . . . 71.129999999999995 110.418 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 221' ' ' ILE . . . . . 1.084 HD11 HG22 ' A' ' 217' ' ' THR . 35.2 mt -83.64 -40.28 15.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.477 1.111 . . . . 61.340000000000003 109.301 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 222' ' ' TRP . . . . . . . . . . . . . 27.7 t90 -64.11 -54.98 25.35 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.546 1.153 . . . . 75.120000000000005 108.042 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -20.23 52.64 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.485 1.116 . . . . 71.540000000000006 109.318 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 224' ' ' GLU . . . . . 0.46 ' CG ' ' O ' ' A' ' 220' ' ' THR . 79.6 mt-10 . . . . . 0 C--N 1.325 -0.474 0 O-C-N 124.543 1.152 . . . . 74.310000000000002 110.302 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.516 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 6.4 p . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.312 -0.625 . . . . 71.329999999999998 109.312 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.413 ' O ' ' C ' ' A' ' 79' ' ' LEU . 26.8 m-85 -87.95 23.5 2.04 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.531 1.144 . . . . 74.25 111.034 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.667 HD11 HG22 ' A' ' 110' ' ' ILE . 12.5 tp -39.63 155.26 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.52 1.137 . . . . 70.510000000000005 109.278 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.756 ' NZ ' ' H ' ' A' ' 107' ' ' LYS . 27.4 ttpt -100.49 -60.61 1.49 Allowed 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.497 1.123 . . . . 64.109999999999999 109.312 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 1.228 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.2 OUTLIER -156.99 132.83 9.48 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.487 1.117 . . . . 65.319999999999993 111.038 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.886 ' CG1' HG22 ' A' ' 135' ' ' THR . 7.2 p -96.8 168.47 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.528 1.142 . . . . 55.229999999999997 109.368 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 1.228 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 4.2 mp -130.67 101.32 5.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.529 1.143 . . . . 64.140000000000001 109.326 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.115 HD11 ' HB1' ' A' ' 128' ' ' ALA . 3.7 mp -75.73 124.28 27.01 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.504 1.127 . . . . 75.25 109.317 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.824 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -146.27 174.4 11.37 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.455 1.097 . . . . 72.299999999999997 109.614 -179.99 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.44 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -115.82 164.3 14.59 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.508 1.13 . . . . 71.430000000000007 109.338 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -57.45 -17.28 12.41 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.532 1.145 . . . . 71.530000000000001 110.255 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -78.56 -45.56 21.51 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.536 1.148 . . . . 74.409999999999997 109.31 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.877 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.9 OUTLIER -121.63 44.14 2.64 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.452 1.095 . . . . 73.420000000000002 109.269 -179.973 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.596 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -77.63 -48.24 17.32 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.493 1.12 . . . . 73.420000000000002 110.371 -179.958 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -67.84 -19.45 65.05 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.471 1.107 . . . . 62.310000000000002 109.332 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.03 -56.93 5.67 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.458 1.099 . . . . 72.430000000000007 110.298 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 1.038 ' HB1' ' CG2' ' A' ' 83' ' ' ILE . . . -68.4 -22.77 64.61 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.527 1.142 . . . . 61.229999999999997 109.268 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.672 HD23 ' O ' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -82.68 -34.06 27.51 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.552 1.157 . . . . 71.439999999999998 109.378 179.927 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -67.3 -34.56 77.63 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.466 1.104 . . . . 73.239999999999995 110.274 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.578 HG13 ' N ' ' A' ' 97' ' ' GLN . 8.5 p -81.44 -55.29 8.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.554 1.159 . . . . 75.430000000000007 109.267 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.578 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -49.5 -20.95 0.82 Allowed 'General case' 0 C--N 1.326 -0.419 0 O-C-N 124.476 1.11 . . . . 74.140000000000001 110.35 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.493 ' O ' ' CG ' ' A' ' 101' ' ' GLN . 0.2 OUTLIER -78.94 -36.08 42.24 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.481 1.113 . . . . 70.340000000000003 109.287 -179.93 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.735 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -85.82 -20.0 29.82 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.52 1.137 . . . . 74.450000000000003 109.326 179.965 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.833 HD22 HG11 ' A' ' 206' ' ' VAL . 56.7 mt -78.98 -21.99 46.26 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.509 1.131 . . . . 70.219999999999999 109.323 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' GLN . . . . . 0.621 ' HB2' ' CG ' ' A' ' 107' ' ' LYS . 0.2 OUTLIER -82.58 -15.15 53.3 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.497 1.123 . . . . 75.319999999999993 110.302 -179.99 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ASP . . . . . 0.494 ' O ' ' C ' ' A' ' 103' ' ' ASP . 13.3 t70 -116.09 -58.01 2.15 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.548 1.155 . . . . 60.219999999999999 109.284 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.551 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 28.1 t0 -32.31 -66.81 0.12 Allowed 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.478 1.111 . . . . 63.409999999999997 109.265 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.509 ' HE1' HD23 ' A' ' 100' ' ' LEU . 5.2 m-85 -102.12 -29.66 11.61 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.448 1.093 . . . . 65.010000000000005 110.98 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 107' ' ' LYS . . . 109.59 16.67 10.64 Favored Glycine 0 CA--C 1.531 1.054 0 O-C-N 124.526 1.141 . . . . 4.1200000000000001 110.982 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.667 ' HA ' ' HZ1' ' A' ' 80' ' ' LYS . 36.8 mm -54.45 85.78 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.488 0.757 . . . . 62.340000000000003 109.259 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.756 ' H ' ' NZ ' ' A' ' 80' ' ' LYS . 4.5 mtmp? -138.57 154.91 73.72 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.48 1.113 . . . . 71.099999999999994 109.292 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.5 Cg_endo -74.99 128.87 17.23 Favored 'Cis proline' 0 C--N 1.36 1.155 0 C-N-CA 121.041 -2.483 . . . . 73.030000000000001 111.034 -0.053 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' GLY . . . . . 0.507 ' N ' ' HA ' ' A' ' 107' ' ' LYS . . . -105.93 122.91 7.29 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.597 1.186 . . . . 44.329999999999998 111.023 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.667 HG22 HD11 ' A' ' 79' ' ' LEU . 8.0 tt -144.74 157.38 14.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 O-C-N 124.469 0.746 . . . . 75.030000000000001 109.282 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ILE . . . . . 0.824 HD12 ' NE2' ' A' ' 85' ' ' HIS . 28.7 pt -93.66 -178.54 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.533 1.145 . . . . 72.109999999999999 109.373 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 1.228 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 0.9 OUTLIER -82.03 -22.76 36.28 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.458 1.099 . . . . 71.400000000000006 110.993 179.988 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -88.07 -3.36 58.9 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.499 1.124 . . . . 54.43 109.311 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.408 ' C ' HD11 ' A' ' 110' ' ' ILE . 19.8 mm-40 -107.45 -26.03 11.14 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.53 1.144 . . . . 73.140000000000001 110.335 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 3.8 ttm -45.64 138.54 5.22 Favored Pre-proline 0 C--N 1.325 -0.457 0 O-C-N 124.496 1.123 . . . . 64.239999999999995 111.046 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo . . . . . 0 C--N 1.359 1.116 0 O-C-N 124.515 1.797 . . . . 74.109999999999999 111.046 -179.981 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.581 ' O ' HG23 ' A' ' 129' ' ' VAL . 1.0 OUTLIER . . . . . 0 N--CA 1.454 -0.271 0 N-CA-C 109.298 -0.631 . . . . 74.329999999999998 109.298 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -42.67 -61.47 1.23 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.515 1.135 . . . . 72.219999999999999 109.32 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.443 ' O ' ' N ' ' A' ' 130' ' ' ASN . 6.5 m-20 -45.89 -63.23 1.02 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.5 1.125 . . . . 55.340000000000003 109.246 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 1.228 ' HB2' ' CE1' ' A' ' 112' ' ' PHE . . . -50.86 -26.79 6.24 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.498 1.124 . . . . 62.219999999999999 109.299 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.706 HG12 ' O ' ' A' ' 129' ' ' VAL . 99.1 t -94.08 30.87 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.525 1.141 . . . . 65.010000000000005 109.253 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' ASN . . . . . 0.443 ' N ' ' O ' ' A' ' 127' ' ' ASP . 11.2 t-20 -152.55 145.28 24.3 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.547 1.154 . . . . 51.229999999999997 109.306 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 64.99 38.51 95.56 Favored Glycine 0 CA--C 1.53 0.997 0 O-C-N 124.423 1.077 . . . . 64.5 111.05 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 50.7 m -151.36 178.79 8.92 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.549 0.793 . . . . 74.340000000000003 110.02 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 80' ' ' LYS . . . -112.45 -42.09 3.74 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.573 1.171 . . . . 60.25 109.291 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.57 ' CZ2' ' HA ' ' A' ' 210' ' ' PHE . 14.6 m-90 -141.14 160.76 39.4 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.543 1.152 . . . . 65.219999999999999 107.933 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 135' ' ' THR . . . . . 0.886 HG22 ' CG1' ' A' ' 82' ' ' VAL . 1.7 p -145.28 125.54 13.84 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.456 1.098 . . . . 74.239999999999995 110.317 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.565 HD13 ' HE2' ' A' ' 81' ' ' PHE . 0.8 OUTLIER -84.42 134.89 25.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.488 1.117 . . . . 61.130000000000003 109.28 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.478 HD22 ' O ' ' A' ' 136' ' ' ILE . 2.2 mm? -117.92 96.81 5.52 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.502 1.127 . . . . 72.109999999999999 109.334 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.877 HD23 ' HB2' ' A' ' 89' ' ' ASP . 0.2 OUTLIER -62.64 104.84 0.57 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.498 1.124 . . . . 74.129999999999995 109.274 179.999 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.417 HD21 HD13 ' A' ' 189' ' ' LEU . 18.9 mt -78.22 111.56 14.29 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.54 1.15 . . . . 72.299999999999997 109.33 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 140' ' ' THR . . . . . 0.484 ' O ' ' CB ' ' A' ' 144' ' ' LEU . 9.6 m -139.67 159.46 42.11 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.505 1.128 . . . . 73.040000000000006 110.444 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -56.08 -36.51 68.19 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.47 1.106 . . . . 64.129999999999995 110.264 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -88.4 -52.04 5.41 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.501 1.126 . . . . 71.549999999999997 109.294 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.6 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 10.9 t80 -57.46 -19.8 26.42 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.521 1.138 . . . . 75.140000000000001 110.983 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.619 HD12 ' NH1' ' A' ' 145' ' ' ARG . 3.0 tm? -84.93 -52.64 5.86 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.582 1.176 . . . . 71.209999999999994 109.333 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.619 ' NH1' HD12 ' A' ' 144' ' ' LEU . 0.0 OUTLIER -55.85 -27.09 49.96 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.436 1.085 . . . . 63.229999999999997 110.32 179.967 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -79.13 -63.0 1.52 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.494 1.121 . . . . 73.230000000000004 109.279 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.565 HG21 ' CE1' ' A' ' 143' ' ' PHE . 25.5 p -56.9 -61.59 2.34 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.531 1.144 . . . . 72.219999999999999 110.33 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.471 ' HB2' HD22 ' A' ' 144' ' ' LEU . 1.4 t-105 -44.52 -41.95 6.82 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.009 -1.108 . . . . 70.349999999999994 108.009 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 149' ' ' CYS . . . . . 0.423 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 7.1 t -63.48 -45.55 90.23 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.484 1.115 . . . . 73.450000000000003 108.278 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 150' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' A' ' 147' ' ' THR . 0.8 OUTLIER -57.32 -61.68 2.31 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.539 1.149 . . . . 62.439999999999998 109.274 -179.915 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.956 ' CE1' HD12 ' A' ' 157' ' ' LEU . 8.5 m-30 -39.65 -39.24 0.72 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.524 1.14 . . . . 74.5 110.935 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -56.75 -46.77 81.21 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.511 1.132 . . . . 54.539999999999999 110.278 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.491 ' O ' ' CG ' ' A' ' 153' ' ' PHE . 66.8 t80 -99.9 7.55 44.8 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.459 1.1 . . . . 52.210000000000001 111.015 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.449 ' N ' ' O ' ' A' ' 150' ' ' ASN . 0.3 OUTLIER -145.92 81.63 1.6 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.509 1.13 . . . . 73.329999999999998 111.023 179.953 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 3.9 t -72.1 -5.31 34.45 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.407 1.067 . . . . 51.32 110.409 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 156' ' ' SER . . . . . 0.438 ' HB3' ' CE1' ' A' ' 154' ' ' TYR . 1.1 t -67.42 -31.56 71.85 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.53 1.143 . . . . 64.439999999999998 110.022 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.956 HD12 ' CE1' ' A' ' 151' ' ' PHE . 3.4 tm? -79.31 -41.82 27.14 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.539 1.149 . . . . 74.299999999999997 109.333 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 158' ' ' MET . . . . . . . . . . . . . 13.8 tpp -51.63 -21.98 3.02 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.526 1.141 . . . . 75.230000000000004 111.05 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -67.18 -37.39 83.63 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.467 1.105 . . . . 74.030000000000001 109.293 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 160' ' ' SER . . . . . 0.784 ' HB2' HG21 ' A' ' 170' ' ' VAL . 0.8 OUTLIER -77.28 -27.56 53.14 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.523 1.139 . . . . 72.430000000000007 109.986 179.975 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 161' ' ' VAL . . . . . 0.552 HG13 HH21 ' A' ' 163' ' ' ARG . 3.5 t -62.44 -18.1 19.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.56 1.163 . . . . 62.530000000000001 109.364 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -74.42 -4.39 36.29 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 124.552 1.158 . . . . 62.329999999999998 109.296 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.734 ' HE ' HD13 ' A' ' 192' ' ' ILE . 5.2 mmt180 58.51 30.97 20.48 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.494 1.121 . . . . 72.219999999999999 110.208 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -52.45 -174.64 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.483 1.114 . . . . 73.340000000000003 110.264 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -110.53 73.13 0.81 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.536 1.147 . . . . 72.400000000000006 109.58 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.409 ' C ' ' N ' ' A' ' 168' ' ' ASN . 0.0 OUTLIER -111.8 163.75 13.83 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.496 1.123 . . . . 72.030000000000001 109.329 -179.993 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 167' ' ' TYR . . . . . 0.574 ' N ' HG21 ' A' ' 221' ' ' ILE . 1.1 p90 -42.62 -25.91 0.1 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.467 1.105 . . . . 74.409999999999997 111.033 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 168' ' ' ASN . . . . . 0.541 HD21 ' HE1' ' A' ' 167' ' ' TYR . 9.3 p30 -119.3 156.17 30.49 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.54 1.15 . . . . 53.32 109.318 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.493 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 1.2 m -131.54 143.5 50.42 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.577 1.173 . . . . 72.230000000000004 109.97 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 1.0 ' O ' HD12 ' A' ' 171' ' ' ILE . 5.1 t -102.91 131.63 50.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.467 1.104 . . . . 73.239999999999995 109.333 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 1.0 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.2 mp -140.03 111.09 7.25 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.561 1.163 . . . . 72.209999999999994 109.287 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 172' ' ' PRO . . . . . 0.759 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.08 106.74 2.33 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.45 1.763 . . . . 64.310000000000002 110.983 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 173' ' ' MET . . . . . 0.539 ' HB3' HG23 ' A' ' 136' ' ' ILE . 3.1 ttt -90.47 151.83 21.21 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.467 1.105 . . . . 64.319999999999993 111.048 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 174' ' ' ARG . . . . . 0.422 ' N ' ' HG2' ' A' ' 173' ' ' MET . 4.7 tpp85 -110.18 122.04 39.92 Favored Pre-proline 0 C--N 1.324 -0.512 0 O-C-N 124.509 1.131 . . . . 73.040000000000006 110.279 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 175' ' ' PRO . . . . . 0.744 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.3 Cg_endo -75.04 160.91 39.47 Favored 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.477 1.777 . . . . 73.340000000000003 110.992 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 176' ' ' LEU . . . . . 0.975 HD21 ' CG ' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -100.62 -40.55 7.34 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.579 1.175 . . . . 72.430000000000007 109.316 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -73.0 -23.6 60.66 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.466 1.104 . . . . 70.439999999999998 109.275 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 178' ' ' ASN . . . . . 0.447 ' ND2' ' OD2' ' A' ' 89' ' ' ASP . 2.1 m-80 -110.41 106.7 58.13 Favored Pre-proline 0 C--N 1.325 -0.467 0 O-C-N 124.534 1.146 . . . . 74.319999999999993 109.273 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.97 115.12 4.19 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.497 1.788 . . . . 74.409999999999997 111.013 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.49 ' CD1' ' OG1' ' A' ' 185' ' ' THR . 1.1 tm? -126.94 96.97 33.45 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 124.454 1.096 . . . . 75.200000000000003 109.306 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 165.37 31.42 Favored 'Trans proline' 0 C--N 1.36 1.14 0 O-C-N 124.548 1.815 . . . . 61.409999999999997 110.969 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 3.7 ptt180 -55.8 -39.35 71.18 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.474 1.109 . . . . 72.340000000000003 110.308 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -55.72 -18.22 7.68 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.481 1.113 . . . . 75.150000000000006 110.277 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 184' ' ' ARG . . . . . 0.401 ' HB3' HD21 ' A' ' 180' ' ' LEU . 14.2 mmt180 -104.14 -18.06 14.66 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.488 1.118 . . . . 61.310000000000002 110.218 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 185' ' ' THR . . . . . 0.522 HG23 ' HD2' ' A' ' 186' ' ' PRO . 42.1 m -91.38 143.99 29.04 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.426 1.079 . . . . 75.510000000000005 110.381 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 186' ' ' PRO . . . . . 0.578 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -75.06 149.0 35.81 Favored 'Trans proline' 0 C--N 1.362 1.239 0 O-C-N 124.453 1.765 . . . . 61.549999999999997 110.993 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 187' ' ' PHE . . . . . 0.415 ' O ' HG23 ' A' ' 191' ' ' THR . 4.8 t80 -62.82 -11.51 18.48 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.492 1.12 . . . . 61.520000000000003 110.994 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 188' ' ' ALA . . . . . 0.434 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -88.57 -53.98 4.39 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.5 1.125 . . . . 72.109999999999999 109.36 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.578 HD12 ' CG ' ' A' ' 186' ' ' PRO . 40.4 mt -73.04 -18.17 61.36 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.538 1.149 . . . . 73.049999999999997 109.299 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 190' ' ' GLN . . . . . 0.473 ' CG ' ' O ' ' A' ' 190' ' ' GLN . 6.9 tt0 -86.0 -1.07 56.99 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.504 1.127 . . . . 62.119999999999997 110.289 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 191' ' ' THR . . . . . 0.415 HG23 ' O ' ' A' ' 187' ' ' PHE . 41.2 p -128.12 22.66 6.13 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.492 1.12 . . . . 72.439999999999998 110.411 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.734 HD13 ' HE ' ' A' ' 163' ' ' ARG . 4.2 mt -124.58 157.63 32.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.483 1.115 . . . . 63.32 109.296 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -61.79 82.8 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.513 1.133 . . . . 60.119999999999997 109.288 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 194' ' ' ALA . . . . . 0.759 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -82.5 152.05 26.22 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.59 1.181 . . . . 71.540000000000006 109.29 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 195' ' ' LEU . . . . . 0.51 HD23 ' CD1' ' A' ' 209' ' ' ILE . 0.2 OUTLIER -83.86 137.66 33.57 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.475 1.109 . . . . 65.010000000000005 109.3 179.979 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -121.47 123.2 41.48 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.514 1.134 . . . . 72.549999999999997 110.274 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.975 ' CG ' HD21 ' A' ' 176' ' ' LEU . 9.5 tp10 -97.27 -29.61 13.45 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.476 1.11 . . . . 71.409999999999997 110.33 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 198' ' ' GLU . . . . . 0.516 ' HG2' HD12 ' A' ' 176' ' ' LEU . 4.4 pt-20 -95.19 23.08 6.04 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.436 1.085 . . . . 73.219999999999999 110.305 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 2.0 t -122.91 134.37 54.36 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.581 1.176 . . . . 75.519999999999996 110.017 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 20.4 ttt180 -54.88 -18.56 5.06 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.497 1.123 . . . . 74.230000000000004 110.355 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -91.42 18.77 50.92 Favored Glycine 0 CA--C 1.529 0.964 0 O-C-N 124.504 1.128 . . . . 71.040000000000006 111.01 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 202' ' ' PHE . . . . . 0.803 ' O ' HG23 ' A' ' 206' ' ' VAL . 7.3 t80 -65.67 -39.43 32.13 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.429 0.723 . . . . 64.209999999999994 110.989 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 203' ' ' PRO . . . . . 0.685 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -74.98 -38.67 1.5 Allowed 'Trans proline' 0 C--N 1.361 1.209 0 O-C-N 124.509 1.794 . . . . 74.120000000000005 111.012 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -51.61 -62.66 1.49 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.511 1.132 . . . . 74.239999999999995 110.415 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 205' ' ' GLN . . . . . 0.454 ' O ' ' N ' ' A' ' 208' ' ' ARG . 7.2 mt-30 -55.63 -58.02 9.54 Favored 'General case' 0 C--N 1.323 -0.549 0 O-C-N 124.476 1.11 . . . . 54.5 110.298 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 206' ' ' VAL . . . . . 0.833 HG11 HD22 ' A' ' 100' ' ' LEU . 72.2 t -42.69 -31.2 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.44 1.088 . . . . 71.049999999999997 109.318 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -83.03 -41.32 18.8 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.491 1.119 . . . . 71.219999999999999 110.323 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 208' ' ' ARG . . . . . 0.454 ' N ' ' O ' ' A' ' 205' ' ' GLN . 51.1 mtt180 -71.43 -63.23 1.16 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.45 1.094 . . . . 73.109999999999999 110.269 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 209' ' ' ILE . . . . . 0.631 HG22 ' CD1' ' A' ' 210' ' ' PHE . 39.6 mt -48.33 -50.14 12.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.456 1.098 . . . . 75.049999999999997 109.287 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 210' ' ' PHE . . . . . 0.631 ' CD1' HG22 ' A' ' 209' ' ' ILE . 0.5 OUTLIER -102.77 65.06 0.89 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.515 1.134 . . . . 75.120000000000005 111.004 -179.977 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 211' ' ' GLN . . . . . 0.552 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.5 OUTLIER -110.9 144.8 39.39 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 124.519 1.137 . . . . 61.329999999999998 110.286 -179.982 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 212' ' ' GLU . . . . . 0.448 ' O ' ' N ' ' A' ' 215' ' ' TYR . 21.6 tt0 -48.84 -54.98 12.98 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.542 1.151 . . . . 74.450000000000003 110.286 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 3.4 t -48.34 -25.12 1.44 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.522 1.139 . . . . 72.239999999999995 109.983 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.552 HG23 ' HG2' ' A' ' 211' ' ' GLN . 43.2 t -96.28 -27.07 4.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.52 1.137 . . . . 72.040000000000006 109.298 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 215' ' ' TYR . . . . . 0.448 ' N ' ' O ' ' A' ' 212' ' ' GLU . 13.5 t80 -67.42 -36.62 81.61 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.484 1.115 . . . . 72.5 110.94 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 14.9 mmtt -52.03 -50.71 60.9 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.498 1.124 . . . . 62.200000000000003 109.321 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 217' ' ' THR . . . . . 0.738 HG22 HD11 ' A' ' 221' ' ' ILE . 18.8 m -58.17 -65.24 0.68 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.484 1.115 . . . . 73.209999999999994 110.407 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 218' ' ' GLN . . . . . 0.513 ' HA ' HD12 ' A' ' 221' ' ' ILE . 1.7 mp0 -54.12 -22.17 10.4 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.5 1.125 . . . . 73.120000000000005 110.316 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 219' ' ' GLN . . . . . 0.42 ' N ' ' O ' ' A' ' 215' ' ' TYR . 8.3 tp-100 -84.35 -30.17 25.68 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.482 1.114 . . . . 72.239999999999995 110.236 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 220' ' ' THR . . . . . 0.491 ' O ' ' CG ' ' A' ' 224' ' ' GLU . 1.0 OUTLIER -86.64 -22.64 26.05 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.536 1.147 . . . . 73.450000000000003 110.379 -179.981 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 221' ' ' ILE . . . . . 0.738 HD11 HG22 ' A' ' 217' ' ' THR . 42.6 mt -74.22 -53.97 15.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 O-C-N 124.424 1.077 . . . . 74.340000000000003 109.303 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 222' ' ' TRP . . . . . 0.516 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 14.4 t90 -63.26 -52.03 63.73 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.937 -1.134 . . . . 73.329999999999998 107.937 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.98 -20.93 10.23 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.553 1.158 . . . . 74.340000000000003 109.335 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 224' ' ' GLU . . . . . 0.491 ' CG ' ' O ' ' A' ' 220' ' ' THR . 8.2 mm-40 . . . . . 0 C--N 1.325 -0.463 0 O-C-N 124.49 1.119 . . . . 73.010000000000005 110.267 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.999 0 N-CA-C 110.993 -0.843 . . . . 35.0 110.993 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.96 -168.19 0.49 Allowed 'Trans proline' 0 C--N 1.359 1.125 0 O-C-N 124.495 1.787 . . . . 73.230000000000004 111.005 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.503 HD13 ' O ' ' A' ' 72' ' ' LEU . 0.5 OUTLIER -105.93 -56.16 2.22 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.527 1.142 . . . . 74.099999999999994 109.331 179.988 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -161.33 58.07 0.3 Allowed Glycine 0 CA--C 1.53 0.984 0 O-C-N 124.512 1.132 . . . . 74.420000000000002 111.026 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.414 ' OG ' ' N ' ' A' ' 75' ' ' GLU . 0.5 OUTLIER -75.37 173.34 11.04 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.47 0.747 . . . . 65.010000000000005 110.02 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.414 ' N ' ' OG ' ' A' ' 74' ' ' SER . 27.7 tt0 -42.43 121.35 1.91 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.516 1.135 . . . . 74.129999999999995 110.354 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -116.48 134.07 55.29 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.471 1.107 . . . . 73.140000000000001 110.265 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.3 p -138.68 150.18 23.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.551 1.157 . . . . 72.409999999999997 109.239 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.41 ' CD2' ' O ' ' A' ' 78' ' ' PHE . 52.1 p90 -89.23 34.63 0.8 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.547 1.154 . . . . 72.239999999999995 110.981 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.849 HD23 ' N ' ' A' ' 80' ' ' LYS . 4.4 tt -39.99 150.9 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.54 1.15 . . . . 74.329999999999998 109.322 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.849 ' N ' HD23 ' A' ' 79' ' ' LEU . 5.0 mtpt -72.2 -60.68 2.11 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.544 1.153 . . . . 74.310000000000002 109.257 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.66 ' CE1' HD11 ' A' ' 83' ' ' ILE . 0.1 OUTLIER -167.22 152.15 7.23 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.491 1.12 . . . . 73.230000000000004 111.011 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.711 HG11 ' HA ' ' A' ' 128' ' ' ALA . 4.5 p -100.86 163.39 3.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.487 1.117 . . . . 64.140000000000001 109.307 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.791 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.3 mp -125.63 98.6 5.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.515 1.134 . . . . 71.019999999999996 109.316 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 84' ' ' LEU . 4.8 mt -73.11 115.59 12.61 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.52 1.137 . . . . 74.230000000000004 109.304 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.724 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -138.87 174.48 10.48 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.535 1.147 . . . . 70.140000000000001 109.596 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.649 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -109.52 164.04 12.88 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.461 1.101 . . . . 60.450000000000003 109.248 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 87' ' ' GLU . 15.9 tt0 -67.53 -9.57 43.7 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.555 1.159 . . . . 74.109999999999999 110.343 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -84.02 -44.96 13.61 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.431 1.082 . . . . 65.299999999999997 109.254 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -120.85 43.67 2.71 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.473 1.108 . . . . 71.349999999999994 109.299 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.609 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -77.08 -22.6 52.58 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.478 1.111 . . . . 70.200000000000003 110.383 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -82.06 -28.08 32.61 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.568 1.168 . . . . 73.129999999999995 109.357 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -71.14 -56.32 6.34 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.494 1.121 . . . . 72.239999999999995 110.303 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.981 ' HB2' HD22 ' A' ' 138' ' ' LEU . . . -56.04 -33.83 65.33 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.499 1.124 . . . . 73.340000000000003 109.306 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.919 ' HB2' HD13 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -74.05 -45.63 48.32 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.491 1.12 . . . . 72.409999999999997 109.364 179.945 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.747 ' N ' HD13 ' A' ' 94' ' ' LEU . 10.3 tpt180 -48.29 -29.76 4.17 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.52 1.137 . . . . 74.099999999999994 110.308 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.814 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.2 t -81.87 -65.41 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.477 1.111 . . . . 60.399999999999999 109.339 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.476 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -40.11 -27.23 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.547 1.154 . . . . 64.25 110.379 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.452 ' N ' ' O ' ' A' ' 96' ' ' VAL . 1.3 t-20 -71.35 -53.06 15.45 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.483 1.114 . . . . 75.230000000000004 109.362 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.836 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -70.72 -21.73 62.51 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.539 1.149 . . . . 74.140000000000001 109.279 179.947 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.836 ' N ' HD23 ' A' ' 99' ' ' LEU . 22.8 mt -63.72 -51.32 65.51 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.483 1.114 . . . . 74.510000000000005 109.261 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -81.24 51.74 1.67 Allowed 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.494 1.122 . . . . 64.0 110.254 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -171.06 -66.28 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.492 1.12 . . . . 73.129999999999995 109.314 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -47.93 -47.88 32.16 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.417 1.073 . . . . 71.319999999999993 109.249 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 1.032 ' CE2' HG11 ' A' ' 206' ' ' VAL . 1.1 m-85 -115.94 -30.17 6.13 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.445 1.09 . . . . 62.539999999999999 110.982 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.67 45.18 2.75 Favored Glycine 0 CA--C 1.53 1.024 0 O-C-N 124.442 1.089 . . . . 72.25 111.029 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 9.8 mm -85.47 78.69 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.578 0.81 . . . . 70.340000000000003 109.311 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.531 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -124.16 156.02 67.03 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.519 1.137 . . . . 75.409999999999997 109.259 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.531 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.98 156.64 99.9 Favored 'Cis proline' 0 C--N 1.36 1.167 0 C-N-CA 120.945 -2.523 . . . . 74.209999999999994 111.023 -0.123 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -133.27 124.21 3.65 Favored Glycine 0 CA--C 1.531 1.047 0 O-C-N 124.452 1.095 . . . . 74.010000000000005 110.992 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.706 HG22 HD11 ' A' ' 79' ' ' LEU . 1.7 tt -142.32 149.57 19.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.492 0.76 . . . . 74.340000000000003 109.314 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.919 HD13 ' HB2' ' A' ' 94' ' ' LEU . 33.6 pt -99.61 163.49 2.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.472 1.107 . . . . 63.530000000000001 109.299 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -63.31 -19.09 64.29 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.508 1.13 . . . . 64.109999999999999 110.981 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -89.53 -8.13 53.44 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.519 1.137 . . . . 74.200000000000003 109.284 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -107.04 -20.09 13.42 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.571 1.169 . . . . 72.129999999999995 110.256 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.417 ' HE1' ' CG2' ' A' ' 82' ' ' VAL . 20.9 ttm -60.21 110.83 3.18 Favored Pre-proline 0 C--N 1.325 -0.5 0 O-C-N 124.441 1.088 . . . . 74.239999999999995 110.973 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 174.04 13.47 Favored 'Trans proline' 0 C--N 1.36 1.167 0 O-C-N 124.471 1.774 . . . . 42.399999999999999 111.03 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 10.1 p80 -174.65 168.84 3.69 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.514 1.134 . . . . 72.120000000000005 109.55 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -123.11 -94.92 1.18 Allowed Glycine 0 CA--C 1.529 0.923 0 O-C-N 124.478 1.111 . . . . 63.210000000000001 111.035 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 33.6 mtm180 -82.44 -26.65 32.51 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.439 0.729 . . . . 72.239999999999995 110.331 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -75.39 153.82 37.51 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.553 1.158 . . . . 71.329999999999998 110.341 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 6.6 m170 -83.67 173.14 11.61 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.508 1.13 . . . . 74.0 109.651 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.792 ' C ' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -108.71 -18.15 13.78 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.455 1.097 . . . . 74.219999999999999 109.337 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.431 ' N ' HD13 ' A' ' 122' ' ' LEU . 14.5 mt-30 -76.65 61.32 1.8 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.546 1.153 . . . . 63.32 110.214 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -129.46 86.01 2.37 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.551 1.157 . . . . 73.129999999999995 109.328 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.695 HD13 ' HG ' ' A' ' 157' ' ' LEU . 4.2 pp -58.02 -17.84 20.23 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.478 1.111 . . . . 61.43 109.268 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.403 ' O ' ' N ' ' A' ' 129' ' ' VAL . 6.1 p-10 -74.5 -41.2 61.1 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.521 1.138 . . . . 72.549999999999997 109.267 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -47.05 -48.41 22.36 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.439 1.087 . . . . 71.200000000000003 109.265 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.711 ' HA ' HG11 ' A' ' 82' ' ' VAL . . . -59.56 -34.48 72.74 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.484 1.115 . . . . 74.010000000000005 109.332 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.732 HG12 ' O ' ' A' ' 129' ' ' VAL . 68.8 t -92.84 30.8 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 O-C-N 124.507 1.129 . . . . 72.430000000000007 109.279 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -133.0 139.27 47.16 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.473 1.108 . . . . 73.540000000000006 109.286 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' GLY . . . . . 0.501 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 37.87 76.7 0.07 OUTLIER Glycine 0 CA--C 1.53 1.03 0 O-C-N 124.537 1.148 . . . . 52.030000000000001 110.982 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' SER . . . . . 0.4 ' O ' ' O ' ' A' ' 167' ' ' TYR . 0.6 OUTLIER -163.64 -175.46 4.17 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.499 0.764 . . . . 64.099999999999994 109.98 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.744 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -110.46 -41.36 4.37 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.566 1.166 . . . . 55.009999999999998 109.292 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.744 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 0.4 OUTLIER -154.54 165.86 35.12 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 107.969 -1.123 . . . . 72.340000000000003 107.969 -179.967 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.622 HG22 HG12 ' A' ' 82' ' ' VAL . 3.2 p -133.35 129.21 37.16 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.542 1.151 . . . . 74.319999999999993 110.399 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.791 ' HB ' HG23 ' A' ' 83' ' ' ILE . 11.4 mm -84.56 121.87 37.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.506 1.129 . . . . 75.549999999999997 109.288 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.538 HD23 ' C ' ' A' ' 136' ' ' ILE . 6.7 mt -108.29 87.81 2.58 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.479 1.112 . . . . 75.329999999999998 109.311 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.981 HD22 ' HB2' ' A' ' 93' ' ' ALA . 3.5 tp -62.27 88.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.5 1.125 . . . . 44.409999999999997 109.268 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.529 HD13 HG23 ' A' ' 185' ' ' THR . 19.3 mt -61.48 113.7 2.82 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.441 1.088 . . . . 63.200000000000003 109.343 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.595 HG23 ' ND2' ' A' ' 178' ' ' ASN . 5.7 m -140.32 154.4 46.77 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.525 1.14 . . . . 44.299999999999997 110.412 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 11.2 mp0 -47.34 -39.95 16.11 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.478 1.111 . . . . 51.119999999999997 110.332 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ASN . . . . . 0.412 ' ND2' ' N ' ' A' ' 143' ' ' PHE . 2.4 p-10 -89.89 -53.6 4.42 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.53 1.144 . . . . 74.209999999999994 109.294 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.649 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 37.3 t80 -48.95 -21.49 0.67 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.486 1.116 . . . . 74.109999999999999 111.038 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.511 ' O ' ' CB ' ' A' ' 148' ' ' TRP . 3.0 tm? -78.49 -67.64 0.72 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.547 1.154 . . . . 74.230000000000004 109.303 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.461 ' CD ' ' N ' ' A' ' 145' ' ' ARG . 0.1 OUTLIER -55.52 -17.48 5.44 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.457 1.098 . . . . 73.519999999999996 110.362 179.934 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -70.19 -73.15 0.17 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.5 1.125 . . . . 72.400000000000006 109.297 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.477 HG23 ' CZ ' ' A' ' 151' ' ' PHE . 0.9 OUTLIER -72.61 -48.11 42.38 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.503 1.127 . . . . 61.219999999999999 110.443 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.541 ' CE3' ' CD2' ' A' ' 151' ' ' PHE . 15.5 t-105 -44.39 -40.26 5.28 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.49 1.118 . . . . 71.409999999999997 108.001 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 149' ' ' CYS . . . . . 0.451 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 15.9 t -66.28 -45.74 79.41 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.483 1.114 . . . . 73.140000000000001 108.274 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ASN . . . . . 0.468 ' N ' ' O ' ' A' ' 147' ' ' THR . 6.8 t-20 -54.07 -53.92 46.54 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.47 1.106 . . . . 65.340000000000003 109.291 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 1.083 ' CE1' HD12 ' A' ' 157' ' ' LEU . 9.8 m-30 -38.2 -60.26 0.79 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.502 1.126 . . . . 71.209999999999994 111.029 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -45.75 -38.54 7.13 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.474 1.109 . . . . 72.510000000000005 110.291 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.45 ' N ' ' O ' ' A' ' 150' ' ' ASN . 51.8 t80 -82.26 -23.91 35.05 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.435 1.084 . . . . 71.299999999999997 110.989 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.555 ' CD2' ' HB2' ' A' ' 156' ' ' SER . 1.2 t80 -144.57 107.45 4.48 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.472 1.107 . . . . 74.209999999999994 110.949 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.1 t -73.18 -6.26 44.68 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.444 1.09 . . . . 64.109999999999999 110.431 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' SER . . . . . 0.555 ' HB2' ' CD2' ' A' ' 154' ' ' TYR . 22.0 m -51.29 -52.55 44.15 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.434 1.083 . . . . 41.299999999999997 110.01 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 1.083 HD12 ' CE1' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -66.96 -40.26 87.45 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.49 1.119 . . . . 74.239999999999995 109.244 -179.96 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 158' ' ' MET . . . . . 0.632 ' CE ' HG21 ' A' ' 161' ' ' VAL . 2.1 mmt -53.24 -19.55 3.27 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.418 1.074 . . . . 61.130000000000003 110.994 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -75.18 -42.23 56.32 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.474 1.108 . . . . 74.230000000000004 109.326 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.775 ' O ' HG21 ' A' ' 170' ' ' VAL . 0.3 OUTLIER -64.54 -13.47 52.76 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.51 1.131 . . . . 73.510000000000005 110.023 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 161' ' ' VAL . . . . . 0.638 ' CG1' ' HB1' ' A' ' 188' ' ' ALA . 89.0 t -74.85 -15.96 16.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.508 1.13 . . . . 74.340000000000003 109.311 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 162' ' ' ASN . . . . . 0.932 ' HB3' HE22 ' A' ' 164' ' ' GLN . 0.6 OUTLIER -79.14 2.83 19.5 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.506 1.129 . . . . 73.340000000000003 109.286 -179.965 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.452 ' HD3' ' CG2' ' A' ' 192' ' ' ILE . 14.8 mmm-85 60.37 64.97 1.13 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.42 1.075 . . . . 73.310000000000002 110.29 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 164' ' ' GLN . . . . . 0.932 HE22 ' HB3' ' A' ' 162' ' ' ASN . 1.4 mp0 -65.68 129.15 38.75 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.478 1.112 . . . . 73.239999999999995 110.271 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.417 ' O ' ' O ' ' A' ' 166' ' ' LYS . 13.3 m-70 -74.03 -3.91 32.17 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.507 1.129 . . . . 74.209999999999994 109.624 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.417 ' O ' ' O ' ' A' ' 165' ' ' HIS . 5.6 mptt -49.64 178.79 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.501 1.125 . . . . 63.350000000000001 109.334 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 167' ' ' TYR . . . . . 0.743 ' CE2' ' ND2' ' A' ' 168' ' ' ASN . 29.6 p90 -48.22 -47.66 35.52 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.452 1.095 . . . . 72.329999999999998 111.014 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.743 ' ND2' ' CE2' ' A' ' 167' ' ' TYR . 9.4 p30 -89.5 146.23 24.76 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.468 1.105 . . . . 70.409999999999997 109.345 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 8.3 t -128.11 169.02 14.56 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.505 1.128 . . . . 72.530000000000001 109.991 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.793 ' C ' HD12 ' A' ' 171' ' ' ILE . 12.7 t -123.0 111.59 30.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 O-C-N 124.463 1.102 . . . . 40.350000000000001 109.336 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.793 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -126.32 97.24 34.72 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.538 1.149 . . . . 73.439999999999998 109.269 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 172' ' ' PRO . . . . . 0.804 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.3 Cg_endo -75.0 106.92 2.37 Favored 'Trans proline' 0 C--N 1.36 1.141 0 O-C-N 124.507 1.793 . . . . 65.420000000000002 110.986 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 173' ' ' MET . . . . . 0.814 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.9 ttt -78.54 156.36 29.26 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.485 1.116 . . . . 73.319999999999993 110.997 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 174' ' ' ARG . . . . . 0.479 ' NH2' ' NH2' ' A' ' 182' ' ' ARG . 59.5 mtt85 -110.13 124.32 33.75 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.545 1.153 . . . . 70.519999999999996 110.327 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 175' ' ' PRO . . . . . 0.719 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -74.95 156.11 43.21 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.505 1.792 . . . . 64.310000000000002 111.008 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.892 HD21 ' CD ' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -104.17 -47.0 4.28 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.478 1.111 . . . . 75.319999999999993 109.248 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -72.77 -21.46 61.0 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.496 1.123 . . . . 72.230000000000004 109.314 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 178' ' ' ASN . . . . . 0.595 ' ND2' HG23 ' A' ' 140' ' ' THR . 5.5 t-20 -107.0 109.11 62.93 Favored Pre-proline 0 C--N 1.324 -0.528 0 O-C-N 124.576 1.173 . . . . 74.549999999999997 109.265 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.06 115.34 4.25 Favored 'Trans proline' 0 C--N 1.359 1.11 0 O-C-N 124.518 1.799 . . . . 63.409999999999997 111.007 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.505 HD22 ' HA ' ' A' ' 180' ' ' LEU . 0.6 OUTLIER -138.02 96.9 10.08 Favored Pre-proline 0 C--N 1.326 -0.453 0 O-C-N 124.491 1.119 . . . . 74.239999999999995 109.237 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.97 166.97 28.09 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.461 1.769 . . . . 74.230000000000004 110.969 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 182' ' ' ARG . . . . . 0.479 ' NH2' ' NH2' ' A' ' 174' ' ' ARG . 0.1 OUTLIER -56.98 -31.41 65.01 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.579 1.174 . . . . 74.010000000000005 110.34 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -57.15 -17.0 9.09 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.473 1.108 . . . . 70.530000000000001 110.317 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 184' ' ' ARG . . . . . 0.467 ' HB2' HD13 ' A' ' 180' ' ' LEU . 23.3 mmt85 -109.24 -14.18 14.52 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.49 1.119 . . . . 73.439999999999998 110.299 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 185' ' ' THR . . . . . 0.529 HG23 HD13 ' A' ' 139' ' ' LEU . 86.3 m -89.94 143.19 29.64 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.487 1.117 . . . . 71.239999999999995 110.395 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 186' ' ' PRO . . . . . 0.689 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.5 Cg_endo -74.95 144.54 30.57 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.52 1.8 . . . . 74.450000000000003 110.989 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 187' ' ' PHE . . . . . 0.629 ' O ' HG23 ' A' ' 191' ' ' THR . 22.5 p90 -60.84 -13.0 12.69 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.411 1.069 . . . . 62.109999999999999 110.981 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 188' ' ' ALA . . . . . 0.721 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -86.25 -54.6 4.35 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.553 1.158 . . . . 34.219999999999999 109.26 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.689 HD12 ' CG ' ' A' ' 186' ' ' PRO . 20.2 mt -74.14 -15.46 61.03 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.448 1.092 . . . . 63.210000000000001 109.299 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -84.75 -23.56 29.2 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.468 1.105 . . . . 72.120000000000005 110.248 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 191' ' ' THR . . . . . 0.629 HG23 ' O ' ' A' ' 187' ' ' PHE . 39.8 p -101.9 21.19 15.06 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 124.571 1.169 . . . . 64.319999999999993 110.403 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.721 HD12 ' O ' ' A' ' 188' ' ' ALA . 19.9 mt -124.64 154.69 32.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.492 1.12 . . . . 73.409999999999997 109.248 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -63.76 98.04 0.18 Allowed 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.517 1.136 . . . . 73.530000000000001 109.375 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 194' ' ' ALA . . . . . 0.804 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -92.39 151.77 20.08 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.585 1.178 . . . . 54.409999999999997 109.323 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 195' ' ' LEU . . . . . 0.734 HD23 ' CD1' ' A' ' 209' ' ' ILE . 0.3 OUTLIER -86.8 147.56 25.77 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.495 1.122 . . . . 71.530000000000001 109.316 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 196' ' ' GLU . . . . . 0.485 ' N ' HD13 ' A' ' 195' ' ' LEU . 25.0 mt-10 -143.77 141.02 30.22 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.478 1.111 . . . . 71.439999999999998 110.321 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.892 ' CD ' HD21 ' A' ' 176' ' ' LEU . 2.1 pt-20 -113.19 -17.47 12.35 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.494 1.121 . . . . 71.409999999999997 110.296 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 198' ' ' GLU . . . . . 0.561 ' HB3' HD12 ' A' ' 176' ' ' LEU . 0.0 OUTLIER -92.32 2.58 56.55 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 124.472 1.107 . . . . 62.43 110.363 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 36.3 t -99.16 165.32 11.77 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.499 1.124 . . . . 74.209999999999994 109.959 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 14.8 mtm180 -75.85 -27.48 57.85 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.525 1.141 . . . . 74.439999999999998 110.35 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -95.86 20.28 50.6 Favored Glycine 0 CA--C 1.528 0.892 0 O-C-N 124.537 1.148 . . . . 74.349999999999994 111.029 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 202' ' ' PHE . . . . . 0.781 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.1 OUTLIER -58.21 -43.22 98.1 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.45 0.736 . . . . 72.150000000000006 110.932 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 203' ' ' PRO . . . . . 0.627 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.5 Cg_endo -74.98 -30.32 7.32 Favored 'Trans proline' 0 C--N 1.359 1.108 0 O-C-N 124.529 1.805 . . . . 73.450000000000003 110.984 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.04 -65.56 0.67 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.53 1.144 . . . . 71.340000000000003 110.352 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -52.05 -39.4 59.58 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.481 1.113 . . . . 74.140000000000001 110.28 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 206' ' ' VAL . . . . . 1.032 HG11 ' CE2' ' A' ' 104' ' ' PHE . 47.3 t -60.84 -28.3 42.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.557 1.161 . . . . 52.329999999999998 109.308 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -83.06 -50.32 8.63 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.474 1.109 . . . . 70.310000000000002 110.241 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 208' ' ' ARG . . . . . 0.428 ' N ' ' HD2' ' A' ' 208' ' ' ARG . 9.5 mpt_? -61.18 -64.07 1.08 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.466 1.104 . . . . 70.439999999999998 110.261 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 209' ' ' ILE . . . . . 0.797 HG22 ' CD1' ' A' ' 210' ' ' PHE . 44.9 mt -47.07 -56.44 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 124.501 1.126 . . . . 72.340000000000003 109.263 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 210' ' ' PHE . . . . . 0.797 ' CD1' HG22 ' A' ' 209' ' ' ILE . 2.4 m-85 -101.2 67.58 1.18 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.598 1.186 . . . . 74.329999999999998 110.962 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 211' ' ' GLN . . . . . 0.419 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -110.7 145.33 38.19 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.485 1.115 . . . . 72.219999999999999 110.311 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' A' ' 215' ' ' TYR . 34.0 tt0 -49.45 -55.07 14.45 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.511 1.132 . . . . 75.420000000000002 110.326 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.94 -23.83 0.88 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.463 1.102 . . . . 65.319999999999993 109.918 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.419 HG23 ' HG2' ' A' ' 211' ' ' GLN . 20.0 t -95.66 -30.56 4.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 O-C-N 124.527 1.142 . . . . 74.439999999999998 109.322 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 215' ' ' TYR . . . . . 0.455 ' N ' ' O ' ' A' ' 212' ' ' GLU . 6.6 t80 -62.12 -25.11 67.55 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.467 1.104 . . . . 75.329999999999998 110.965 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 216' ' ' LYS . . . . . 0.413 ' O ' ' N ' ' A' ' 219' ' ' GLN . 3.9 mmtp -73.73 -61.65 1.77 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.504 1.128 . . . . 52.109999999999999 109.303 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 217' ' ' THR . . . . . 0.754 HG22 HD11 ' A' ' 221' ' ' ILE . 71.4 m -46.93 -48.54 21.39 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.487 1.117 . . . . 72.510000000000005 110.383 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -64.54 -25.08 67.83 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.469 1.106 . . . . 75.319999999999993 110.284 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 219' ' ' GLN . . . . . 0.413 ' N ' ' O ' ' A' ' 216' ' ' LYS . 4.7 tp-100 -83.64 -28.85 28.14 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.494 1.121 . . . . 74.129999999999995 110.256 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 220' ' ' THR . . . . . 0.459 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 3.0 m -85.11 -28.35 25.64 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.568 1.167 . . . . 75.340000000000003 110.426 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 221' ' ' ILE . . . . . 0.754 HD11 HG22 ' A' ' 217' ' ' THR . 46.2 mt -76.54 -32.76 21.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.473 1.108 . . . . 71.340000000000003 109.28 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 222' ' ' TRP . . . . . 0.686 ' O ' HG22 ' A' ' 225' ' ' THR . 18.2 t90 -74.29 -58.33 3.37 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.523 1.139 . . . . 61.420000000000002 107.989 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 223' ' ' LYS . . . . . 0.459 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -51.26 -22.63 2.84 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.551 1.157 . . . . 70.140000000000001 109.325 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -89.32 -35.22 16.24 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.528 1.142 . . . . 71.299999999999997 110.3 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.686 HG22 ' O ' ' A' ' 222' ' ' TRP . 1.9 t -63.08 -15.74 57.63 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.49 1.118 . . . . 54.149999999999999 110.35 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.28 -9.41 59.73 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.386 1.054 . . . . 74.319999999999993 110.284 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 227' ' ' ASN . . . . . 0.44 ' O ' ' N ' ' A' ' 231' ' ' ARG . 3.8 m-20 -92.22 -71.05 0.66 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.451 1.094 . . . . 74.310000000000002 109.3 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 228' ' ' MET . . . . . 0.464 ' CE ' ' HA ' ' A' ' 225' ' ' THR . 0.0 OUTLIER -43.32 -36.11 1.74 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.473 1.108 . . . . 63.130000000000003 110.97 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 229' ' ' VAL . . . . . 0.644 HG13 ' O ' ' A' ' 225' ' ' THR . 30.7 m -71.43 -53.95 19.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.548 1.155 . . . . 72.540000000000006 109.35 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 230' ' ' GLN . . . . . 0.549 ' N ' HG23 ' A' ' 229' ' ' VAL . 3.6 tp60 -68.29 -8.41 39.34 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.412 1.07 . . . . 74.420000000000002 110.258 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 231' ' ' ARG . . . . . 0.44 ' N ' ' O ' ' A' ' 227' ' ' ASN . 20.1 tpt180 -87.62 -83.27 0.21 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.493 1.121 . . . . 73.049999999999997 110.324 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -141.36 36.74 1.69 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.516 1.135 . . . . 51.039999999999999 110.287 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.86 33.88 0.68 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.503 1.127 . . . . 73.230000000000004 111.054 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 8.2 tt -57.06 152.41 2.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.551 1.157 . . . . 74.340000000000003 109.27 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.457 0 O-C-N 124.483 1.115 . . . . 73.209999999999994 109.313 -179.994 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.008 0 N-CA-C 110.998 -0.841 . . . . 61.210000000000001 110.998 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.01 144.05 29.76 Favored 'Trans proline' 0 C--N 1.36 1.166 0 O-C-N 124.56 1.821 . . . . 72.120000000000005 111.007 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.582 ' O ' HD13 ' A' ' 72' ' ' LEU . 1.5 tm? -76.82 -47.77 20.49 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.479 1.112 . . . . 63.210000000000001 109.257 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -119.48 117.41 3.6 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.451 1.095 . . . . 42.439999999999998 111.011 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 60.0 p -131.04 164.99 24.19 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.491 0.76 . . . . 53.520000000000003 109.959 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.9 tt0 -44.35 140.32 2.31 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.596 1.185 . . . . 74.420000000000002 110.331 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -133.01 144.13 49.88 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.518 1.137 . . . . 74.120000000000005 110.317 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.412 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.4 p -178.38 159.49 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.442 1.089 . . . . 65.109999999999999 109.285 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.532 ' O ' ' CD2' ' A' ' 78' ' ' PHE . 10.1 p90 -89.61 28.27 1.34 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.55 1.157 . . . . 70.400000000000006 110.977 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.415 ' C ' ' O ' ' A' ' 78' ' ' PHE . 4.3 tp -39.52 140.59 0.46 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.537 1.148 . . . . 74.049999999999997 109.268 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.488 ' CD ' ' O ' ' A' ' 107' ' ' LYS . 3.2 mtpt -75.99 -64.25 1.13 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.495 1.122 . . . . 72.109999999999999 109.26 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.815 ' CE1' HD11 ' A' ' 83' ' ' ILE . 0.1 OUTLIER -161.54 149.33 15.03 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.457 1.098 . . . . 70.319999999999993 111.001 -179.959 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 1.026 ' CG1' HG22 ' A' ' 135' ' ' THR . 7.7 p -97.81 169.62 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 O-C-N 124.441 1.088 . . . . 70.340000000000003 109.292 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.826 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.0 mp -132.63 92.2 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.49 1.119 . . . . 74.420000000000002 109.267 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.809 HD11 ' CB ' ' A' ' 128' ' ' ALA . 8.2 mt -70.17 117.81 12.2 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.49 1.119 . . . . 64.299999999999997 109.28 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.769 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -140.35 174.6 10.35 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.513 1.133 . . . . 64.439999999999998 109.583 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.772 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -102.78 164.36 11.68 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.52 1.138 . . . . 53.130000000000003 109.235 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.453 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 21.9 tt0 -69.78 -6.78 34.48 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.586 1.179 . . . . 74.109999999999999 110.262 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -89.9 -46.07 8.8 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.435 1.085 . . . . 71.150000000000006 109.252 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -114.57 44.12 1.79 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.409 1.068 . . . . 62.219999999999999 109.28 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.595 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -78.85 -22.99 45.26 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.512 1.132 . . . . 73.040000000000006 110.432 179.948 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -82.51 -30.2 29.97 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.459 1.099 . . . . 71.239999999999995 109.356 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.411 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -70.22 -57.54 4.78 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.478 1.111 . . . . 75.209999999999994 110.226 -179.958 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 1.035 ' HB2' ' CD2' ' A' ' 138' ' ' LEU . . . -55.19 -35.24 64.62 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.508 1.13 . . . . 43.0 109.298 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.853 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -72.4 -44.32 62.65 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.526 1.141 . . . . 33.32 109.335 179.953 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.687 ' N ' HD13 ' A' ' 94' ' ' LEU . 15.2 tpp180 -48.3 -29.49 3.93 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.479 1.112 . . . . 72.019999999999996 110.303 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.595 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.1 t -81.02 -64.62 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.497 1.123 . . . . 73.409999999999997 109.282 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.481 ' HA ' HD12 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -41.04 -26.21 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.512 1.132 . . . . 72.519999999999996 110.309 -179.968 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.458 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.1 t-20 -72.4 -58.09 3.67 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.449 1.093 . . . . 63.450000000000003 109.333 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.849 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -64.92 -22.28 66.97 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.503 1.127 . . . . 73.209999999999994 109.265 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.849 ' N ' HD23 ' A' ' 99' ' ' LEU . 22.2 mt -62.99 -57.3 11.18 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.481 1.113 . . . . 72.349999999999994 109.301 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.46 58.44 1.01 Allowed 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.47 1.106 . . . . 62.25 110.318 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -178.66 -62.99 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.496 1.123 . . . . 74.099999999999994 109.36 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.416 ' HB3' ' CD2' ' A' ' 104' ' ' PHE . 19.9 t0 -51.86 -49.77 62.26 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 62.130000000000003 109.303 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.506 ' CE2' HG11 ' A' ' 206' ' ' VAL . 0.9 OUTLIER -114.47 -26.54 7.9 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.565 1.165 . . . . 74.019999999999996 111.018 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.436 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 93.54 45.63 3.41 Favored Glycine 0 CA--C 1.529 0.957 0 O-C-N 124.476 1.11 . . . . 63.329999999999998 111.017 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 12.1 mm -84.42 69.34 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.442 0.731 . . . . 51.399999999999999 109.252 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.538 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -115.58 156.35 46.21 Favored Pre-proline 0 C--N 1.325 -0.499 0 O-C-N 124.483 1.114 . . . . 73.530000000000001 109.296 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.538 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.5 Cg_endo -74.92 157.96 99.27 Favored 'Cis proline' 0 C--N 1.36 1.181 0 C-N-CA 121.077 -2.468 . . . . 74.450000000000003 110.957 0.073 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -122.86 133.01 8.9 Favored Glycine 0 CA--C 1.532 1.096 0 O-C-N 124.535 1.147 . . . . 41.219999999999999 110.986 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -154.64 135.02 4.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.534 0.785 . . . . 62.310000000000002 109.354 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.793 HD13 ' HB2' ' A' ' 94' ' ' LEU . 38.2 pt -91.07 176.46 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.449 1.093 . . . . 73.209999999999994 109.292 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.709 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 2.2 t80 -78.71 -19.2 52.96 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.503 1.127 . . . . 74.510000000000005 110.995 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -90.08 -3.59 57.85 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.521 1.138 . . . . 55.0 109.279 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -110.49 -26.41 9.52 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.515 1.134 . . . . 64.120000000000005 110.239 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 6.1 ttm -38.55 111.1 0.6 Allowed Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.525 1.141 . . . . 73.530000000000001 110.991 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 76.45 3.39 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.533 1.807 . . . . 73.209999999999994 111.004 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -125.15 174.11 8.29 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.534 1.146 . . . . 73.409999999999997 109.618 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.69 -179.82 4.61 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.594 1.184 . . . . 75.340000000000003 110.987 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 30.0 mtp85 -117.55 42.15 2.66 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.395 0.703 . . . . 55.219999999999999 110.348 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -78.84 -61.38 2.03 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.483 1.114 . . . . 62.43 110.326 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -167.72 132.66 1.88 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.517 1.135 . . . . 74.049999999999997 109.641 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.66 ' H ' HD12 ' A' ' 122' ' ' LEU . 0.1 OUTLIER -103.94 22.58 14.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.5 1.125 . . . . 74.239999999999995 109.291 -179.923 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -70.79 -52.5 20.2 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.516 1.135 . . . . 75.439999999999998 110.326 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -58.34 101.79 0.09 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.576 1.172 . . . . 74.340000000000003 109.276 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.842 HD22 HD12 ' A' ' 157' ' ' LEU . 0.2 OUTLIER -85.52 -17.14 37.25 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.403 1.064 . . . . 64.219999999999999 109.299 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.482 ' N ' HD12 ' A' ' 125' ' ' LEU . 7.8 t0 -45.31 -59.23 2.77 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.509 1.13 . . . . 61.200000000000003 109.321 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -44.65 -39.25 4.9 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.536 1.147 . . . . 54.549999999999997 109.285 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.809 ' CB ' HD11 ' A' ' 84' ' ' LEU . . . -50.38 -50.49 51.31 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.504 1.128 . . . . 52.109999999999999 109.297 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.507 ' O ' ' CB ' ' A' ' 168' ' ' ASN . 34.6 m -92.48 31.16 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.438 1.086 . . . . 64.030000000000001 109.218 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -114.08 149.18 35.9 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.492 1.12 . . . . 72.310000000000002 109.254 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 39.66 70.03 0.38 Allowed Glycine 0 CA--C 1.531 1.063 0 O-C-N 124.54 1.15 . . . . 63.020000000000003 110.983 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -163.6 179.77 6.98 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.545 0.791 . . . . 65.430000000000007 110.063 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.764 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -102.49 -43.06 5.75 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.526 1.141 . . . . 73.519999999999996 109.279 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.764 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 0.7 OUTLIER -154.99 169.89 23.03 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.534 1.146 . . . . 73.319999999999993 108.05 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 135' ' ' THR . . . . . 1.026 HG22 ' CG1' ' A' ' 82' ' ' VAL . 1.2 p -137.99 158.32 44.57 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 65.049999999999997 110.374 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.826 ' HB ' HG23 ' A' ' 83' ' ' ILE . 10.5 mm -110.98 142.26 23.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.53 1.144 . . . . 52.030000000000001 109.257 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.802 HD13 ' O ' ' A' ' 136' ' ' ILE . 0.5 OUTLIER -134.69 96.46 3.56 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.462 1.101 . . . . 73.019999999999996 109.31 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 1.035 ' CD2' ' HB2' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.43 96.72 0.08 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.547 1.154 . . . . 73.239999999999995 109.278 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.725 HD11 HD13 ' A' ' 189' ' ' LEU . 0.2 OUTLIER -61.23 102.81 0.24 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.468 1.105 . . . . 52.32 109.291 -179.971 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.443 ' O ' ' N ' ' A' ' 144' ' ' LEU . 2.6 m -130.47 155.59 46.19 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.446 1.091 . . . . 63.210000000000001 110.397 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -64.42 -36.39 84.0 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.546 1.154 . . . . 63.549999999999997 110.313 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -84.1 -25.93 29.35 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.469 1.106 . . . . 72.200000000000003 109.366 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.772 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 52.9 t80 -85.67 -19.93 30.17 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.479 1.112 . . . . 60.229999999999997 111.06 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.707 HD13 ' C ' ' A' ' 144' ' ' LEU . 2.0 tm? -66.23 -67.23 0.46 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.495 1.122 . . . . 64.239999999999995 109.299 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.45 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 22.4 mmt180 -55.17 -19.69 8.49 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.481 1.113 . . . . 73.129999999999995 110.355 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -71.96 -67.2 0.55 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.475 1.11 . . . . 74.030000000000001 109.318 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.478 HG21 ' CE1' ' A' ' 143' ' ' PHE . 3.1 p -66.84 -54.62 20.54 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.542 1.151 . . . . 75.120000000000005 110.4 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.519 ' CZ3' ' HE3' ' A' ' 158' ' ' MET . 3.3 t-105 -43.08 -36.54 1.67 Allowed 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.518 1.136 . . . . 75.109999999999999 108.029 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 149' ' ' CYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 43.7 t -78.64 -45.33 21.77 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.61 1.194 . . . . 74.120000000000005 108.354 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' ASN . . . . . 0.453 ' N ' ' O ' ' A' ' 147' ' ' THR . 0.1 OUTLIER -56.51 -21.83 28.7 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.432 1.082 . . . . 72.5 109.319 179.946 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.771 ' HE1' HD13 ' A' ' 157' ' ' LEU . 10.7 m-30 -77.06 -51.78 10.46 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.558 1.161 . . . . 75.140000000000001 111.027 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 38.6 tt0 -42.46 -40.9 2.74 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.475 1.109 . . . . 71.109999999999999 110.3 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -88.81 -23.63 22.8 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.465 1.103 . . . . 74.450000000000003 110.924 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.564 ' CE2' ' HB2' ' A' ' 156' ' ' SER . 6.8 t80 -135.17 87.91 2.37 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.481 1.113 . . . . 71.400000000000006 111.116 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.84 -4.65 29.19 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.525 1.141 . . . . 75.420000000000002 110.416 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 156' ' ' SER . . . . . 0.564 ' HB2' ' CE2' ' A' ' 154' ' ' TYR . 0.7 OUTLIER -54.68 -34.39 62.23 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.521 1.138 . . . . 65.340000000000003 109.994 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.842 HD12 HD22 ' A' ' 125' ' ' LEU . 0.9 OUTLIER -83.06 -31.43 27.37 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.49 1.119 . . . . 74.040000000000006 109.242 -179.967 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 158' ' ' MET . . . . . 0.9 ' O ' HG22 ' A' ' 161' ' ' VAL . 3.5 mmt -58.94 -37.42 76.68 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.493 1.121 . . . . 72.200000000000003 110.956 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -84.11 -9.62 58.44 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.453 1.095 . . . . 72.439999999999998 109.359 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.921 ' HB3' HG21 ' A' ' 170' ' ' VAL . 0.3 OUTLIER -82.8 -31.37 28.21 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.43 1.082 . . . . 73.409999999999997 110.037 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 161' ' ' VAL . . . . . 0.9 HG22 ' O ' ' A' ' 158' ' ' MET . 29.8 m -62.18 -18.04 19.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 124.45 1.094 . . . . 61.399999999999999 109.248 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 42.0 m-20 -78.8 0.59 26.37 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.558 1.161 . . . . 62.350000000000001 109.234 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.724 ' NE ' HG23 ' A' ' 192' ' ' ILE . 0.0 OUTLIER 50.55 49.96 19.8 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.478 1.111 . . . . 43.310000000000002 110.281 179.974 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -50.63 -177.98 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.497 1.123 . . . . 65.519999999999996 110.312 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 22.1 p80 -93.26 39.58 1.05 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.548 1.155 . . . . 64.109999999999999 109.572 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.562 ' C ' HG21 ' A' ' 221' ' ' ILE . 2.7 tptt -94.71 179.33 5.29 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.536 1.147 . . . . 74.0 109.317 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 167' ' ' TYR . . . . . . . . . . . . . 24.4 p90 -84.95 44.27 1.06 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.489 1.118 . . . . 72.019999999999996 110.979 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.507 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 19.5 p30 -170.51 142.31 2.06 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 62.340000000000003 109.352 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.481 ' O ' ' N ' ' A' ' 135' ' ' THR . 1.4 t -128.14 128.4 44.77 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.555 1.159 . . . . 54.43 109.982 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.921 HG21 ' HB3' ' A' ' 160' ' ' SER . 8.9 t -95.59 107.18 19.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.507 1.129 . . . . 71.310000000000002 109.319 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.662 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -121.48 106.31 37.92 Favored Pre-proline 0 C--N 1.324 -0.512 0 O-C-N 124.511 1.132 . . . . 71.540000000000006 109.338 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 172' ' ' PRO . . . . . 0.884 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -74.98 116.24 4.53 Favored 'Trans proline' 0 C--N 1.359 1.118 0 O-C-N 124.52 1.8 . . . . 60.140000000000001 111.016 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 173' ' ' MET . . . . . 0.667 ' CE ' HD12 ' A' ' 195' ' ' LEU . 3.6 ttt -92.46 152.46 19.67 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.492 1.12 . . . . 74.109999999999999 110.997 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 174' ' ' ARG . . . . . 0.44 ' N ' ' HG2' ' A' ' 173' ' ' MET . 3.6 tpp180 -104.78 116.81 60.27 Favored Pre-proline 0 C--N 1.325 -0.47 0 O-C-N 124.52 1.138 . . . . 61.350000000000001 110.301 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 175' ' ' PRO . . . . . 0.469 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.1 Cg_endo -75.05 153.85 41.84 Favored 'Trans proline' 0 C--N 1.36 1.183 0 O-C-N 124.47 1.774 . . . . 72.200000000000003 110.999 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.901 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -87.31 -43.79 11.9 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.463 1.102 . . . . 43.539999999999999 109.307 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -71.81 -27.21 62.77 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.51 1.131 . . . . 74.239999999999995 109.284 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 178' ' ' ASN . . . . . 0.469 ' CB ' ' HG2' ' A' ' 175' ' ' PRO . 7.1 m-80 -110.85 97.86 35.63 Favored Pre-proline 0 C--N 1.326 -0.445 0 O-C-N 124.435 1.085 . . . . 61.130000000000003 109.307 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.95 121.38 6.56 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.562 1.822 . . . . 74.400000000000006 111.081 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.519 HD13 ' HB2' ' A' ' 184' ' ' ARG . 0.4 OUTLIER -128.9 96.49 29.15 Favored Pre-proline 0 C--N 1.324 -0.527 0 O-C-N 124.575 1.172 . . . . 64.420000000000002 109.327 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.04 171.54 18.12 Favored 'Trans proline' 0 C--N 1.359 1.124 0 O-C-N 124.554 1.818 . . . . 73.049999999999997 110.971 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 7.6 ptp85 -59.66 -23.41 63.03 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.531 1.145 . . . . 71.439999999999998 110.278 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 183' ' ' GLU . . . . . 0.414 ' HG2' ' N ' ' A' ' 184' ' ' ARG . 2.7 pt-20 -70.05 -29.23 66.2 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.459 1.099 . . . . 60.350000000000001 110.337 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 184' ' ' ARG . . . . . 0.519 ' HB2' HD13 ' A' ' 180' ' ' LEU . 27.7 mmt180 -95.41 -18.74 20.47 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.542 1.151 . . . . 74.019999999999996 110.31 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 185' ' ' THR . . . . . 0.499 HG22 ' HD2' ' A' ' 186' ' ' PRO . 19.9 m -80.9 143.95 54.5 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.516 1.135 . . . . 75.329999999999998 110.381 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 186' ' ' PRO . . . . . 0.737 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.1 Cg_endo -75.08 155.61 42.55 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.475 1.776 . . . . 72.209999999999994 110.927 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 187' ' ' PHE . . . . . 0.503 ' O ' ' CG2' ' A' ' 191' ' ' THR . 9.2 p90 -69.4 -7.1 34.62 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.513 1.133 . . . . 72.299999999999997 111.04 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 188' ' ' ALA . . . . . 0.627 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -93.97 -53.14 4.11 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.523 1.139 . . . . 74.030000000000001 109.3 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.863 HD22 ' HG3' ' A' ' 172' ' ' PRO . 53.2 mt -68.3 -42.4 79.52 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.424 1.078 . . . . 74.209999999999994 109.281 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 190' ' ' GLN . . . . . 0.411 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 6.9 pt20 -63.82 -10.96 23.12 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.512 1.132 . . . . 74.219999999999999 110.327 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 191' ' ' THR . . . . . 0.503 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 36.2 p -113.6 18.31 17.66 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.429 1.08 . . . . 75.030000000000001 110.393 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.738 HD13 ' O ' ' A' ' 161' ' ' VAL . 4.9 mt -136.37 142.46 38.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.462 1.101 . . . . 73.0 109.265 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -48.23 124.31 7.64 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.515 1.135 . . . . 70.540000000000006 109.319 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 194' ' ' ALA . . . . . 0.884 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -121.09 155.05 35.28 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.463 1.102 . . . . 70.230000000000004 109.311 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 195' ' ' LEU . . . . . 0.707 HD23 HD12 ' A' ' 209' ' ' ILE . 0.3 OUTLIER -82.27 134.22 35.27 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.538 1.149 . . . . 74.209999999999994 109.278 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 196' ' ' GLU . . . . . 0.412 ' O ' ' HA ' ' A' ' 202' ' ' PHE . 31.0 mt-10 -112.72 131.47 55.65 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.455 1.097 . . . . 72.409999999999997 110.259 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.901 ' HG3' HD21 ' A' ' 176' ' ' LEU . 3.8 tp10 -113.42 -25.37 8.83 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.491 1.119 . . . . 61.439999999999998 110.369 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -96.98 3.95 51.77 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.515 1.135 . . . . 54.219999999999999 110.299 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 19.5 t -97.26 174.27 6.8 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.545 1.153 . . . . 64.019999999999996 109.966 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -83.47 -32.89 25.77 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.54 1.15 . . . . 75.120000000000005 110.253 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -87.71 19.34 33.67 Favored Glycine 0 CA--C 1.529 0.941 0 O-C-N 124.568 1.167 . . . . 71.420000000000002 111.034 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 202' ' ' PHE . . . . . 0.819 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.1 OUTLIER -56.8 -43.42 99.36 Favored Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.454 0.738 . . . . 72.420000000000002 110.98 -179.971 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 203' ' ' PRO . . . . . 0.615 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.0 Cg_endo -75.02 -28.91 8.73 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.486 1.782 . . . . 63.210000000000001 110.964 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 204' ' ' THR . . . . . 0.402 HG22 ' N ' ' A' ' 205' ' ' GLN . 0.9 OUTLIER -64.69 -65.1 0.72 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.449 1.093 . . . . 60.340000000000003 110.405 179.987 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 205' ' ' GLN . . . . . 0.402 ' N ' HG22 ' A' ' 204' ' ' THR . 5.8 mt-30 -50.38 -44.31 54.78 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.458 1.099 . . . . 61.409999999999997 110.318 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 206' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 202' ' ' PHE . 72.5 t -56.2 -29.44 27.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.453 1.096 . . . . 70.519999999999996 109.363 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -82.8 -51.54 7.57 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.517 1.136 . . . . 52.020000000000003 110.297 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 208' ' ' ARG . . . . . 0.42 ' N ' ' HD2' ' A' ' 208' ' ' ARG . 11.6 mpt_? -58.21 -62.52 1.77 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.543 1.152 . . . . 73.230000000000004 110.377 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 209' ' ' ILE . . . . . 0.707 HD12 HD23 ' A' ' 195' ' ' LEU . 84.6 mt -49.85 -51.29 16.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.516 1.135 . . . . 72.420000000000002 109.306 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 210' ' ' PHE . . . . . 0.685 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.2 m-85 -101.49 61.71 0.92 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.494 1.121 . . . . 73.230000000000004 111.016 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 211' ' ' GLN . . . . . 0.544 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -110.94 145.85 37.62 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.507 1.13 . . . . 73.019999999999996 110.334 180.0 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.452 ' O ' ' N ' ' A' ' 215' ' ' TYR . 32.4 tt0 -49.43 -55.02 14.55 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.506 1.129 . . . . 73.420000000000002 110.306 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.04 -23.59 1.24 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.495 1.122 . . . . 74.450000000000003 110.083 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.544 HG23 ' HG2' ' A' ' 211' ' ' GLN . 38.9 t -96.22 -27.49 4.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.538 1.149 . . . . 70.519999999999996 109.321 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 215' ' ' TYR . . . . . 0.452 ' N ' ' O ' ' A' ' 212' ' ' GLU . 3.4 t80 -63.87 -28.72 70.04 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.495 1.122 . . . . 74.209999999999994 111.01 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 216' ' ' LYS . . . . . 0.439 ' O ' ' N ' ' A' ' 220' ' ' THR . 64.2 mmtt -60.0 -65.28 0.71 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.547 1.154 . . . . 73.510000000000005 109.352 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 217' ' ' THR . . . . . 0.797 HG22 HD11 ' A' ' 221' ' ' ILE . 34.7 m -40.58 -62.94 0.7 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.546 1.154 . . . . 73.430000000000007 110.398 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 218' ' ' GLN . . . . . 0.533 ' HA ' HD12 ' A' ' 221' ' ' ILE . 93.4 mm-40 -50.15 -63.31 1.15 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.52 1.137 . . . . 70.239999999999995 110.342 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -52.99 -20.2 3.24 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.561 1.163 . . . . 74.120000000000005 110.274 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 220' ' ' THR . . . . . 0.439 ' N ' ' O ' ' A' ' 216' ' ' LYS . 0.9 OUTLIER -87.49 -29.69 21.18 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.476 1.11 . . . . 74.439999999999998 110.435 -179.939 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 221' ' ' ILE . . . . . 0.797 HD11 HG22 ' A' ' 217' ' ' THR . 10.0 mt -78.86 -35.24 17.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.485 1.116 . . . . 71.109999999999999 109.305 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 222' ' ' TRP . . . . . 0.803 ' O ' HG22 ' A' ' 225' ' ' THR . 25.1 t90 -69.91 -55.0 10.86 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.492 1.12 . . . . 74.049999999999997 108.047 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -22.03 55.9 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.467 1.104 . . . . 75.239999999999995 109.356 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 224' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 220' ' ' THR . 67.9 mt-10 -86.57 -36.73 18.73 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.539 1.149 . . . . 55.020000000000003 110.354 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.803 HG22 ' O ' ' A' ' 222' ' ' TRP . 3.0 t -61.55 -20.57 63.41 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.52 1.138 . . . . 73.019999999999996 110.414 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 5.2 mtm180 -75.82 -24.73 55.87 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.514 1.134 . . . . 74.5 110.315 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 227' ' ' ASN . . . . . 0.447 ' O ' ' CG ' ' A' ' 231' ' ' ARG . 2.4 m-20 -78.41 -43.47 27.33 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.547 1.154 . . . . 62.340000000000003 109.286 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 43.9 mtm -58.28 -34.33 70.41 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.522 1.139 . . . . 75.200000000000003 110.999 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 229' ' ' VAL . . . . . 0.734 HG13 ' HA ' ' A' ' 234' ' ' ILE . 25.0 t -75.81 -57.26 6.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.487 1.117 . . . . 65.340000000000003 109.362 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 230' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -60.32 -15.25 23.76 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.46 1.1 . . . . 70.319999999999993 110.272 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 231' ' ' ARG . . . . . 0.447 ' CG ' ' O ' ' A' ' 227' ' ' ASN . 34.1 mmm-85 -89.86 -89.61 0.15 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.492 1.12 . . . . 70.099999999999994 110.248 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 9.5 tm0? -134.85 62.03 1.66 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.462 1.102 . . . . 74.040000000000006 110.343 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 233' ' ' PHE . . . . . 0.944 ' C ' HD12 ' A' ' 234' ' ' ILE . 1.5 t80 -176.63 -176.36 0.72 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.561 1.163 . . . . 64.140000000000001 111.0 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.944 HD12 ' C ' ' A' ' 233' ' ' PHE . 2.4 mp -134.71 162.79 38.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.504 1.127 . . . . 64.439999999999998 109.318 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 235' ' ' ALA . . . . . 0.473 ' N ' ' CG2' ' A' ' 234' ' ' ILE . . . . . . . . 0 C--N 1.325 -0.468 0 O-C-N 124.517 1.136 . . . . 73.519999999999996 109.292 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.036 0 N-CA-C 110.951 -0.86 . . . . 65.140000000000001 110.951 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.95 170.88 19.42 Favored 'Trans proline' 0 C--N 1.359 1.13 0 O-C-N 124.491 1.785 . . . . 75.140000000000001 110.993 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.68 -45.4 68.42 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 124.51 1.132 . . . . 74.340000000000003 109.31 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -164.97 61.05 0.24 Allowed Glycine 0 CA--C 1.531 1.033 0 O-C-N 124.468 1.105 . . . . 54.420000000000002 111.018 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -128.61 171.96 11.66 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.584 0.814 . . . . 72.519999999999996 109.985 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -92.64 145.95 24.03 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.478 1.111 . . . . 74.409999999999997 110.314 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -128.36 129.21 45.9 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.495 1.122 . . . . 64.409999999999997 110.285 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.512 HG22 ' N ' ' A' ' 78' ' ' PHE . 3.3 p -127.15 165.69 25.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.42 1.075 . . . . 65.129999999999995 109.334 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.512 ' N ' HG22 ' A' ' 77' ' ' VAL . 2.3 t80 -88.87 24.29 2.1 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.535 1.147 . . . . 74.200000000000003 111.046 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.794 HD11 HG22 ' A' ' 110' ' ' ILE . 3.6 tp -40.35 159.33 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.464 1.102 . . . . 75.329999999999998 109.302 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.657 ' HD3' HG22 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -106.24 -49.42 3.36 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.47 1.106 . . . . 73.239999999999995 109.292 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.597 ' CD1' ' O ' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -167.07 132.26 2.07 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.513 1.133 . . . . 74.540000000000006 110.968 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.52 ' CG2' ' CE ' ' A' ' 115' ' ' MET . 3.1 p -90.14 158.17 2.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.487 1.117 . . . . 42.520000000000003 109.293 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.767 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.0 mp -113.56 94.58 3.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 O-C-N 124.46 1.1 . . . . 52.32 109.276 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.06 HD11 ' HB3' ' A' ' 128' ' ' ALA . 5.0 mt -70.25 118.03 12.56 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.523 1.14 . . . . 72.400000000000006 109.362 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.6 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -136.62 173.74 11.38 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.532 1.145 . . . . 53.329999999999998 109.566 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -111.19 163.66 13.68 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.458 1.099 . . . . 72.109999999999999 109.291 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.415 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 10.3 tt0 -65.46 -10.7 36.45 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.562 1.164 . . . . 72.010000000000005 110.36 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -85.38 -44.89 12.39 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.501 1.126 . . . . 62.420000000000002 109.311 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.447 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.6 OUTLIER -119.31 43.3 2.64 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.525 1.14 . . . . 73.349999999999994 109.364 179.945 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.457 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -71.84 -42.92 66.36 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.51 1.131 . . . . 71.340000000000003 110.358 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -64.49 -40.23 95.28 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.46 1.1 . . . . 62.229999999999997 109.277 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.408 ' CD ' ' C ' ' A' ' 92' ' ' GLU . 0.5 OUTLIER -53.28 -69.72 0.11 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.527 1.142 . . . . 75.239999999999995 110.298 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.699 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -43.03 -32.14 0.63 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.565 1.166 . . . . 51.530000000000001 109.329 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.659 ' HG ' HD13 ' A' ' 111' ' ' ILE . 0.8 OUTLIER -67.5 -57.25 6.84 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.468 1.105 . . . . 52.530000000000001 109.27 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.11 -35.25 0.54 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.594 1.183 . . . . 73.019999999999996 110.355 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.653 HG21 ' HE1' ' A' ' 173' ' ' MET . 0.9 OUTLIER -79.31 -65.82 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 O-C-N 124.466 1.104 . . . . 64.510000000000005 109.307 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.814 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -42.21 -24.78 0.06 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.515 1.135 . . . . 74.040000000000006 110.329 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.448 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.2 OUTLIER -74.32 -59.06 2.9 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.561 1.163 . . . . 74.019999999999996 109.306 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.873 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -62.47 -22.58 66.34 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.421 1.076 . . . . 63.509999999999998 109.271 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.873 ' N ' HD23 ' A' ' 99' ' ' LEU . 39.0 mt -73.65 -39.21 64.64 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.533 1.146 . . . . 55.299999999999997 109.311 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.464 ' HB2' ' CD ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -87.84 46.77 1.42 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.579 1.174 . . . . 63.5 110.318 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -175.8 -60.39 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.543 1.152 . . . . 51.100000000000001 109.253 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.509 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 49.0 t0 -40.45 -63.17 0.67 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.541 1.15 . . . . 73.150000000000006 109.324 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.939 ' CE2' HG11 ' A' ' 206' ' ' VAL . 4.9 m-85 -103.02 -14.62 16.38 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.465 1.103 . . . . 73.430000000000007 111.017 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.82 39.23 7.14 Favored Glycine 0 CA--C 1.53 1.009 0 O-C-N 124.514 1.134 . . . . 61.020000000000003 110.952 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.657 HG22 ' HD3' ' A' ' 80' ' ' LYS . 11.0 mm -75.57 72.21 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 O-C-N 124.516 0.774 . . . . 63.130000000000003 109.349 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.55 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -118.38 151.79 49.99 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.476 1.11 . . . . 74.040000000000006 109.363 179.996 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.55 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.0 147.46 89.33 Favored 'Cis proline' 0 C--N 1.36 1.169 0 C-N-CA 121.01 -2.496 . . . . 73.420000000000002 110.977 0.023 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -124.34 135.04 9.4 Favored Glycine 0 CA--C 1.531 1.068 0 O-C-N 124.431 1.082 . . . . 72.109999999999999 110.942 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.794 HG22 HD11 ' A' ' 79' ' ' LEU . 9.9 tt -156.94 153.94 6.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.499 0.764 . . . . 75.340000000000003 109.332 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.814 HG23 ' HG2' ' A' ' 97' ' ' GLN . 8.7 pt -95.98 -177.06 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.549 1.156 . . . . 65.430000000000007 109.319 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.606 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 5.4 t80 -80.92 -19.08 45.06 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.54 1.15 . . . . 62.43 110.959 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.441 ' HB2' ' HE1' ' A' ' 85' ' ' HIS . . . -91.6 -12.87 33.05 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.496 1.122 . . . . 42.140000000000001 109.294 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.419 ' C ' HD11 ' A' ' 110' ' ' ILE . 37.6 mm-40 -97.62 -24.53 15.49 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.475 1.109 . . . . 72.219999999999999 110.324 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.52 ' CE ' ' CG2' ' A' ' 82' ' ' VAL . 7.4 ttm -46.03 143.93 3.2 Favored Pre-proline 0 C--N 1.324 -0.511 0 O-C-N 124.421 1.076 . . . . 62.119999999999997 111.007 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.473 ' HD2' ' CG ' ' A' ' 115' ' ' MET . 18.0 Cg_endo -75.01 71.46 5.0 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.527 1.804 . . . . 70.030000000000001 110.95 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -97.53 -43.38 7.26 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.484 1.115 . . . . 73.030000000000001 109.597 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 78.47 -68.24 2.98 Favored Glycine 0 CA--C 1.53 1.002 0 O-C-N 124.507 1.13 . . . . 72.319999999999993 111.044 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 64.3 mtp180 -47.28 171.02 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.533 0.784 . . . . 62.329999999999998 110.231 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -101.08 -68.24 0.82 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.523 1.14 . . . . 73.420000000000002 110.264 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -46.63 144.16 2.39 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.505 1.128 . . . . 75.409999999999997 109.577 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -104.46 138.37 40.94 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.476 1.11 . . . . 72.049999999999997 109.319 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -76.77 -65.12 0.98 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.536 1.148 . . . . 65.109999999999999 110.3 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -159.67 172.55 17.55 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.484 1.115 . . . . 74.420000000000002 109.315 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.54 HD12 ' N ' ' A' ' 126' ' ' ASP . 0.2 OUTLIER -85.36 -17.26 37.27 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.462 1.101 . . . . 60.420000000000002 109.323 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.54 ' N ' HD12 ' A' ' 125' ' ' LEU . 3.9 p-10 -67.86 -15.36 63.58 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.462 1.101 . . . . 71.439999999999998 109.284 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.407 ' O ' ' ND2' ' A' ' 130' ' ' ASN . 66.7 m-20 -62.3 -27.6 69.15 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.536 1.148 . . . . 74.150000000000006 109.402 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 1.06 ' HB3' HD11 ' A' ' 84' ' ' LEU . . . -93.14 -13.12 28.85 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.495 1.122 . . . . 75.239999999999995 109.352 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.728 ' O ' HG12 ' A' ' 129' ' ' VAL . 71.1 t -92.86 30.44 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 124.593 1.183 . . . . 74.049999999999997 109.247 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.407 ' ND2' ' O ' ' A' ' 127' ' ' ASP . 28.3 p30 -135.81 151.18 49.81 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.553 1.158 . . . . 74.530000000000001 109.306 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 42.87 64.53 1.64 Allowed Glycine 0 CA--C 1.53 0.972 0 O-C-N 124.582 1.176 . . . . 64.129999999999995 111.005 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -163.61 -174.29 3.64 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.48 0.753 . . . . 54.329999999999998 109.96 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.608 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -113.71 -35.91 5.04 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.539 1.149 . . . . 71.439999999999998 109.302 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.687 ' HB3' HD13 ' A' ' 171' ' ' ILE . 0.6 OUTLIER -159.07 163.58 36.15 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.556 1.16 . . . . 73.5 108.039 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 28.4 p -131.42 135.47 47.19 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.532 1.145 . . . . 64.25 110.383 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.767 ' HB ' HG23 ' A' ' 83' ' ' ILE . 36.4 mm -84.31 136.99 21.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.485 1.116 . . . . 64.030000000000001 109.314 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.717 HD23 ' O ' ' A' ' 136' ' ' ILE . 21.2 mt -129.7 99.08 5.01 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.582 1.176 . . . . 51.219999999999999 109.338 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.699 HD21 ' HB2' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.26 88.19 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.573 1.171 . . . . 64.409999999999997 109.295 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 18.6 mt -56.93 99.19 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.495 1.122 . . . . 71.439999999999998 109.322 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.612 HG23 ' OD1' ' A' ' 178' ' ' ASN . 10.1 m -124.03 177.31 5.86 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.531 1.144 . . . . 72.439999999999998 110.458 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.567 ' H ' HG22 ' A' ' 140' ' ' THR . 18.9 mt-10 -80.32 -33.7 37.31 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.435 1.085 . . . . 74.25 110.23 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -89.58 -20.84 23.26 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.492 1.12 . . . . 60.340000000000003 109.334 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.478 ' CZ ' HG21 ' A' ' 147' ' ' THR . 19.6 t80 -89.8 -46.34 8.65 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.554 1.159 . . . . 71.400000000000006 111.078 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.761 HD13 ' C ' ' A' ' 144' ' ' LEU . 1.5 tm? -46.88 -61.08 2.02 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.469 1.106 . . . . 71.450000000000003 109.242 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 9.9 mmt85 -60.59 -20.69 61.28 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.488 1.117 . . . . 72.409999999999997 110.27 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -71.89 -66.43 0.64 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.568 1.167 . . . . 71.219999999999999 109.26 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.478 HG21 ' CZ ' ' A' ' 143' ' ' PHE . 16.5 p -69.37 -54.52 14.03 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.457 1.098 . . . . 72.439999999999998 110.38 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.471 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 24.1 t-105 -42.17 -38.05 1.62 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.962 -1.125 . . . . 72.439999999999998 107.962 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 149' ' ' CYS . . . . . 0.446 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 53.3 t -79.02 -45.33 20.42 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.524 1.14 . . . . 71.120000000000005 108.295 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 150' ' ' ASN . . . . . 0.439 ' N ' ' O ' ' A' ' 147' ' ' THR . 3.0 t30 -57.91 -17.78 18.88 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.484 1.115 . . . . 65.150000000000006 109.306 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.561 ' HD2' ' HE3' ' A' ' 158' ' ' MET . 9.7 m-30 -83.06 -46.35 12.93 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 75.409999999999997 111.004 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -49.21 -33.51 12.67 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.48 1.113 . . . . 65.239999999999995 110.287 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -97.29 -19.83 18.28 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.45 1.094 . . . . 75.120000000000005 111.023 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.48 ' CE1' ' HB2' ' A' ' 156' ' ' SER . 0.4 OUTLIER -128.59 94.94 3.99 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.535 1.147 . . . . 74.400000000000006 111.006 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.401 ' O ' ' N ' ' A' ' 158' ' ' MET . 3.5 t -64.53 -21.23 66.63 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.526 1.141 . . . . 75.150000000000006 110.355 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 156' ' ' SER . . . . . 0.48 ' HB2' ' CE1' ' A' ' 154' ' ' TYR . 18.8 t -40.13 -48.16 2.46 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.503 1.127 . . . . 63.310000000000002 109.997 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.445 HD21 HD13 ' A' ' 125' ' ' LEU . 0.5 OUTLIER -70.29 -42.95 71.38 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.519 1.137 . . . . 72.430000000000007 109.323 179.97 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 158' ' ' MET . . . . . 0.607 ' HE1' HG21 ' A' ' 161' ' ' VAL . 24.9 mmt -55.2 -20.71 11.32 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.55 1.156 . . . . 72.409999999999997 110.982 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -86.3 -30.78 22.0 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.623 1.202 . . . . 73.510000000000005 109.275 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.583 ' HB2' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -82.22 -17.48 45.93 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.518 1.136 . . . . 75.430000000000007 110.026 179.973 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 161' ' ' VAL . . . . . 0.607 HG21 ' HE1' ' A' ' 158' ' ' MET . 6.6 t -61.85 -30.6 48.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.48 1.113 . . . . 31.399999999999999 109.297 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 162' ' ' ASN . . . . . 0.482 ' O ' ' C ' ' A' ' 163' ' ' ARG . 15.5 t-20 -82.41 4.53 23.73 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.59 1.181 . . . . 75.120000000000005 109.263 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.482 ' C ' ' O ' ' A' ' 162' ' ' ASN . 0.0 OUTLIER 32.42 49.77 0.16 Allowed 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.498 1.124 . . . . 75.140000000000001 110.289 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -52.37 -173.74 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.508 1.13 . . . . 72.019999999999996 110.292 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -84.18 60.74 6.11 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.504 1.127 . . . . 72.140000000000001 109.528 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.49 ' HG3' ' CD1' ' A' ' 167' ' ' TYR . 0.1 OUTLIER -121.51 157.66 30.17 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.544 1.152 . . . . 74.310000000000002 109.28 179.976 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 167' ' ' TYR . . . . . 0.579 ' CE1' ' OG1' ' A' ' 225' ' ' THR . 52.1 p90 -54.65 -47.17 73.87 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.54 1.15 . . . . 74.329999999999998 110.999 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.565 ' N ' ' CD2' ' A' ' 167' ' ' TYR . 12.7 p30 -87.07 126.18 34.6 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.439 1.087 . . . . 71.420000000000002 109.279 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.416 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 3.1 t -121.86 176.91 5.51 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.494 1.121 . . . . 55.119999999999997 110.011 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.727 ' O ' HD12 ' A' ' 171' ' ' ILE . 3.2 t -134.16 117.26 24.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.464 1.103 . . . . 73.409999999999997 109.291 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.727 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.6 mp -128.13 97.45 29.04 Favored Pre-proline 0 C--N 1.325 -0.481 0 O-C-N 124.518 1.136 . . . . 74.510000000000005 109.252 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 172' ' ' PRO . . . . . 0.905 ' HG3' HD22 ' A' ' 189' ' ' LEU . 18.6 Cg_endo -74.95 107.1 2.4 Favored 'Trans proline' 0 C--N 1.359 1.126 0 O-C-N 124.51 1.795 . . . . 71.439999999999998 111.003 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 173' ' ' MET . . . . . 0.653 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.8 ttt -82.52 157.66 23.46 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.427 1.079 . . . . 72.049999999999997 110.982 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 174' ' ' ARG . . . . . 0.436 ' N ' ' HG2' ' A' ' 173' ' ' MET . 29.4 mmm-85 -108.98 113.67 59.08 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.498 1.124 . . . . 74.109999999999999 110.314 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 175' ' ' PRO . . . . . 0.448 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.3 Cg_endo -74.99 146.39 32.61 Favored 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.451 1.764 . . . . 55.219999999999999 111.013 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.572 HD13 ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -82.32 -40.77 20.97 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.534 1.146 . . . . 73.540000000000006 109.251 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -72.18 -28.63 63.34 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 124.535 1.147 . . . . 65.319999999999993 109.293 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 178' ' ' ASN . . . . . 0.612 ' OD1' HG23 ' A' ' 140' ' ' THR . 4.7 m-80 -110.77 99.2 41.06 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.53 1.144 . . . . 73.409999999999997 109.255 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 135.49 19.15 Favored 'Trans proline' 0 C--N 1.359 1.111 0 O-C-N 124.449 1.763 . . . . 43.399999999999999 111.019 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.604 HD12 ' OG1' ' A' ' 185' ' ' THR . 0.4 OUTLIER -141.2 96.99 7.0 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.463 1.102 . . . . 71.209999999999994 109.364 179.973 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.01 171.35 18.51 Favored 'Trans proline' 0 C--N 1.359 1.121 0 O-C-N 124.529 1.804 . . . . 62.399999999999999 110.978 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 182' ' ' ARG . . . . . 0.5 ' CG ' ' OE1' ' A' ' 190' ' ' GLN . 50.0 mtm-85 -62.74 -23.57 67.25 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.55 1.156 . . . . 74.099999999999994 110.305 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -72.02 -5.17 33.13 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.499 1.125 . . . . 60.509999999999998 110.279 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 184' ' ' ARG . . . . . 0.484 ' O ' HD11 ' A' ' 180' ' ' LEU . 15.6 mmt85 -128.94 4.95 5.38 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.478 1.111 . . . . 65.329999999999998 110.274 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 185' ' ' THR . . . . . 0.604 ' OG1' HD12 ' A' ' 180' ' ' LEU . 51.5 m -110.97 143.8 29.05 Favored Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.49 1.119 . . . . 74.0 110.36 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 186' ' ' PRO . . . . . 0.7 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -75.05 146.91 33.03 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.556 1.819 . . . . 72.439999999999998 111.018 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 187' ' ' PHE . . . . . 0.457 ' O ' HG23 ' A' ' 191' ' ' THR . 38.6 p90 -63.05 -11.49 19.79 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.447 1.092 . . . . 73.439999999999998 111.031 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -87.78 -54.03 4.46 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.51 1.131 . . . . 71.019999999999996 109.313 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.905 HD22 ' HG3' ' A' ' 172' ' ' PRO . 23.0 mt -73.31 -19.0 61.14 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.504 1.127 . . . . 64.030000000000001 109.311 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 190' ' ' GLN . . . . . 0.5 ' OE1' ' CG ' ' A' ' 182' ' ' ARG . 6.7 tt0 -84.84 -2.2 57.45 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.485 1.115 . . . . 64.109999999999999 110.297 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 191' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 187' ' ' PHE . 41.2 p -126.38 1.83 7.0 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.509 1.13 . . . . 53.340000000000003 110.399 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.497 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 12.9 mt -94.25 163.94 2.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.547 1.154 . . . . 74.239999999999995 109.309 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 193' ' ' ASN . . . . . 0.491 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 3.7 t-20 -78.07 57.53 1.81 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.52 1.138 . . . . 64.049999999999997 109.319 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 194' ' ' ALA . . . . . 0.857 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -61.11 177.16 0.36 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.485 1.116 . . . . 65.329999999999998 109.324 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 195' ' ' LEU . . . . . 0.935 HD23 HD12 ' A' ' 209' ' ' ILE . 0.2 OUTLIER -108.29 152.89 24.01 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.523 1.139 . . . . 64.519999999999996 109.26 -179.932 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 196' ' ' GLU . . . . . 0.55 ' H ' HD13 ' A' ' 195' ' ' LEU . 99.1 mt-10 -144.47 137.09 26.69 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.535 1.147 . . . . 53.210000000000001 110.341 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.475 ' HG3' ' CD1' ' A' ' 176' ' ' LEU . 0.8 OUTLIER -111.06 -12.0 14.23 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.431 1.082 . . . . 74.299999999999997 110.29 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 198' ' ' GLU . . . . . 0.457 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 1.4 pt-20 -95.22 13.24 26.14 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.482 1.114 . . . . 64.310000000000002 110.318 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 1.7 t -118.18 164.96 14.39 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.541 1.151 . . . . 73.25 110.005 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -78.59 -26.5 45.49 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.51 1.131 . . . . 74.120000000000005 110.298 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -87.08 13.08 60.42 Favored Glycine 0 CA--C 1.53 1.009 0 O-C-N 124.45 1.094 . . . . 74.310000000000002 111.026 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 202' ' ' PHE . . . . . 0.774 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.0 OUTLIER -52.61 -45.74 96.04 Favored Pre-proline 0 C--N 1.325 -0.458 0 O-C-N 124.423 0.72 . . . . 72.25 110.986 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 203' ' ' PRO . . . . . 0.592 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.2 Cg_endo -74.97 -34.8 3.58 Favored 'Trans proline' 0 C--N 1.359 1.116 0 O-C-N 124.562 1.822 . . . . 54.539999999999999 111.014 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -57.45 -56.0 27.47 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.448 1.092 . . . . 61.009999999999998 110.358 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -63.61 -36.65 84.51 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.467 1.104 . . . . 74.510000000000005 110.33 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 206' ' ' VAL . . . . . 0.939 HG11 ' CE2' ' A' ' 104' ' ' PHE . 37.7 t -63.86 -37.09 78.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 O-C-N 124.491 1.119 . . . . 74.400000000000006 109.329 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 207' ' ' GLU . . . . . 0.435 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 4.3 mt-10 -69.68 -49.49 53.01 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.545 1.153 . . . . 72.329999999999998 110.305 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 80.0 mtt-85 -67.21 -66.25 0.58 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.476 1.11 . . . . 70.239999999999995 110.271 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 209' ' ' ILE . . . . . 0.935 HD12 HD23 ' A' ' 195' ' ' LEU . 45.4 mt -43.46 -57.78 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.53 1.144 . . . . 70.109999999999999 109.309 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 210' ' ' PHE . . . . . 0.83 ' CD1' HG22 ' A' ' 209' ' ' ILE . 3.2 m-85 -102.53 69.45 1.1 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.54 1.15 . . . . 62.219999999999999 110.967 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 211' ' ' GLN . . . . . 0.468 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -110.83 143.26 41.69 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.457 1.098 . . . . 61.140000000000001 110.3 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.454 ' O ' ' N ' ' A' ' 215' ' ' TYR . 29.2 tt0 -50.09 -53.74 25.21 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.541 1.15 . . . . 71.219999999999999 110.246 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -48.56 -23.53 1.02 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.482 1.114 . . . . 71.439999999999998 109.983 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.468 HG23 ' HG2' ' A' ' 211' ' ' GLN . 20.4 t -95.14 -29.56 4.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 O-C-N 124.499 1.124 . . . . 71.019999999999996 109.26 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 215' ' ' TYR . . . . . 0.461 ' OH ' ' CD2' ' A' ' 78' ' ' PHE . 9.4 t80 -61.92 -19.01 62.25 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.476 1.11 . . . . 72.150000000000006 111.039 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 216' ' ' LYS . . . . . 0.42 ' N ' ' HD2' ' A' ' 216' ' ' LYS . 16.5 mmmt -76.13 -44.52 38.06 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.539 1.149 . . . . 75.120000000000005 109.245 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 217' ' ' THR . . . . . 0.871 HG22 HD11 ' A' ' 221' ' ' ILE . 74.7 m -59.63 -66.43 0.51 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.5 1.125 . . . . 44.009999999999998 110.445 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 218' ' ' GLN . . . . . 0.425 ' NE2' ' N ' ' A' ' 218' ' ' GLN . 0.0 OUTLIER -51.34 -28.31 12.01 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.486 1.117 . . . . 73.200000000000003 110.32 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 219' ' ' GLN . . . . . 0.426 ' NE2' ' HD2' ' A' ' 223' ' ' LYS . 33.3 tp60 -67.96 -55.57 12.25 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.54 1.15 . . . . 74.5 110.263 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.6 m -62.31 -36.4 82.05 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.534 1.146 . . . . 63.310000000000002 110.392 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 221' ' ' ILE . . . . . 0.871 HD11 HG22 ' A' ' 217' ' ' THR . 20.3 mt -66.87 -18.91 24.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.519 1.137 . . . . 74.230000000000004 109.302 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 222' ' ' TRP . . . . . 1.027 ' O ' HG22 ' A' ' 225' ' ' THR . 11.8 t90 -69.89 -64.68 0.84 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.517 1.135 . . . . 71.219999999999999 107.958 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 223' ' ' LYS . . . . . 0.492 ' CB ' ' HZ2' ' A' ' 223' ' ' LYS . 0.0 OUTLIER -54.14 -31.21 51.81 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.509 1.13 . . . . 73.209999999999994 109.247 -179.942 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.81 -42.64 70.01 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.498 1.124 . . . . 75.409999999999997 110.301 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 225' ' ' THR . . . . . 1.027 HG22 ' O ' ' A' ' 222' ' ' TRP . 5.4 t -57.3 -23.77 50.66 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.523 1.139 . . . . 65.420000000000002 110.405 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 16.8 mtm180 -77.62 -22.48 50.71 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.485 1.116 . . . . 72.510000000000005 110.342 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 227' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -85.12 -35.56 21.7 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.471 1.107 . . . . 74.310000000000002 109.294 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 228' ' ' MET . . . . . 0.436 ' CE ' ' HA ' ' A' ' 225' ' ' THR . 55.1 mtm -60.68 -45.2 95.08 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.51 1.131 . . . . 63.219999999999999 110.993 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 229' ' ' VAL . . . . . 0.462 HG23 ' N ' ' A' ' 230' ' ' GLN . 31.0 m -63.77 -49.4 82.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.529 1.143 . . . . 75.150000000000006 109.323 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 230' ' ' GLN . . . . . 0.462 ' N ' HG23 ' A' ' 229' ' ' VAL . 2.5 tp60 -71.39 -6.67 41.94 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.497 1.123 . . . . 73.530000000000001 110.3 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 17.9 ttt85 -90.98 -85.72 0.22 Allowed 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.558 1.161 . . . . 73.129999999999995 110.239 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 6.0 tm0? -138.98 39.12 2.14 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.597 1.186 . . . . 65.25 110.269 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -151.52 37.68 0.6 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.474 1.109 . . . . 73.409999999999997 111.012 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 5.8 mm -47.87 140.67 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.492 1.12 . . . . 71.129999999999995 109.358 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.481 0 O-C-N 124.559 1.162 . . . . 54.009999999999998 109.349 179.975 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.001 0 N-CA-C 110.988 -0.845 . . . . 61.0 110.988 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.9 141.86 27.47 Favored 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.494 1.787 . . . . 55.219999999999999 111.04 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.572 HD13 ' N ' ' A' ' 73' ' ' GLY . 0.7 OUTLIER -100.1 128.78 46.12 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.501 1.126 . . . . 74.25 109.327 179.918 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.572 ' N ' HD13 ' A' ' 72' ' ' LEU . . . 42.09 73.77 0.2 Allowed Glycine 0 CA--C 1.53 0.983 0 O-C-N 124.548 1.155 . . . . 74.439999999999998 111.02 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.7 p -123.34 131.63 53.72 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.485 0.756 . . . . 71.239999999999995 110.042 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.401 ' HG3' ' N ' ' A' ' 76' ' ' GLU . 50.1 tp10 -81.88 152.64 26.75 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.514 1.134 . . . . 72.239999999999995 110.313 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.476 ' OE2' ' CH2' ' A' ' 222' ' ' TRP . 0.1 OUTLIER -124.27 157.06 35.79 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.476 1.11 . . . . 74.25 110.296 -179.986 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.444 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 2.4 p -179.83 151.05 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.418 1.074 . . . . 61.340000000000003 109.295 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.553 ' CE2' ' HD3' ' A' ' 108' ' ' PRO . 48.2 p90 -96.22 40.33 1.13 Allowed 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.556 1.16 . . . . 74.010000000000005 111.003 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.475 HD11 HG22 ' A' ' 110' ' ' ILE . 3.0 tp -39.97 133.82 1.59 Allowed 'General case' 0 C--N 1.323 -0.553 0 O-C-N 124.52 1.138 . . . . 65.329999999999998 109.258 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.964 ' NZ ' HG23 ' A' ' 106' ' ' ILE . 9.2 mmmm -57.04 -66.35 0.47 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.483 1.114 . . . . 55.240000000000002 109.317 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.605 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 2.2 p90 -166.32 179.81 5.43 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.585 1.178 . . . . 72.129999999999995 111.001 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 1.047 HG11 ' HB1' ' A' ' 128' ' ' ALA . 0.8 OUTLIER -111.73 149.91 14.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.433 1.083 . . . . 71.420000000000002 109.318 179.999 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.892 ' CG2' ' HB1' ' A' ' 93' ' ' ALA . 4.9 mp -121.2 89.51 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.533 1.145 . . . . 72.420000000000002 109.252 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.893 HD21 ' CB ' ' A' ' 128' ' ' ALA . 6.2 mt -70.24 121.79 18.27 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.568 1.168 . . . . 71.409999999999997 109.35 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.823 ' CD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -144.14 174.64 10.7 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.541 1.151 . . . . 75.209999999999994 109.552 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.478 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -111.99 164.35 13.23 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.474 1.109 . . . . 70.150000000000006 109.279 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -63.04 -12.27 25.19 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.502 1.126 . . . . 73.519999999999996 110.244 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -82.33 -46.12 14.02 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.481 1.113 . . . . 64.439999999999998 109.273 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -120.71 44.33 2.52 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.452 1.095 . . . . 71.430000000000007 109.293 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.607 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -76.85 -25.66 53.41 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.457 1.098 . . . . 74.510000000000005 110.347 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -85.79 -21.75 28.01 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.453 1.096 . . . . 72.349999999999994 109.314 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -73.18 -45.67 55.11 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.56 1.163 . . . . 72.439999999999998 110.338 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.892 ' HB1' ' CG2' ' A' ' 83' ' ' ILE . . . -70.14 -31.43 68.93 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.464 1.103 . . . . 71.409999999999997 109.352 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.941 ' HB2' HD13 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -73.1 -52.82 12.84 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.51 1.131 . . . . 74.5 109.311 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.663 ' N ' HD13 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -43.23 -37.25 2.07 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.46 1.1 . . . . 73.209999999999994 110.328 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.805 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.3 t -73.42 -64.76 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.512 1.133 . . . . 64.439999999999998 109.315 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.486 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -40.6 -26.86 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.53 1.144 . . . . 64.430000000000007 110.319 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.454 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.2 OUTLIER -73.21 -60.18 2.36 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.521 1.138 . . . . 62.229999999999997 109.287 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.841 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -62.61 -22.11 66.16 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.504 1.127 . . . . 73.120000000000005 109.282 179.995 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.841 ' N ' HD23 ' A' ' 99' ' ' LEU . 28.5 mt -67.75 -43.23 80.35 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.415 1.072 . . . . 61.219999999999999 109.272 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -86.41 46.73 1.38 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.567 1.167 . . . . 64.409999999999997 110.272 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -166.68 -63.74 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.574 1.171 . . . . 61.240000000000002 109.247 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.551 ' OD1' ' CE2' ' A' ' 104' ' ' PHE . 22.4 t70 -46.55 -46.46 19.38 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.55 1.156 . . . . 63.310000000000002 109.297 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.911 ' CE1' HG11 ' A' ' 206' ' ' VAL . 0.4 OUTLIER -116.26 -31.87 5.5 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.514 1.134 . . . . 74.019999999999996 110.96 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.444 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 100.73 44.63 2.07 Favored Glycine 0 CA--C 1.531 1.049 0 O-C-N 124.519 1.137 . . . . 74.129999999999995 110.986 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.964 HG23 ' NZ ' ' A' ' 80' ' ' LYS . 6.1 mm -84.95 70.11 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.556 0.798 . . . . 73.510000000000005 109.308 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.541 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -120.92 155.48 57.52 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.468 1.105 . . . . 74.420000000000002 109.272 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.553 ' HD3' ' CE2' ' A' ' 78' ' ' PHE . 18.1 Cg_endo -74.97 160.76 96.07 Favored 'Cis proline' 0 C--N 1.36 1.176 0 C-N-CA 120.927 -2.53 . . . . 74.140000000000001 111.022 -0.052 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -136.56 137.11 8.81 Favored Glycine 0 CA--C 1.53 0.985 0 O-C-N 124.498 1.124 . . . . 65.409999999999997 111.028 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.544 HD11 ' O ' ' A' ' 114' ' ' GLU . 2.5 tt -148.2 152.09 12.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.529 0.782 . . . . 65.200000000000003 109.263 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.941 HD13 ' HB2' ' A' ' 94' ' ' LEU . 40.9 pt -101.22 167.33 2.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.426 1.079 . . . . 50.409999999999997 109.31 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.802 ' CD1' HD23 ' A' ' 84' ' ' LEU . 2.7 t80 -66.88 -19.24 65.7 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.481 1.113 . . . . 55.539999999999999 111.0 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -90.69 -6.64 54.23 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.552 1.157 . . . . 73.109999999999999 109.324 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.544 ' O ' HD11 ' A' ' 110' ' ' ILE . 12.2 mm-40 -110.64 -5.91 14.95 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.495 1.122 . . . . 72.299999999999997 110.3 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 10.8 ttm -61.4 110.94 3.54 Favored Pre-proline 0 C--N 1.325 -0.457 0 O-C-N 124.456 1.097 . . . . 74.430000000000007 110.958 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.95 70.52 5.23 Favored 'Trans proline' 0 C--N 1.359 1.128 0 O-C-N 124.497 1.788 . . . . 51.039999999999999 111.0 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 17.7 p-80 -79.82 -44.54 20.37 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.403 1.064 . . . . 75.329999999999998 109.546 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 109.42 -110.3 2.93 Favored Glycine 0 CA--C 1.531 1.033 0 O-C-N 124.424 1.078 . . . . 72.209999999999994 110.957 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -106.37 -9.72 16.63 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.496 0.762 . . . . 72.010000000000005 110.307 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -61.54 165.48 4.86 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.409 1.068 . . . . 55.350000000000001 110.283 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -84.46 126.18 33.04 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.544 1.153 . . . . 71.519999999999996 109.583 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.773 HD12 ' CE2' ' A' ' 112' ' ' PHE . 0.3 OUTLIER -79.79 -23.41 42.16 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.479 1.112 . . . . 71.230000000000004 109.262 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 21.1 mp0 -38.93 -33.75 0.13 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.455 1.097 . . . . 53.439999999999998 110.274 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 18.6 m-20 -56.31 98.16 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.551 1.157 . . . . 43.229999999999997 109.336 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.591 ' CD1' HD23 ' A' ' 157' ' ' LEU . 4.2 pp -83.55 -17.36 42.06 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.401 1.063 . . . . 73.340000000000003 109.303 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.44 ' O ' ' N ' ' A' ' 129' ' ' VAL . 11.9 p-10 -63.85 -42.34 97.61 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.494 1.121 . . . . 70.030000000000001 109.313 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -48.98 -32.92 9.98 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.509 1.131 . . . . 74.040000000000006 109.307 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 1.047 ' HB1' HG11 ' A' ' 82' ' ' VAL . . . -68.44 -36.2 78.7 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.522 1.138 . . . . 72.319999999999993 109.311 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.673 HG12 ' O ' ' A' ' 129' ' ' VAL . 53.9 t -89.12 14.2 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.478 1.111 . . . . 63.100000000000001 109.29 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -129.27 120.84 26.39 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.544 1.153 . . . . 71.150000000000006 109.265 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 88.2 -20.12 31.41 Favored Glycine 0 CA--C 1.53 0.973 0 O-C-N 124.506 1.129 . . . . 35.100000000000001 110.994 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 39.2 m -87.95 151.67 22.63 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.522 0.777 . . . . 62.43 110.027 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.785 ' HB3' ' O ' ' A' ' 80' ' ' LYS . . . -94.44 -9.69 34.76 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.454 1.096 . . . . 71.219999999999999 109.308 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.597 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 9.7 m-90 -161.91 173.7 14.14 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.524 1.14 . . . . 73.420000000000002 107.981 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.946 HG22 HG12 ' A' ' 82' ' ' VAL . 11.8 p -153.29 131.26 11.76 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 124.528 1.143 . . . . 61.409999999999997 110.436 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.763 ' C ' HD23 ' A' ' 137' ' ' LEU . 21.5 mm -93.21 134.62 30.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 124.552 1.158 . . . . 64.010000000000005 109.292 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.884 ' O ' HD22 ' A' ' 139' ' ' LEU . 5.2 mt -113.64 85.49 2.21 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.499 1.124 . . . . 72.040000000000006 109.263 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.777 HD22 ' HB2' ' A' ' 93' ' ' ALA . 1.8 tp -62.65 90.14 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.575 1.172 . . . . 64.310000000000002 109.33 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.884 HD22 ' O ' ' A' ' 137' ' ' LEU . 0.7 OUTLIER -70.44 116.69 11.06 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.541 1.15 . . . . 34.299999999999997 109.272 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.421 ' HB ' ' CB ' ' A' ' 143' ' ' PHE . 6.8 m -139.22 157.87 45.17 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.43 1.082 . . . . 60.100000000000001 110.352 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -50.24 -40.96 49.23 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.477 1.111 . . . . 62.200000000000003 110.271 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -89.27 -52.18 5.19 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.509 1.13 . . . . 73.150000000000006 109.337 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 1.007 ' CE1' HG21 ' A' ' 147' ' ' THR . 29.0 t80 -52.18 -20.16 2.42 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.483 1.114 . . . . 72.120000000000005 111.018 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.695 ' C ' HD13 ' A' ' 144' ' ' LEU . 1.9 tm? -72.14 -67.54 0.53 Allowed 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.518 1.136 . . . . 75.239999999999995 109.282 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.445 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 25.4 mmm180 -52.75 -23.1 6.11 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.59 1.181 . . . . 70.349999999999994 110.302 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -75.69 -73.11 0.28 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.521 1.138 . . . . 64.540000000000006 109.265 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' THR . . . . . 1.007 HG21 ' CE1' ' A' ' 143' ' ' PHE . 47.2 p -57.42 -56.18 25.24 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.428 1.08 . . . . 64.140000000000001 110.403 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.494 ' CH2' ' HB3' ' A' ' 186' ' ' PRO . 4.6 t-105 -43.9 -42.2 5.67 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.558 1.161 . . . . 73.409999999999997 108.01 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 149' ' ' CYS . . . . . 0.445 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 12.6 t -67.88 -45.4 74.58 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.486 1.116 . . . . 44.240000000000002 108.279 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 150' ' ' ASN . . . . . 0.454 ' N ' ' O ' ' A' ' 147' ' ' THR . 34.2 m-20 -52.23 -61.96 1.94 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.5 1.125 . . . . 70.430000000000007 109.309 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.869 ' CE1' HD12 ' A' ' 157' ' ' LEU . 9.8 m-30 -38.46 -45.88 1.09 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.437 1.086 . . . . 63.340000000000003 110.971 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -49.27 -48.84 45.66 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.544 1.153 . . . . 65.420000000000002 110.31 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -88.06 -11.72 46.34 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.538 1.148 . . . . 73.530000000000001 111.041 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.4 ' N ' ' O ' ' A' ' 150' ' ' ASN . 3.2 m-30 -116.67 77.36 1.1 Allowed 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.437 1.086 . . . . 74.439999999999998 110.995 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.1 t -61.82 -13.41 23.71 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.538 1.149 . . . . 64.329999999999998 110.448 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 13.1 m -71.53 -32.26 67.96 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.461 1.1 . . . . 74.340000000000003 110.017 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.869 HD12 ' CE1' ' A' ' 151' ' ' PHE . 0.4 OUTLIER -74.1 -47.21 37.86 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.566 1.166 . . . . 53.009999999999998 109.322 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 158' ' ' MET . . . . . 0.623 ' CE ' HG21 ' A' ' 161' ' ' VAL . 1.9 tpt -48.76 -23.01 0.91 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.485 1.115 . . . . 71.420000000000002 111.083 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -77.84 -42.79 32.41 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.528 1.143 . . . . 71.25 109.271 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.542 ' CB ' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -63.16 -22.79 67.1 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.484 1.115 . . . . 74.030000000000001 110.011 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 161' ' ' VAL . . . . . 0.623 HG21 ' CE ' ' A' ' 158' ' ' MET . 41.9 t -57.41 -17.87 7.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.489 1.118 . . . . 70.109999999999999 109.315 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -90.96 21.5 4.16 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.621 1.201 . . . . 73.430000000000007 109.288 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.483 ' CD ' ' O ' ' A' ' 170' ' ' VAL . 0.0 OUTLIER 46.6 37.12 4.16 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.5 1.125 . . . . 73.329999999999998 110.327 -179.94 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 164' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' A' ' 163' ' ' ARG . 21.9 mt-30 -38.3 131.31 1.19 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.483 1.114 . . . . 73.230000000000004 110.295 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 13.8 m-70 -90.1 57.4 3.76 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.518 1.136 . . . . 75.510000000000005 109.587 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.608 ' HA ' HG21 ' A' ' 221' ' ' ILE . 0.0 OUTLIER -118.25 89.7 3.18 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.534 1.146 . . . . 64.329999999999998 109.24 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 167' ' ' TYR . . . . . 0.603 ' CD1' ' O ' ' A' ' 166' ' ' LYS . 12.7 p90 36.61 32.98 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.571 1.17 . . . . 75.200000000000003 111.047 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.439 ' ND2' ' O ' ' A' ' 129' ' ' VAL . 27.0 p30 178.48 156.97 0.45 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.548 1.155 . . . . 75.019999999999996 109.277 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.576 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 0.4 OUTLIER -140.05 176.99 8.29 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.494 1.121 . . . . 42.030000000000001 109.969 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.902 ' O ' HD12 ' A' ' 171' ' ' ILE . 65.3 t -131.34 120.57 46.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.563 1.164 . . . . 71.439999999999998 109.272 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.902 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.3 mp -136.37 105.42 9.31 Favored Pre-proline 0 C--N 1.325 -0.468 0 O-C-N 124.497 1.123 . . . . 70.420000000000002 109.359 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 172' ' ' PRO . . . . . 0.674 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.5 Cg_endo -74.95 112.96 3.68 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.507 1.793 . . . . 44.439999999999998 111.041 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 173' ' ' MET . . . . . 0.805 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.7 ttt -89.16 160.67 16.87 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.576 1.173 . . . . 64.219999999999999 110.96 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 174' ' ' ARG . . . . . 0.423 ' N ' ' HG2' ' A' ' 173' ' ' MET . 0.0 OUTLIER -123.48 119.05 27.35 Favored Pre-proline 0 C--N 1.325 -0.48 0 O-C-N 124.531 1.144 . . . . 73.049999999999997 110.296 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 175' ' ' PRO . . . . . 0.636 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -75.05 155.05 42.68 Favored 'Trans proline' 0 C--N 1.36 1.142 0 O-C-N 124.5 1.79 . . . . 71.109999999999999 110.983 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 1.018 HD21 ' CG ' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -98.18 -36.87 9.91 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.584 1.177 . . . . 75.120000000000005 109.319 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -72.68 -23.02 60.83 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.504 1.127 . . . . 53.200000000000003 109.278 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -110.35 113.09 56.61 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.409 1.068 . . . . 71.099999999999994 109.292 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.05 115.02 4.16 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.536 1.808 . . . . 62.020000000000003 110.958 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.539 HD13 ' HB2' ' A' ' 184' ' ' ARG . 0.8 OUTLIER -132.86 96.62 17.88 Favored Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.537 1.148 . . . . 61.399999999999999 109.342 179.939 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 181' ' ' PRO . . . . . 0.424 ' HG2' ' CG ' ' A' ' 183' ' ' GLU . 18.3 Cg_endo -74.98 164.21 33.83 Favored 'Trans proline' 0 C--N 1.361 1.203 0 O-C-N 124.455 1.766 . . . . 52.219999999999999 111.025 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 182' ' ' ARG . . . . . 0.424 ' HG3' ' N ' ' A' ' 183' ' ' GLU . 0.7 OUTLIER -51.88 -35.16 44.16 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.446 1.091 . . . . 73.099999999999994 110.329 -179.985 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 183' ' ' GLU . . . . . 0.424 ' CG ' ' HG2' ' A' ' 181' ' ' PRO . 4.7 pt-20 -56.8 -32.01 65.25 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.54 1.15 . . . . 55.140000000000001 110.324 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 184' ' ' ARG . . . . . 0.539 ' HB2' HD13 ' A' ' 180' ' ' LEU . 5.7 mmp_? -87.96 -28.6 21.37 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.476 1.11 . . . . 75.519999999999996 110.236 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 185' ' ' THR . . . . . 0.494 HG22 ' HD2' ' A' ' 186' ' ' PRO . 21.2 m -77.27 144.03 70.3 Favored Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.477 1.111 . . . . 73.129999999999995 110.454 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 186' ' ' PRO . . . . . 0.701 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -74.93 152.33 41.0 Favored 'Trans proline' 0 C--N 1.36 1.167 0 O-C-N 124.508 1.793 . . . . 64.200000000000003 111.02 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 187' ' ' PHE . . . . . 0.483 ' O ' ' CG2' ' A' ' 191' ' ' THR . 13.2 p90 -68.22 -6.79 25.48 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.517 1.135 . . . . 72.409999999999997 111.0 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.75 -53.84 3.86 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.528 1.143 . . . . 63.420000000000002 109.267 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.701 HD12 ' CG ' ' A' ' 186' ' ' PRO . 49.3 mt -68.5 -42.21 78.91 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.455 1.097 . . . . 74.010000000000005 109.306 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 190' ' ' GLN . . . . . 0.402 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 6.4 pt20 -63.31 -11.5 22.52 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.5 1.125 . . . . 72.239999999999995 110.293 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 191' ' ' THR . . . . . 0.483 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 32.5 p -112.67 2.4 16.1 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.49 1.118 . . . . 74.120000000000005 110.353 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.49 ' CG2' ' N ' ' A' ' 193' ' ' ASN . 30.9 mt -105.31 163.36 4.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.461 1.101 . . . . 72.340000000000003 109.36 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 193' ' ' ASN . . . . . 0.49 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 22.7 p30 -66.8 74.78 0.11 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.507 1.129 . . . . 74.010000000000005 109.301 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 194' ' ' ALA . . . . . 0.674 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -70.04 156.36 39.27 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.557 1.16 . . . . 52.530000000000001 109.342 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 195' ' ' LEU . . . . . 0.725 HD23 ' CD1' ' A' ' 209' ' ' ILE . 0.3 OUTLIER -95.83 127.58 41.98 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.474 1.109 . . . . 72.310000000000002 109.256 -179.967 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 196' ' ' GLU . . . . . 0.402 ' HB3' ' CB ' ' A' ' 199' ' ' SER . 45.3 mt-10 -108.42 130.42 55.24 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.543 1.152 . . . . 73.019999999999996 110.292 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 1.018 ' CG ' HD21 ' A' ' 176' ' ' LEU . 25.2 tp10 -100.53 -23.14 14.77 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.509 1.131 . . . . 72.519999999999996 110.305 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 198' ' ' GLU . . . . . 0.508 ' HB3' HD12 ' A' ' 176' ' ' LEU . 0.4 OUTLIER -104.95 15.33 27.91 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.527 1.142 . . . . 64.239999999999995 110.292 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 199' ' ' SER . . . . . 0.402 ' CB ' ' HB3' ' A' ' 196' ' ' GLU . 40.2 t -104.54 139.78 38.94 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.437 1.086 . . . . 73.219999999999999 110.023 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 21.5 ttp180 -59.47 -15.34 16.86 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.538 1.149 . . . . 75.319999999999993 110.315 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -102.89 17.61 52.15 Favored Glycine 0 CA--C 1.531 1.047 0 O-C-N 124.543 1.152 . . . . 44.219999999999999 110.928 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 202' ' ' PHE . . . . . 0.8 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.1 OUTLIER -54.16 -44.49 98.58 Favored Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.535 0.785 . . . . 65.209999999999994 111.019 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 203' ' ' PRO . . . . . 0.601 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.2 Cg_endo -74.99 -34.98 3.42 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.542 1.811 . . . . 75.209999999999994 110.994 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.98 -51.03 70.86 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.538 1.149 . . . . 53.140000000000001 110.411 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 205' ' ' GLN . . . . . 0.401 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 6.2 mt-30 -69.53 -33.04 72.23 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.495 1.122 . . . . 71.510000000000005 110.3 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 206' ' ' VAL . . . . . 0.911 HG11 ' CE1' ' A' ' 104' ' ' PHE . 50.5 t -70.28 -29.68 40.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.564 1.165 . . . . 61.119999999999997 109.287 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 207' ' ' GLU . . . . . 0.504 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 3.9 mt-10 -77.92 -36.67 49.16 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.544 1.152 . . . . 74.109999999999999 110.335 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -78.79 -62.93 1.54 Allowed 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.459 1.099 . . . . 72.239999999999995 110.279 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 209' ' ' ILE . . . . . 0.825 HG22 ' CD1' ' A' ' 210' ' ' PHE . 81.3 mt -47.83 -61.13 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.443 1.09 . . . . 73.439999999999998 109.325 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 210' ' ' PHE . . . . . 0.825 ' CD1' HG22 ' A' ' 209' ' ' ILE . 3.9 m-85 -97.42 67.36 2.09 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.519 1.137 . . . . 75.340000000000003 111.012 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 211' ' ' GLN . . . . . 0.504 ' CB ' ' O ' ' A' ' 207' ' ' GLU . 0.0 OUTLIER -110.98 141.09 44.92 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.502 1.126 . . . . 71.129999999999995 110.372 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.454 ' O ' ' N ' ' A' ' 215' ' ' TYR . 25.6 tt0 -51.97 -51.52 56.63 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.528 1.142 . . . . 71.530000000000001 110.255 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.42 -23.16 0.85 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.443 1.09 . . . . 64.120000000000005 109.943 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.52 HG12 HE22 ' A' ' 218' ' ' GLN . 17.4 t -95.47 -30.19 4.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 O-C-N 124.603 1.189 . . . . 73.030000000000001 109.301 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 215' ' ' TYR . . . . . 0.454 ' N ' ' O ' ' A' ' 212' ' ' GLU . 13.7 t80 -64.64 -20.37 66.25 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.586 1.178 . . . . 74.319999999999993 111.025 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 4.8 mmpt? -69.37 -54.88 12.27 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.468 1.105 . . . . 72.299999999999997 109.305 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 217' ' ' THR . . . . . 0.796 HG22 HD11 ' A' ' 221' ' ' ILE . 2.2 m -49.13 -67.52 0.26 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.506 1.129 . . . . 74.239999999999995 110.409 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 218' ' ' GLN . . . . . 0.947 ' HA ' HD12 ' A' ' 221' ' ' ILE . 0.7 OUTLIER -50.32 -43.64 53.86 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.493 1.12 . . . . 75.340000000000003 110.252 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 219' ' ' GLN . . . . . 0.402 ' CB ' ' O ' ' A' ' 215' ' ' TYR . 5.7 tp-100 -52.3 -37.87 56.92 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.505 1.128 . . . . 73.409999999999997 110.284 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 22.7 m -79.6 -35.17 40.0 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.429 1.081 . . . . 73.040000000000006 110.381 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 221' ' ' ILE . . . . . 0.947 HD12 ' HA ' ' A' ' 218' ' ' GLN . 10.9 mt -66.03 -27.24 40.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 O-C-N 124.443 1.09 . . . . 71.209999999999994 109.32 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 222' ' ' TRP . . . . . 0.697 ' O ' HG22 ' A' ' 225' ' ' THR . 24.1 t90 -89.11 -49.18 6.9 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.498 1.124 . . . . 54.43 107.991 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 223' ' ' LYS . . . . . 0.462 ' CD ' ' C ' ' A' ' 223' ' ' LYS . 0.0 OUTLIER -60.47 -16.77 39.91 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.532 1.145 . . . . 73.0 109.283 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -93.13 -35.4 13.2 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.554 1.159 . . . . 61.130000000000003 110.309 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.697 HG22 ' O ' ' A' ' 222' ' ' TRP . 3.3 t -65.96 -16.09 63.58 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.483 1.114 . . . . 74.25 110.412 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 10.7 mtm180 -72.85 -14.72 61.56 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.503 1.127 . . . . 71.040000000000006 110.269 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 227' ' ' ASN . . . . . 0.44 ' O ' ' N ' ' A' ' 231' ' ' ARG . 3.4 m-20 -85.4 -64.41 1.16 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.498 1.124 . . . . 73.239999999999995 109.301 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 228' ' ' MET . . . . . 0.432 ' HG3' HG13 ' A' ' 229' ' ' VAL . 17.4 ptp -38.41 -42.79 0.76 Allowed 'General case' 0 C--N 1.323 -0.549 0 O-C-N 124.553 1.158 . . . . 53.439999999999998 110.988 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 229' ' ' VAL . . . . . 0.483 HG23 ' N ' ' A' ' 230' ' ' GLN . 19.6 m -67.15 -50.33 64.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.545 1.153 . . . . 55.130000000000003 109.296 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 230' ' ' GLN . . . . . 0.483 ' N ' HG23 ' A' ' 229' ' ' VAL . 2.2 tp-100 -70.32 -6.62 36.44 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.503 1.127 . . . . 75.310000000000002 110.272 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 231' ' ' ARG . . . . . 0.44 ' N ' ' O ' ' A' ' 227' ' ' ASN . 14.9 tpt180 -95.9 -79.82 0.43 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.528 1.143 . . . . 65.019999999999996 110.254 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -146.25 53.37 1.13 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.501 1.126 . . . . 74.340000000000003 110.268 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 233' ' ' PHE . . . . . 0.597 ' O ' HD13 ' A' ' 234' ' ' ILE . 0.4 OUTLIER -165.73 -173.12 2.6 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.503 1.127 . . . . 72.099999999999994 111.064 179.941 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.597 HD13 ' O ' ' A' ' 233' ' ' PHE . 7.5 mm -138.55 161.18 30.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.469 1.106 . . . . 71.219999999999999 109.308 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.47 0 O-C-N 124.542 1.151 . . . . 75.310000000000002 109.288 179.99 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.006 0 N-CA-C 111.018 -0.833 . . . . 61.530000000000001 111.018 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.97 145.04 31.07 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.536 1.809 . . . . 72.230000000000004 111.039 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.541 HD13 ' N ' ' A' ' 73' ' ' GLY . 0.4 OUTLIER -110.5 121.58 45.65 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.393 1.058 . . . . 65.129999999999995 109.278 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.541 ' N ' HD13 ' A' ' 72' ' ' LEU . . . 71.21 59.15 5.15 Favored Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.501 1.126 . . . . 53.310000000000002 110.975 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.424 ' OG ' ' N ' ' A' ' 75' ' ' GLU . 0.8 OUTLIER -119.53 175.16 5.98 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.455 0.738 . . . . 61.310000000000002 110.027 179.976 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.424 ' N ' ' OG ' ' A' ' 74' ' ' SER . 10.2 tt0 -39.07 149.42 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.535 1.147 . . . . 73.439999999999998 110.3 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -140.54 127.85 21.15 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.468 1.105 . . . . 74.010000000000005 110.325 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.427 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 5.3 p -140.37 160.03 25.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 O-C-N 124.452 1.095 . . . . 74.420000000000002 109.303 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.49 ' CE2' ' OH ' ' A' ' 215' ' ' TYR . 5.6 t80 -88.68 24.82 1.89 Allowed 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.481 1.113 . . . . 74.299999999999997 111.004 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.407 ' C ' ' O ' ' A' ' 78' ' ' PHE . 3.2 tp -39.5 143.14 0.23 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.486 1.116 . . . . 74.409999999999997 109.269 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.6 ' O ' ' HB3' ' A' ' 133' ' ' ALA . 8.2 ttmt -79.03 -62.3 1.74 Allowed 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.522 1.139 . . . . 62.43 109.249 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.944 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.3 OUTLIER -165.47 140.09 4.87 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.563 1.164 . . . . 75.140000000000001 110.979 179.97 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.94 ' CG1' HG22 ' A' ' 135' ' ' THR . 7.5 p -90.69 167.49 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 O-C-N 124.428 1.08 . . . . 65.219999999999999 109.313 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.944 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 3.8 mp -132.64 92.0 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.47 1.106 . . . . 72.030000000000001 109.33 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.735 HD21 ' HB3' ' A' ' 128' ' ' ALA . 5.9 mp -70.16 113.22 7.13 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.454 1.096 . . . . 71.409999999999997 109.304 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.619 ' CB ' HD22 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -128.44 174.39 9.39 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.465 1.103 . . . . 73.219999999999999 109.661 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -113.24 162.47 15.98 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.538 1.149 . . . . 55.25 109.309 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -64.31 -11.33 31.02 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.541 1.151 . . . . 61.009999999999998 110.374 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -81.68 -45.95 15.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.482 1.114 . . . . 74.439999999999998 109.284 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.416 ' CG ' HD23 ' A' ' 138' ' ' LEU . 0.8 OUTLIER -124.58 44.21 2.82 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.441 1.088 . . . . 64.019999999999996 109.265 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.607 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -75.54 -33.89 60.71 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.456 1.098 . . . . 72.340000000000003 110.383 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -79.01 -17.21 55.75 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.537 1.148 . . . . 73.099999999999994 109.354 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -79.39 -54.04 6.32 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.548 1.155 . . . . 72.400000000000006 110.302 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.872 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -65.16 -19.75 66.12 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.473 1.108 . . . . 73.409999999999997 109.251 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.936 ' HB2' HD13 ' A' ' 111' ' ' ILE . 0.1 OUTLIER -87.96 -51.89 5.57 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.573 1.17 . . . . 64.409999999999997 109.264 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.568 ' N ' HD13 ' A' ' 94' ' ' LEU . 10.7 tpt180 -45.27 -33.32 2.33 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.514 1.133 . . . . 72.519999999999996 110.334 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.582 HG13 ' N ' ' A' ' 97' ' ' GLN . 10.7 p -82.77 -55.89 6.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.516 1.135 . . . . 72.219999999999999 109.295 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.582 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -48.24 -22.12 0.61 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.466 1.104 . . . . 73.230000000000004 110.339 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -77.21 -38.61 51.03 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.466 1.104 . . . . 73.5 109.334 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.783 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -83.08 -21.99 33.57 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.473 1.108 . . . . 72.519999999999996 109.263 -179.98 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.783 ' N ' HD23 ' A' ' 99' ' ' LEU . 71.9 mt -63.44 -51.51 65.37 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.529 1.143 . . . . 55.450000000000003 109.276 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -77.5 54.79 1.21 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.487 1.117 . . . . 64.129999999999995 110.306 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -176.3 -67.05 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.482 1.114 . . . . 70.040000000000006 109.321 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -43.57 -54.09 5.17 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.462 1.101 . . . . 51.310000000000002 109.276 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.418 ' CZ ' ' HB3' ' A' ' 203' ' ' PRO . 6.4 m-85 -107.96 -31.2 8.08 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.507 1.13 . . . . 71.430000000000007 110.992 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 104.78 41.98 1.9 Allowed Glycine 0 CA--C 1.531 1.048 0 O-C-N 124.482 1.114 . . . . 71.239999999999995 110.996 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.1 mm -82.97 79.69 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.555 0.797 . . . . 74.040000000000006 109.295 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.538 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -131.76 156.39 80.18 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.522 1.139 . . . . 73.310000000000002 109.321 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.538 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.0 160.1 97.05 Favored 'Cis proline' 0 C--N 1.36 1.168 0 C-N-CA 120.981 -2.508 . . . . 71.209999999999994 110.994 -0.029 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -122.7 141.48 14.03 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.466 1.104 . . . . 60.229999999999997 111.046 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -158.72 130.16 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.5 0.765 . . . . 53.340000000000003 109.275 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.936 HD13 ' HB2' ' A' ' 94' ' ' LEU . 1.9 pt -96.67 156.88 3.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.571 1.169 . . . . 73.450000000000003 109.291 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.685 ' HE1' ' HB2' ' A' ' 128' ' ' ALA . 1.5 t80 -54.65 -19.17 5.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.491 1.12 . . . . 43.43 110.998 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.856 ' HB3' HD12 ' A' ' 111' ' ' ILE . . . -76.26 -51.58 11.74 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.541 1.15 . . . . 52.420000000000002 109.356 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -71.02 -25.93 62.89 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.425 1.078 . . . . 73.140000000000001 110.319 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.43 ' HE1' ' CG2' ' A' ' 82' ' ' VAL . 34.8 tpp -38.12 111.03 0.57 Allowed Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.508 1.13 . . . . 73.140000000000001 110.974 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.96 140.21 25.31 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.483 1.781 . . . . 64.519999999999996 111.048 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.564 ' CE1' HD12 ' A' ' 122' ' ' LEU . 10.2 p80 -166.01 109.47 0.79 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.543 1.152 . . . . 51.020000000000003 109.605 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -68.64 -27.77 73.6 Favored Glycine 0 CA--C 1.531 1.041 0 O-C-N 124.547 1.154 . . . . 74.349999999999994 111.079 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 22.0 ttm-85 -63.0 151.04 40.86 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.588 0.817 . . . . 64.120000000000005 110.307 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -54.66 -176.65 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.535 1.147 . . . . 74.530000000000001 110.274 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -47.68 136.0 10.97 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.48 1.113 . . . . 74.140000000000001 109.658 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.84 ' O ' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -137.49 127.12 25.23 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.498 1.123 . . . . 62.420000000000002 109.337 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -101.83 5.61 41.17 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.477 1.111 . . . . 51.409999999999997 110.315 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 73.7 m-80 -73.53 99.36 3.01 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.555 1.159 . . . . 74.299999999999997 109.342 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.643 HD11 ' HE1' ' A' ' 151' ' ' PHE . 1.1 pt? -75.01 -17.27 60.55 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.532 1.145 . . . . 63.240000000000002 109.242 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.9 -40.06 72.49 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.55 1.157 . . . . 73.209999999999994 109.265 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -43.9 -54.53 5.24 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.548 1.155 . . . . 75.400000000000006 109.302 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.735 ' HB3' HD21 ' A' ' 84' ' ' LEU . . . -60.5 -36.03 77.37 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.53 1.144 . . . . 63.219999999999999 109.293 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.822 HG21 HD21 ' A' ' 157' ' ' LEU . 3.4 t -73.31 -5.5 6.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.526 1.141 . . . . 73.310000000000002 109.276 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -109.59 119.81 40.55 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.473 1.108 . . . . 72.420000000000002 109.268 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 78.77 63.49 2.09 Favored Glycine 0 CA--C 1.529 0.951 0 O-C-N 124.436 1.085 . . . . 63.25 111.033 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 50.9 p -163.52 155.94 17.94 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.45 0.735 . . . . 42.229999999999997 110.073 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.6 ' HB3' ' O ' ' A' ' 80' ' ' LYS . . . -94.92 -22.31 18.07 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.497 1.123 . . . . 73.150000000000006 109.336 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.583 ' CZ2' ' HA ' ' A' ' 210' ' ' PHE . 16.1 m-90 -161.07 154.87 22.27 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.492 1.12 . . . . 71.530000000000001 108.041 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.94 HG22 ' CG1' ' A' ' 82' ' ' VAL . 1.8 p -140.55 122.3 15.36 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.551 1.157 . . . . 72.219999999999999 110.391 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.754 ' O ' HD23 ' A' ' 137' ' ' LEU . 0.9 OUTLIER -84.08 142.09 13.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.542 1.151 . . . . 74.239999999999995 109.23 -179.936 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.754 HD23 ' O ' ' A' ' 136' ' ' ILE . 47.7 mt -130.06 98.88 4.88 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.535 1.147 . . . . 72.129999999999995 109.378 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.872 HD21 ' HB2' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.46 102.23 0.3 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.571 1.169 . . . . 50.329999999999998 109.307 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.955 HD11 HD13 ' A' ' 189' ' ' LEU . 0.2 OUTLIER -68.56 99.13 0.94 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.474 1.109 . . . . 75.510000000000005 109.269 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.447 ' O ' ' N ' ' A' ' 144' ' ' LEU . 2.4 m -125.34 141.55 52.01 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.582 1.176 . . . . 74.140000000000001 110.394 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.441 ' HB3' ' CD2' ' A' ' 180' ' ' LEU . 0.1 OUTLIER -47.41 -46.18 26.11 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.512 1.132 . . . . 73.329999999999998 110.307 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ASN . . . . . 0.453 ' OD1' ' N ' ' A' ' 143' ' ' PHE . 11.2 p30 -73.04 -47.57 43.6 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.562 1.164 . . . . 71.430000000000007 109.331 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.976 ' CE2' HG21 ' A' ' 147' ' ' THR . 76.9 t80 -60.24 -19.37 54.26 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.44 1.087 . . . . 72.109999999999999 110.997 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.723 HD13 ' C ' ' A' ' 144' ' ' LEU . 2.0 tm? -66.83 -67.54 0.44 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.515 1.134 . . . . 73.349999999999994 109.319 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.447 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 30.3 mmt180 -50.95 -21.51 1.78 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.534 1.146 . . . . 75.420000000000002 110.276 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 92.7 m-20 -78.36 -72.33 0.38 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.442 1.089 . . . . 71.400000000000006 109.283 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.976 HG21 ' CE2' ' A' ' 143' ' ' PHE . 20.6 p -58.64 -56.0 27.76 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.489 1.118 . . . . 72.420000000000002 110.394 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.407 ' CE3' ' HA ' ' A' ' 148' ' ' TRP . 2.1 t-105 -43.48 -56.65 3.51 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.98 -1.119 . . . . 75.010000000000005 107.98 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 149' ' ' CYS . . . . . 0.447 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 42.6 t -58.86 -37.88 77.51 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.446 1.091 . . . . 74.129999999999995 108.261 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 150' ' ' ASN . . . . . 0.457 ' HA ' ' CE2' ' A' ' 153' ' ' PHE . 14.5 t-20 -63.5 -27.6 69.38 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.47 1.106 . . . . 72.450000000000003 109.3 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.853 ' CZ ' HD12 ' A' ' 157' ' ' LEU . 10.1 m-30 -87.15 -13.3 44.46 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.452 1.095 . . . . 72.409999999999997 110.978 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -75.46 -35.76 60.83 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.541 1.151 . . . . 61.200000000000003 110.293 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.594 ' C ' ' CD1' ' A' ' 153' ' ' PHE . 0.8 OUTLIER -94.08 -21.4 19.15 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.489 1.118 . . . . 74.099999999999994 111.017 -179.989 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.557 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 1.0 OUTLIER -115.24 109.74 18.41 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.519 1.137 . . . . 63.229999999999997 111.043 -179.974 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.2 t -85.81 -5.98 59.17 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.573 1.17 . . . . 72.450000000000003 110.369 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 1.6 t -72.52 -31.89 65.69 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.543 1.152 . . . . 45.130000000000003 110.051 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.853 HD12 ' CZ ' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -85.46 -25.87 26.65 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.471 1.107 . . . . 72.239999999999995 109.291 179.984 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 158' ' ' MET . . . . . 0.701 ' HA ' ' HE2' ' A' ' 158' ' ' MET . 7.0 mmt -67.64 -25.61 65.82 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.445 1.091 . . . . 74.450000000000003 110.978 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -78.08 -15.81 58.57 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.475 1.11 . . . . 73.430000000000007 109.354 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.94 ' OG ' HG21 ' A' ' 170' ' ' VAL . 0.5 OUTLIER -80.0 -43.08 22.61 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.521 1.138 . . . . 65.319999999999993 109.976 179.978 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 161' ' ' VAL . . . . . 0.686 HG22 ' O ' ' A' ' 158' ' ' MET . 35.5 m -61.02 -17.02 15.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 O-C-N 124.447 1.092 . . . . 75.549999999999997 109.258 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -76.04 -0.8 23.04 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.509 1.13 . . . . 64.519999999999996 109.323 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.488 ' NH2' ' H ' ' A' ' 170' ' ' VAL . 2.6 mmp_? 51.35 58.64 5.3 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.472 1.108 . . . . 71.230000000000004 110.32 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -78.62 -163.54 0.47 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.51 1.131 . . . . 73.299999999999997 110.353 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -112.17 54.48 0.7 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.476 1.11 . . . . 73.430000000000007 109.552 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.572 ' HG3' ' CD2' ' A' ' 167' ' ' TYR . 3.5 tptt -97.72 164.46 12.39 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.476 1.11 . . . . 63.539999999999999 109.309 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 167' ' ' TYR . . . . . 0.581 ' CD1' ' N ' ' A' ' 168' ' ' ASN . 40.0 p90 -58.09 -48.22 80.83 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.46 1.1 . . . . 74.200000000000003 110.983 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.581 ' N ' ' CD1' ' A' ' 167' ' ' TYR . 7.8 p30 -79.86 134.88 36.34 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.519 1.137 . . . . 62.310000000000002 109.264 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.574 ' HB3' ' CD1' ' A' ' 134' ' ' TRP . 47.0 t -113.06 132.3 55.47 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.463 1.102 . . . . 73.530000000000001 109.992 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 1.015 ' O ' HD12 ' A' ' 171' ' ' ILE . 9.6 t -99.48 133.98 40.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.494 1.121 . . . . 63.439999999999998 109.272 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 1.015 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.2 mp -140.52 108.05 6.61 Favored Pre-proline 0 C--N 1.326 -0.44 0 O-C-N 124.389 1.056 . . . . 72.340000000000003 109.361 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 172' ' ' PRO . . . . . 0.715 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -74.99 106.57 2.3 Favored 'Trans proline' 0 C--N 1.359 1.097 0 O-C-N 124.537 1.809 . . . . 74.209999999999994 111.012 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 173' ' ' MET . . . . . 0.43 ' HG2' ' N ' ' A' ' 174' ' ' ARG . 6.7 ttt -89.21 156.41 18.79 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.579 1.175 . . . . 60.109999999999999 110.983 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 174' ' ' ARG . . . . . 0.43 ' N ' ' HG2' ' A' ' 173' ' ' MET . 8.7 mmm-85 -114.94 121.62 35.02 Favored Pre-proline 0 C--N 1.324 -0.506 0 O-C-N 124.47 1.106 . . . . 73.239999999999995 110.284 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 175' ' ' PRO . . . . . 0.746 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -75.01 159.94 40.71 Favored 'Trans proline' 0 C--N 1.359 1.114 0 O-C-N 124.516 1.798 . . . . 61.439999999999998 110.975 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.958 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -104.21 -40.17 6.24 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.523 1.139 . . . . 73.120000000000005 109.278 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -72.89 -23.76 60.76 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.543 1.152 . . . . 75.099999999999994 109.311 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -110.19 105.91 57.59 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.503 1.127 . . . . 75.109999999999999 109.34 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.92 115.67 4.36 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.466 1.772 . . . . 74.019999999999996 111.049 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.639 HD21 ' CB ' ' A' ' 184' ' ' ARG . 2.1 tm? -139.12 101.67 7.61 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.432 1.083 . . . . 72.209999999999994 109.342 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.99 171.79 17.64 Favored 'Trans proline' 0 C--N 1.362 1.245 0 O-C-N 124.441 1.759 . . . . 73.230000000000004 110.993 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 3.5 ptp85 -59.53 -32.17 70.08 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.505 1.128 . . . . 64.219999999999999 110.299 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -48.47 -31.82 6.92 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.523 1.14 . . . . 51.549999999999997 110.279 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 184' ' ' ARG . . . . . 0.639 ' CB ' HD21 ' A' ' 180' ' ' LEU . 39.6 mmt180 -96.11 -22.38 17.36 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.507 1.129 . . . . 61.229999999999997 110.292 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 185' ' ' THR . . . . . 0.578 HG23 HD23 ' A' ' 139' ' ' LEU . 12.1 m -77.44 144.35 70.09 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.492 1.12 . . . . 51.219999999999999 110.424 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 186' ' ' PRO . . . . . 0.796 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.2 Cg_endo -74.97 164.6 33.07 Favored 'Trans proline' 0 C--N 1.36 1.155 0 O-C-N 124.404 1.739 . . . . 60.240000000000002 110.989 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 187' ' ' PHE . . . . . 0.466 ' O ' ' CG2' ' A' ' 191' ' ' THR . 32.2 p90 -77.35 -6.92 55.07 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.596 1.185 . . . . 75.329999999999998 111.028 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 188' ' ' ALA . . . . . 0.566 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -95.33 -51.29 4.65 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.434 1.084 . . . . 71.400000000000006 109.279 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.955 HD13 HD11 ' A' ' 139' ' ' LEU . 49.4 mt -68.39 -42.66 78.77 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.502 1.126 . . . . 63.329999999999998 109.257 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 190' ' ' GLN . . . . . 0.439 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 2.0 pt20 -65.2 -9.68 25.4 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.505 1.128 . . . . 74.129999999999995 110.262 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 191' ' ' THR . . . . . 0.466 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 80.8 p -120.84 24.55 10.17 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.491 1.119 . . . . 73.319999999999993 110.403 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.566 HD12 ' O ' ' A' ' 188' ' ' ALA . 7.8 mt -123.41 163.32 22.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.499 1.125 . . . . 73.329999999999998 109.315 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 193' ' ' ASN . . . . . 0.496 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 2.4 m-20 -66.71 74.22 0.1 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.558 1.161 . . . . 70.439999999999998 109.284 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 194' ' ' ALA . . . . . 0.715 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -71.04 162.3 29.66 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.452 1.095 . . . . 73.549999999999997 109.3 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 195' ' ' LEU . . . . . 0.754 HD23 HD12 ' A' ' 209' ' ' ILE . 0.3 OUTLIER -106.72 149.32 27.41 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.478 1.111 . . . . 72.450000000000003 109.288 -179.967 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 196' ' ' GLU . . . . . 0.415 ' N ' HD13 ' A' ' 195' ' ' LEU . 6.8 mm-40 -142.94 142.07 31.59 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.477 1.111 . . . . 53.43 110.335 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.958 ' HG3' HD21 ' A' ' 176' ' ' LEU . 3.4 pm0 -113.62 -28.67 7.4 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.464 1.103 . . . . 72.230000000000004 110.233 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 198' ' ' GLU . . . . . 0.493 ' HG2' HD12 ' A' ' 176' ' ' LEU . 1.5 pp20? -77.39 0.7 21.47 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.488 1.118 . . . . 60.340000000000003 110.334 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 6.9 t -104.28 161.33 14.14 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.49 1.119 . . . . 71.219999999999999 110.042 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 22.0 ttt-85 -77.55 -26.14 50.7 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.458 1.099 . . . . 72.0 110.274 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -88.73 21.99 23.67 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.554 1.159 . . . . 42.030000000000001 110.98 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 202' ' ' PHE . . . . . 0.848 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.3 OUTLIER -61.18 -41.96 83.35 Favored Pre-proline 0 C--N 1.326 -0.438 0 O-C-N 124.458 0.74 . . . . 73.340000000000003 110.981 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 203' ' ' PRO . . . . . 0.646 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.6 Cg_endo -74.94 -37.43 2.08 Favored 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.494 1.786 . . . . 44.340000000000003 111.049 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.36 -50.98 61.3 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.558 1.161 . . . . 71.329999999999998 110.406 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 205' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 3.0 mt-30 -71.05 -40.15 71.83 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.559 1.162 . . . . 74.549999999999997 110.326 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 206' ' ' VAL . . . . . 0.848 HG23 ' O ' ' A' ' 202' ' ' PHE . 57.1 t -62.82 -26.64 41.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 O-C-N 124.586 1.179 . . . . 75.150000000000006 109.261 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -81.01 -49.93 10.32 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.482 1.114 . . . . 64.319999999999993 110.345 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 83.7 mtt-85 -67.46 -62.75 1.27 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.57 1.169 . . . . 71.530000000000001 110.293 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 209' ' ' ILE . . . . . 0.754 HD12 HD23 ' A' ' 195' ' ' LEU . 96.5 mt -45.61 -50.0 3.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.554 1.159 . . . . 71.140000000000001 109.325 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 210' ' ' PHE . . . . . 0.751 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.5 m-85 -105.83 67.39 0.75 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.524 1.14 . . . . 64.310000000000002 111.01 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 211' ' ' GLN . . . . . 0.548 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.3 OUTLIER -111.04 142.95 42.51 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.485 1.116 . . . . 72.230000000000004 110.324 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.449 ' CG ' ' HE3' ' A' ' 216' ' ' LYS . 7.1 tt0 -49.06 -54.42 16.01 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.498 1.124 . . . . 65.120000000000005 110.324 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.01 -25.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.499 1.125 . . . . 51.299999999999997 109.993 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.548 HG23 ' HG2' ' A' ' 211' ' ' GLN . 42.5 t -96.1 -28.45 3.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.487 1.117 . . . . 72.299999999999997 109.279 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 215' ' ' TYR . . . . . 0.49 ' OH ' ' CE2' ' A' ' 78' ' ' PHE . 32.0 t80 -64.69 -30.77 71.79 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.522 1.139 . . . . 74.120000000000005 111.051 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 216' ' ' LYS . . . . . 0.449 ' HE3' ' CG ' ' A' ' 212' ' ' GLU . 12.7 mttp -63.11 -66.32 0.56 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.565 1.166 . . . . 73.420000000000002 109.323 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 217' ' ' THR . . . . . 0.713 HG22 HD11 ' A' ' 221' ' ' ILE . 86.9 m -41.01 -55.26 2.59 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.502 1.126 . . . . 74.450000000000003 110.362 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 218' ' ' GLN . . . . . 0.453 ' O ' ' N ' ' A' ' 221' ' ' ILE . 12.6 mm100 -57.15 -67.2 0.34 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.496 1.122 . . . . 75.319999999999993 110.321 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -44.05 -27.36 0.37 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.539 1.15 . . . . 73.219999999999999 110.385 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 4.4 m -81.2 -41.01 22.96 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.503 1.127 . . . . 74.120000000000005 110.392 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 221' ' ' ILE . . . . . 0.713 HD11 HG22 ' A' ' 217' ' ' THR . 14.5 mt -66.56 -31.26 52.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.439 1.087 . . . . 75.420000000000002 109.215 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 222' ' ' TRP . . . . . 0.965 ' O ' HG22 ' A' ' 225' ' ' THR . 28.9 t90 -69.57 -61.46 1.78 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.549 1.156 . . . . 74.5 107.968 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 223' ' ' LYS . . . . . 0.516 ' HA ' ' CD ' ' A' ' 226' ' ' ARG . 0.0 OUTLIER -54.05 -20.48 6.51 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.564 1.165 . . . . 70.120000000000005 109.275 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -93.23 -23.13 18.64 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.518 1.136 . . . . 73.510000000000005 110.344 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.965 HG22 ' O ' ' A' ' 222' ' ' TRP . 5.8 t -64.02 -15.05 58.52 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.554 1.159 . . . . 74.230000000000004 110.353 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 226' ' ' ARG . . . . . 0.516 ' CD ' ' HA ' ' A' ' 223' ' ' LYS . 0.8 OUTLIER -76.69 -30.39 56.69 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.503 1.127 . . . . 73.239999999999995 110.279 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 227' ' ' ASN . . . . . 0.448 ' O ' ' N ' ' A' ' 230' ' ' GLN . 3.8 m-20 -79.7 -59.72 2.63 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.467 1.105 . . . . 62.130000000000003 109.243 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 228' ' ' MET . . . . . 0.415 ' HG3' ' N ' ' A' ' 229' ' ' VAL . 10.1 ptp -41.82 -36.64 1.08 Allowed 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.577 1.173 . . . . 51.200000000000003 111.041 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 229' ' ' VAL . . . . . 0.481 HG13 ' HA ' ' A' ' 234' ' ' ILE . 5.7 t -76.76 -41.84 33.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.411 1.07 . . . . 54.119999999999997 109.297 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 230' ' ' GLN . . . . . 0.448 ' N ' ' O ' ' A' ' 227' ' ' ASN . 0.0 OUTLIER -68.29 -12.84 61.69 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.452 1.095 . . . . 73.430000000000007 110.322 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 38.2 mmm-85 -91.55 -80.34 0.35 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.501 1.126 . . . . 72.340000000000003 110.315 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -147.79 54.22 1.05 Allowed 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.547 1.154 . . . . 73.450000000000003 110.319 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 233' ' ' PHE . . . . . 0.724 ' O ' HD13 ' A' ' 234' ' ' ILE . 0.1 OUTLIER -161.53 173.27 15.05 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.6 1.187 . . . . 73.120000000000005 110.944 179.958 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.724 HD13 ' O ' ' A' ' 233' ' ' PHE . 13.4 mm -136.47 159.56 37.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.494 1.121 . . . . 72.439999999999998 109.367 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.468 0 O-C-N 124.492 1.12 . . . . 74.230000000000004 109.316 179.964 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.997 0 N-CA-C 111.002 -0.839 . . . . 52.020000000000003 111.002 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 169.2 23.14 Favored 'Trans proline' 0 C--N 1.359 1.103 0 O-C-N 124.465 1.771 . . . . 70.420000000000002 111.009 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.496 HD13 ' O ' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -109.4 -43.78 4.04 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.572 1.17 . . . . 64.030000000000001 109.275 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -76.67 -63.89 2.25 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.53 1.144 . . . . 73.120000000000005 110.985 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.33 166.26 0.89 Allowed 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.51 0.771 . . . . 73.540000000000006 110.026 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.3 tp10 -59.83 144.28 49.0 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.415 1.072 . . . . 53.409999999999997 110.32 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.404 ' OE1' ' NH1' ' A' ' 226' ' ' ARG . 2.5 tt0 -129.18 127.79 42.06 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.555 1.159 . . . . 55.539999999999999 110.265 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.54 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.7 p -124.72 162.71 26.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 124.454 1.096 . . . . 73.510000000000005 109.288 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.451 ' N ' HG22 ' A' ' 77' ' ' VAL . 8.3 m-85 -88.84 25.21 1.83 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.494 1.121 . . . . 61.520000000000003 111.007 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.677 HD11 HG22 ' A' ' 110' ' ' ILE . 6.1 tp -40.07 158.51 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.553 1.158 . . . . 62.140000000000001 109.317 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.903 ' HZ3' ' HA ' ' A' ' 106' ' ' ILE . 11.4 ptmt -111.76 -47.68 3.13 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.458 1.099 . . . . 71.209999999999994 109.338 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 1.127 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.1 OUTLIER -166.48 151.3 7.84 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.567 1.167 . . . . 75.430000000000007 110.936 -179.972 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.535 HG22 ' N ' ' A' ' 83' ' ' ILE . 3.9 p -104.86 167.78 2.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.451 1.095 . . . . 45.549999999999997 109.347 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 1.127 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 2.3 mp -126.49 105.03 13.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 O-C-N 124.525 1.14 . . . . 63.310000000000002 109.412 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.525 HD23 ' HA ' ' A' ' 84' ' ' LEU . 5.3 mt -70.22 133.27 46.88 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.464 1.102 . . . . 50.219999999999999 109.259 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.68 ' CB ' HD22 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -156.61 174.45 15.43 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.519 1.137 . . . . 72.450000000000003 109.568 179.972 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.577 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -119.2 164.92 14.88 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.514 1.133 . . . . 41.539999999999999 109.307 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -54.46 -35.12 62.69 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 124.478 1.111 . . . . 73.310000000000002 110.267 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -69.28 -46.33 67.46 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.554 1.159 . . . . 65.409999999999997 109.281 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.726 ' HB3' HD23 ' A' ' 138' ' ' LEU . 2.1 m-20 -108.02 44.43 1.1 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.464 1.103 . . . . 72.349999999999994 109.33 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.587 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -80.42 -51.59 8.65 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.47 1.106 . . . . 70.030000000000001 110.39 -179.962 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.04 -32.88 74.59 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.479 1.112 . . . . 73.219999999999999 109.289 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.404 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 4.5 tp10 -58.61 -67.8 0.32 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.498 1.124 . . . . 71.409999999999997 110.288 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.652 ' HB1' ' CG2' ' A' ' 83' ' ' ILE . . . -47.71 -29.66 3.23 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.495 1.122 . . . . 72.310000000000002 109.302 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.496 ' HG ' HD13 ' A' ' 111' ' ' ILE . 1.2 tt -69.9 -49.62 50.4 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.506 1.128 . . . . 71.420000000000002 109.332 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -47.19 -33.15 5.03 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.474 1.109 . . . . 73.030000000000001 110.326 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.814 HG21 ' HE1' ' A' ' 173' ' ' MET . 1.8 t -79.31 -64.69 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.531 1.145 . . . . 73.549999999999997 109.224 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.607 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.8 OUTLIER -45.08 -22.48 0.1 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.489 1.118 . . . . 74.120000000000005 110.353 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.435 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.1 OUTLIER -78.02 -59.91 2.59 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.541 1.151 . . . . 75.209999999999994 109.291 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.836 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -61.73 -21.55 64.61 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.509 1.131 . . . . 71.230000000000004 109.375 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.836 ' N ' HD23 ' A' ' 99' ' ' LEU . 22.6 mt -66.42 -52.61 44.73 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.521 1.138 . . . . 73.400000000000006 109.292 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.549 ' OE1' ' NE2' ' A' ' 97' ' ' GLN . 10.4 pt20 -81.0 49.86 1.3 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.485 1.116 . . . . 72.420000000000002 110.276 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -169.63 -65.79 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.498 1.124 . . . . 64.230000000000004 109.337 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -48.42 -48.13 37.38 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.455 1.097 . . . . 75.040000000000006 109.29 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -115.94 -29.8 6.24 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.596 1.185 . . . . 74.450000000000003 111.018 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.43 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 95.21 45.83 2.95 Favored Glycine 0 CA--C 1.53 1.012 0 O-C-N 124.517 1.136 . . . . 64.239999999999995 110.95 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.903 ' HA ' ' HZ3' ' A' ' 80' ' ' LYS . 10.0 mm -81.29 68.12 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.452 0.736 . . . . 75.340000000000003 109.326 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.524 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -118.42 155.46 51.96 Favored Pre-proline 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 64.019999999999996 109.327 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.524 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.96 154.43 99.69 Favored 'Cis proline' 0 C--N 1.359 1.117 0 C-N-CA 120.925 -2.531 . . . . 54.0 111.049 -0.111 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -135.2 142.99 14.49 Favored Glycine 0 CA--C 1.531 1.038 0 O-C-N 124.468 1.105 . . . . 43.539999999999999 110.957 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.677 HG22 HD11 ' A' ' 79' ' ' LEU . 3.3 tt -153.2 151.92 10.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.506 0.768 . . . . 75.409999999999997 109.269 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.607 HG23 ' HG2' ' A' ' 97' ' ' GLN . 21.3 pt -95.73 -178.14 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.445 1.091 . . . . 74.409999999999997 109.293 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.45 ' HB3' ' CE1' ' A' ' 85' ' ' HIS . 8.0 t80 -82.07 -19.21 40.7 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.488 1.118 . . . . 64.140000000000001 111.059 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.45 -4.37 51.41 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.425 1.078 . . . . 63.039999999999999 109.251 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.43 ' O ' HD11 ' A' ' 110' ' ' ILE . 48.6 mm-40 -109.09 -12.22 14.85 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.502 1.126 . . . . 71.049999999999997 110.292 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.444 ' CG ' ' HD2' ' A' ' 116' ' ' PRO . 6.2 ttm -55.74 143.89 58.08 Favored Pre-proline 0 C--N 1.326 -0.439 0 O-C-N 124.465 1.103 . . . . 73.439999999999998 111.06 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.444 ' HD2' ' CG ' ' A' ' 115' ' ' MET . 18.2 Cg_endo -74.99 83.48 1.81 Allowed 'Trans proline' 0 C--N 1.36 1.159 0 O-C-N 124.498 1.788 . . . . 72.030000000000001 110.964 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.435 ' CD2' ' HB3' ' A' ' 115' ' ' MET . 1.6 p80 -165.56 145.58 6.71 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.51 1.131 . . . . 71.239999999999995 109.627 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -151.5 94.14 0.15 Allowed Glycine 0 CA--C 1.529 0.96 0 O-C-N 124.526 1.141 . . . . 63.109999999999999 110.961 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.413 ' N ' ' HD3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER -123.02 177.69 5.4 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.427 0.722 . . . . 65.209999999999994 110.332 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -47.66 -72.08 0.06 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.529 1.143 . . . . 74.340000000000003 110.326 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -104.3 -175.57 2.83 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.521 1.138 . . . . 72.099999999999994 109.612 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.583 HD22 ' N ' ' A' ' 122' ' ' LEU . 0.4 OUTLIER -103.68 23.15 13.17 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.513 1.133 . . . . 62.310000000000002 109.332 179.959 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.89 175.5 0.12 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.559 1.162 . . . . 73.329999999999998 110.318 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 65.28 50.01 1.84 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.485 1.116 . . . . 73.230000000000004 109.274 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.634 HD12 ' N ' ' A' ' 126' ' ' ASP . 2.4 pp -59.8 -17.61 37.15 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.479 1.112 . . . . 72.109999999999999 109.249 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.634 ' N ' HD12 ' A' ' 125' ' ' LEU . 7.4 t0 -62.81 -14.12 41.72 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 124.568 1.168 . . . . 74.099999999999994 109.295 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -55.54 -26.29 42.42 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.518 1.136 . . . . 73.209999999999994 109.366 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -93.91 -22.5 18.57 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.459 1.099 . . . . 72.230000000000004 109.324 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.568 HG12 ' O ' ' A' ' 129' ' ' VAL . 25.4 t -82.8 5.17 2.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.5 1.125 . . . . 63.520000000000003 109.259 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 -143.55 118.54 10.02 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.579 1.175 . . . . 74.219999999999999 109.293 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 102.1 42.19 2.29 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.478 1.111 . . . . 30.350000000000001 111.032 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' SER . . . . . 0.462 ' CB ' ' HA ' ' A' ' 81' ' ' PHE . 0.2 OUTLIER -163.26 -177.03 5.11 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.513 0.772 . . . . 52.119999999999997 110.014 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.832 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -107.24 -25.86 11.31 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.536 1.148 . . . . 73.120000000000005 109.343 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.832 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 4.2 m-90 -159.66 172.9 16.91 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.487 1.117 . . . . 74.540000000000006 108.035 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.491 ' O ' ' CD1' ' A' ' 137' ' ' LEU . 38.9 p -147.25 124.62 11.6 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.518 1.136 . . . . 61.5 110.421 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.764 HD13 HG13 ' A' ' 83' ' ' ILE . 1.1 mp -84.32 128.65 38.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.528 1.143 . . . . 65.310000000000002 109.353 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.717 HD12 ' C ' ' A' ' 136' ' ' ILE . 2.0 mp -110.96 101.69 10.23 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.508 1.13 . . . . 74.329999999999998 109.252 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.726 HD23 ' HB3' ' A' ' 89' ' ' ASP . 0.1 OUTLIER -62.02 89.87 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.43 1.081 . . . . 73.519999999999996 109.306 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.864 HD21 HG23 ' A' ' 185' ' ' THR . 5.2 tp -63.04 99.99 0.19 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.472 1.107 . . . . 72.329999999999998 109.27 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 18.9 m -131.11 154.11 48.65 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.542 1.151 . . . . 74.219999999999999 110.397 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -52.71 -34.32 51.81 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.54 1.15 . . . . 72.120000000000005 110.304 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -89.39 -53.06 4.72 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.541 1.151 . . . . 73.010000000000005 109.324 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.592 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 58.7 t80 -55.16 -19.8 8.69 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.442 1.089 . . . . 71.109999999999999 110.982 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.594 ' C ' HD13 ' A' ' 144' ' ' LEU . 3.0 tm? -63.08 -67.83 0.39 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.52 1.138 . . . . 64.150000000000006 109.3 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.454 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 0.2 OUTLIER -62.7 -15.03 50.87 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.521 1.138 . . . . 72.040000000000006 110.255 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -64.21 -60.65 2.95 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.551 1.157 . . . . 65.409999999999997 109.246 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.573 HG23 ' CZ ' ' A' ' 151' ' ' PHE . 1.0 OUTLIER -92.06 -47.03 7.48 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.523 1.139 . . . . 74.439999999999998 110.392 -179.946 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.502 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 30.2 t-105 -43.37 -35.72 1.65 Allowed 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.503 1.127 . . . . 73.0 108.017 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 149' ' ' CYS . . . . . 0.454 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 17.9 t -80.37 -45.01 18.45 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.479 1.112 . . . . 73.420000000000002 108.282 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' ASN . . . . . 0.427 ' N ' ' O ' ' A' ' 147' ' ' THR . 24.3 t-20 -60.7 -15.65 31.26 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.461 1.1 . . . . 50.240000000000002 109.317 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.698 ' CZ ' HD12 ' A' ' 157' ' ' LEU . 10.7 m-30 -82.41 -50.91 8.36 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.54 1.15 . . . . 75.209999999999994 110.951 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -46.26 -38.11 8.11 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.507 1.13 . . . . 72.049999999999997 110.385 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -77.66 -33.76 53.32 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.483 1.114 . . . . 72.400000000000006 110.957 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -116.41 91.32 3.55 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.468 1.105 . . . . 73.219999999999999 110.966 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.2 t -62.56 -13.03 26.52 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.5 1.125 . . . . 72.409999999999997 110.334 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 12.1 t -70.19 -18.64 63.19 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.461 1.1 . . . . 63.240000000000002 109.956 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.698 HD12 ' CZ ' ' A' ' 151' ' ' PHE . 0.2 OUTLIER -88.58 -36.02 16.57 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.523 1.139 . . . . 74.239999999999995 109.315 179.98 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 158' ' ' MET . . . . . 0.479 ' HA ' ' CE ' ' A' ' 158' ' ' MET . 2.2 mmt -68.67 -11.55 60.3 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.53 1.144 . . . . 65.049999999999997 110.989 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -77.58 -48.52 16.73 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.465 1.103 . . . . 75.329999999999998 109.317 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.471 ' HB3' ' CG2' ' A' ' 170' ' ' VAL . 0.4 OUTLIER -59.86 -24.88 64.59 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.495 1.122 . . . . 70.430000000000007 110.019 179.958 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 161' ' ' VAL . . . . . 0.832 ' O ' HD11 ' A' ' 192' ' ' ILE . 44.2 t -62.01 -18.03 18.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.513 1.133 . . . . 60.130000000000003 109.337 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 162' ' ' ASN . . . . . 0.42 ' HB3' ' NE2' ' A' ' 164' ' ' GLN . 4.0 t-20 -79.45 1.36 25.82 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.427 1.079 . . . . 45.030000000000001 109.271 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.487 ' NH1' ' ND2' ' A' ' 193' ' ' ASN . 17.6 mmm-85 63.33 62.97 0.93 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.449 1.093 . . . . 62.030000000000001 110.323 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 164' ' ' GLN . . . . . 0.549 HE21 ' N ' ' A' ' 164' ' ' GLN . 0.0 OUTLIER -60.1 -173.66 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 75.209999999999994 110.244 -179.973 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -124.54 24.72 7.8 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.572 1.17 . . . . 73.129999999999995 109.62 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -82.95 174.89 10.49 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.566 1.166 . . . . 74.219999999999999 109.284 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 167' ' ' TYR . . . . . 0.714 ' HB2' HG22 ' A' ' 221' ' ' ILE . 9.9 t80 -45.27 -65.47 0.53 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.53 1.144 . . . . 74.400000000000006 111.04 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.402 ' CG ' ' O ' ' A' ' 129' ' ' VAL . 2.0 p-10 -76.84 154.67 33.64 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.487 1.117 . . . . 63.32 109.316 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.54 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 43.2 m -140.23 168.09 20.63 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.479 1.112 . . . . 73.349999999999994 110.065 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.99 ' O ' HD12 ' A' ' 171' ' ' ILE . 73.0 t -122.72 130.96 74.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.546 1.154 . . . . 52.43 109.253 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.99 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.1 mp -142.34 110.74 5.9 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.52 1.138 . . . . 73.099999999999994 109.313 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 172' ' ' PRO . . . . . 0.674 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.0 Cg_endo -75.06 106.77 2.34 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.533 1.807 . . . . 75.430000000000007 110.939 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 173' ' ' MET . . . . . 0.814 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.1 ttt -87.37 155.69 19.92 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.515 1.135 . . . . 62.119999999999997 110.968 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 174' ' ' ARG . . . . . 0.517 HH21 ' HB2' ' A' ' 139' ' ' LEU . 0.0 OUTLIER -115.89 116.53 40.44 Favored Pre-proline 0 C--N 1.325 -0.46 0 O-C-N 124.49 1.119 . . . . 73.209999999999994 110.321 -179.966 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 175' ' ' PRO . . . . . 0.663 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -75.04 160.12 40.41 Favored 'Trans proline' 0 C--N 1.359 1.109 0 O-C-N 124.492 1.786 . . . . 43.25 110.943 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.824 ' N ' HD13 ' A' ' 176' ' ' LEU . 0.0 OUTLIER -95.25 -43.8 7.9 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.526 1.141 . . . . 73.420000000000002 109.257 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 177' ' ' ASN . . . . . 0.469 ' H ' ' ND2' ' A' ' 177' ' ' ASN . 1.9 p30 -72.77 -25.71 61.28 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.509 1.13 . . . . 60.130000000000003 109.25 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -110.26 102.38 51.05 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.52 1.138 . . . . 73.349999999999994 109.326 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.04 134.32 17.61 Favored 'Trans proline' 0 C--N 1.359 1.118 0 O-C-N 124.48 1.779 . . . . 71.040000000000006 110.969 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.401 ' HA ' HD22 ' A' ' 180' ' ' LEU . 1.2 tm? -141.18 97.18 6.98 Favored Pre-proline 0 C--N 1.326 -0.42 0 O-C-N 124.493 1.121 . . . . 61.520000000000003 109.3 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.02 165.8 30.52 Favored 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.495 1.787 . . . . 61.350000000000001 110.973 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 182' ' ' ARG . . . . . 0.416 ' HG3' ' N ' ' A' ' 183' ' ' GLU . 5.4 ptm180 -68.11 -22.33 64.9 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.54 1.15 . . . . 73.209999999999994 110.283 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 183' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' A' ' 182' ' ' ARG . 11.6 pt-20 -61.96 -14.5 35.45 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.53 1.144 . . . . 72.310000000000002 110.262 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -121.4 3.43 10.26 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.594 1.184 . . . . 74.439999999999998 110.313 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 185' ' ' THR . . . . . 0.864 HG23 HD21 ' A' ' 139' ' ' LEU . 10.5 m -100.42 144.13 27.87 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.476 1.11 . . . . 64.049999999999997 110.425 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 186' ' ' PRO . . . . . 0.786 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -74.95 164.38 33.52 Favored 'Trans proline' 0 C--N 1.36 1.179 0 O-C-N 124.522 1.801 . . . . 72.310000000000002 110.97 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 187' ' ' PHE . . . . . 0.495 ' O ' ' CG2' ' A' ' 191' ' ' THR . 5.7 p90 -77.01 -7.0 54.87 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.515 1.134 . . . . 74.439999999999998 110.996 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -95.03 -51.36 4.69 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.557 1.161 . . . . 74.530000000000001 109.252 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.786 HD12 ' CG ' ' A' ' 186' ' ' PRO . 51.9 mt -68.41 -42.55 78.82 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.555 1.159 . . . . 63.43 109.37 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 190' ' ' GLN . . . . . 0.436 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.9 pt20 -65.3 -9.41 24.07 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.494 1.121 . . . . 74.140000000000001 110.241 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 191' ' ' THR . . . . . 0.495 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 67.7 p -119.32 17.95 13.0 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.472 1.107 . . . . 63.039999999999999 110.439 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.832 HD11 ' O ' ' A' ' 161' ' ' VAL . 7.4 mt -112.97 157.36 13.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.552 1.157 . . . . 72.219999999999999 109.277 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 193' ' ' ASN . . . . . 0.555 HD21 HD11 ' A' ' 171' ' ' ILE . 46.2 p-10 -65.53 75.38 0.06 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.477 1.111 . . . . 72.430000000000007 109.324 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 194' ' ' ALA . . . . . 0.674 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -71.9 149.58 45.0 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.424 1.078 . . . . 74.310000000000002 109.292 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 195' ' ' LEU . . . . . 0.584 HD23 HD12 ' A' ' 209' ' ' ILE . 0.5 OUTLIER -93.15 124.53 37.19 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.533 1.146 . . . . 64.439999999999998 109.291 -179.951 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -118.6 109.17 15.83 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.529 1.143 . . . . 72.209999999999994 110.287 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.819 ' CG ' HD11 ' A' ' 176' ' ' LEU . 14.0 pt-20 -79.63 -34.03 40.93 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.453 1.095 . . . . 73.510000000000005 110.314 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 198' ' ' GLU . . . . . 0.575 ' CG ' HD12 ' A' ' 176' ' ' LEU . 11.7 pt-20 -79.62 2.43 22.51 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.49 1.119 . . . . 64.310000000000002 110.303 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 29.4 t -96.52 145.35 25.78 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.445 1.09 . . . . 53.450000000000003 110.063 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -57.55 -28.69 63.76 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.535 1.147 . . . . 72.439999999999998 110.371 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -93.59 23.44 30.41 Favored Glycine 0 CA--C 1.53 1.027 0 O-C-N 124.552 1.158 . . . . 72.209999999999994 111.03 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 202' ' ' PHE . . . . . 0.863 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.2 OUTLIER -59.04 -43.14 97.04 Favored Pre-proline 0 C--N 1.324 -0.534 0 O-C-N 124.567 0.804 . . . . 75.299999999999997 111.027 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 203' ' ' PRO . . . . . 0.619 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -75.03 -36.05 2.76 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.487 1.783 . . . . 71.030000000000001 110.971 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -57.87 -47.2 83.42 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.483 1.114 . . . . 70.140000000000001 110.36 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 205' ' ' GLN . . . . . 0.401 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 1.8 mt-30 -70.67 -40.04 73.19 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.495 1.122 . . . . 64.439999999999998 110.293 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 206' ' ' VAL . . . . . 0.863 HG23 ' O ' ' A' ' 202' ' ' PHE . 89.7 t -66.85 -27.83 41.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.453 1.095 . . . . 63.229999999999997 109.273 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 207' ' ' GLU . . . . . 0.477 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 2.3 mt-10 -80.31 -51.72 8.56 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.494 1.121 . . . . 72.120000000000005 110.253 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 77.4 mtt180 -62.75 -57.92 9.26 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.518 1.136 . . . . 55.350000000000001 110.34 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 209' ' ' ILE . . . . . 0.766 HG22 ' CD1' ' A' ' 210' ' ' PHE . 65.5 mt -52.49 -53.82 18.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.485 1.116 . . . . 73.019999999999996 109.29 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 210' ' ' PHE . . . . . 0.766 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.1 m-85 -104.97 57.51 0.69 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.488 1.118 . . . . 74.439999999999998 110.959 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 211' ' ' GLN . . . . . 0.503 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -96.23 139.51 32.28 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.414 1.071 . . . . 53.43 110.291 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 215' ' ' TYR . 56.9 tt0 -49.98 -53.35 27.03 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.516 1.135 . . . . 73.209999999999994 110.309 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -47.1 -24.25 0.63 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.478 1.111 . . . . 64.340000000000003 110.013 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.503 HG23 ' HG2' ' A' ' 211' ' ' GLN . 34.6 t -95.9 -32.02 4.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.513 1.133 . . . . 62.109999999999999 109.261 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 215' ' ' TYR . . . . . 0.45 ' N ' ' O ' ' A' ' 212' ' ' GLU . 4.5 t80 -63.3 -36.41 83.6 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.512 1.133 . . . . 72.530000000000001 111.027 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt -50.4 -60.86 2.57 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.547 1.154 . . . . 72.230000000000004 109.289 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 217' ' ' THR . . . . . 0.966 HG22 HD11 ' A' ' 221' ' ' ILE . 1.3 m -51.98 -46.89 65.03 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.446 1.091 . . . . 73.209999999999994 110.443 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 218' ' ' GLN . . . . . 0.695 ' HA ' HD12 ' A' ' 221' ' ' ILE . 11.0 mm-40 -49.11 -54.67 15.11 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.476 1.11 . . . . 71.010000000000005 110.265 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 219' ' ' GLN . . . . . 0.417 ' NE2' ' HB2' ' A' ' 223' ' ' LYS . 21.8 tp60 -45.42 -52.81 9.59 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.514 1.134 . . . . 75.129999999999995 110.295 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -59.09 -44.87 91.96 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.483 1.115 . . . . 74.019999999999996 110.399 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 221' ' ' ILE . . . . . 0.966 HD11 HG22 ' A' ' 217' ' ' THR . 17.4 mt -59.18 -27.31 36.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.536 1.148 . . . . 72.409999999999997 109.311 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 222' ' ' TRP . . . . . 0.572 ' HB2' ' CE1' ' A' ' 167' ' ' TYR . 21.2 t90 -89.41 -17.42 28.8 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.98 -1.119 . . . . 71.519999999999996 107.98 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 223' ' ' LYS . . . . . 0.417 ' HB2' ' NE2' ' A' ' 219' ' ' GLN . 1.6 tmmm? -85.91 -29.73 23.41 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.457 1.098 . . . . 71.430000000000007 109.351 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 224' ' ' GLU . . . . . 0.463 ' CG ' ' HA ' ' A' ' 221' ' ' ILE . 0.2 OUTLIER -86.67 -35.26 19.43 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.458 1.099 . . . . 72.409999999999997 110.262 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.702 ' O ' HG13 ' A' ' 229' ' ' VAL . 14.9 t -62.57 -12.72 24.5 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.503 1.127 . . . . 75.030000000000001 110.357 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 226' ' ' ARG . . . . . 0.501 ' CG ' ' O ' ' A' ' 222' ' ' TRP . 6.2 mtm180 -79.47 -16.48 56.0 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.483 1.114 . . . . 75.510000000000005 110.243 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 227' ' ' ASN . . . . . 0.401 ' O ' ' N ' ' A' ' 231' ' ' ARG . 3.3 m-20 -89.21 -46.76 8.55 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.452 1.095 . . . . 44.219999999999999 109.277 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 10.6 mtm -57.53 -34.37 69.06 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.543 1.152 . . . . 75.329999999999998 110.977 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 229' ' ' VAL . . . . . 0.702 HG13 ' O ' ' A' ' 225' ' ' THR . 21.2 m -73.7 -51.21 25.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 O-C-N 124.507 1.129 . . . . 64.219999999999999 109.324 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 230' ' ' GLN . . . . . 0.501 ' N ' HG23 ' A' ' 229' ' ' VAL . 21.0 tp60 -71.41 -7.5 47.72 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.491 1.119 . . . . 71.030000000000001 110.314 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 231' ' ' ARG . . . . . 0.401 ' N ' ' O ' ' A' ' 227' ' ' ASN . 15.2 ttp180 -92.87 -82.42 0.33 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.468 1.105 . . . . 72.400000000000006 110.289 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -143.29 50.62 1.4 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.533 1.146 . . . . 55.409999999999997 110.318 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 233' ' ' PHE . . . . . 0.404 ' O ' HD13 ' A' ' 234' ' ' ILE . 1.5 t80 -163.18 -174.07 3.68 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.506 1.129 . . . . 71.420000000000002 111.022 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.404 HD13 ' O ' ' A' ' 233' ' ' PHE . 16.8 mm -139.84 150.94 21.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 124.454 1.097 . . . . 71.340000000000003 109.337 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 235' ' ' ALA . . . . . 0.661 ' HB2' HG11 ' A' ' 229' ' ' VAL . . . . . . . . 0 C--N 1.325 -0.498 0 O-C-N 124.529 1.143 . . . . 72.420000000000002 109.275 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.054 0 N-CA-C 110.93 -0.868 . . . . 60.409999999999997 110.93 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.97 -165.88 0.31 Allowed 'Trans proline' 0 C--N 1.361 1.188 0 O-C-N 124.533 1.807 . . . . 72.030000000000001 111.064 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.411 ' C ' ' CD1' ' A' ' 72' ' ' LEU . 0.1 OUTLIER -116.64 -73.11 0.66 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.503 1.127 . . . . 60.420000000000002 109.356 179.923 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -93.48 -54.93 1.62 Allowed Glycine 0 CA--C 1.529 0.943 0 O-C-N 124.503 1.127 . . . . 73.310000000000002 111.023 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 68.82 10.47 7.92 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.509 0.77 . . . . 73.219999999999999 109.977 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -43.49 130.48 5.12 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.491 1.119 . . . . 73.430000000000007 110.336 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -118.29 130.79 56.24 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.42 1.075 . . . . 73.209999999999994 110.303 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.505 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 2.9 p -132.05 157.27 43.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.568 1.168 . . . . 72.340000000000003 109.307 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.499 ' CE2' ' HG3' ' A' ' 108' ' ' PRO . 51.4 p90 -89.72 30.95 0.98 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.448 1.092 . . . . 71.209999999999994 110.984 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.626 HD11 HG22 ' A' ' 110' ' ' ILE . 6.1 tp -39.91 134.81 1.39 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.553 1.158 . . . . 72.129999999999995 109.359 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.475 ' O ' ' CB ' ' A' ' 133' ' ' ALA . 9.1 ttmt -74.84 -67.07 0.67 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.589 1.181 . . . . 71.319999999999993 109.365 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 1.08 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 1.5 p90 -152.16 140.68 20.69 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.384 1.052 . . . . 64.219999999999999 111.018 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.576 HG12 ' HB ' ' A' ' 135' ' ' THR . 8.6 p -84.07 171.59 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 O-C-N 124.48 1.112 . . . . 64.340000000000003 109.306 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 1.08 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 2.8 mp -137.4 86.04 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.574 1.172 . . . . 73.540000000000006 109.224 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.753 HD11 ' HB3' ' A' ' 128' ' ' ALA . 12.8 mt -70.41 101.38 1.94 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.501 1.125 . . . . 73.430000000000007 109.275 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.654 ' CE1' ' HB2' ' A' ' 113' ' ' ALA . 0.0 OUTLIER -121.32 174.62 6.61 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 124.552 1.157 . . . . 65.150000000000006 109.6 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.435 ' HB2' ' CD1' ' A' ' 143' ' ' PHE . . . -117.37 164.49 14.78 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.444 1.09 . . . . 74.400000000000006 109.252 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.4 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 21.0 tt0 -63.54 -11.4 24.04 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.512 1.132 . . . . 71.540000000000006 110.316 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -83.66 -45.93 12.89 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.488 1.118 . . . . 44.210000000000001 109.278 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.415 ' CG ' HD23 ' A' ' 138' ' ' LEU . 1.3 p30 -123.05 44.44 2.66 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.475 1.11 . . . . 74.519999999999996 109.324 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.623 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -76.03 -28.94 57.89 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.49 1.119 . . . . 71.319999999999993 110.42 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -84.72 -24.2 29.0 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.472 1.108 . . . . 73.230000000000004 109.408 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.424 ' HG3' ' ND2' ' A' ' 177' ' ' ASN . 0.0 OUTLIER -71.68 -54.73 9.38 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.495 1.122 . . . . 43.340000000000003 110.325 179.972 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.944 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -59.63 -35.63 74.75 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.471 1.107 . . . . 45.020000000000003 109.296 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.842 HD22 ' O ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -69.95 -49.6 50.17 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.537 1.148 . . . . 64.420000000000002 109.249 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.705 ' N ' HD13 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -44.97 -37.83 4.29 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.515 1.134 . . . . 63.009999999999998 110.232 -179.955 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.591 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.1 t -73.63 -64.51 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.489 1.118 . . . . 53.0 109.268 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.453 ' N ' HG12 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -41.67 -26.53 0.08 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.463 1.102 . . . . 74.200000000000003 110.302 -179.95 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.449 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.2 OUTLIER -71.34 -49.68 39.96 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.516 1.135 . . . . 73.299999999999997 109.286 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.85 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -74.95 -22.19 58.72 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.555 1.159 . . . . 74.120000000000005 109.333 -179.995 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.85 ' N ' HD23 ' A' ' 99' ' ' LEU . 30.8 mt -62.83 -51.73 65.89 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.529 1.143 . . . . 65.319999999999993 109.281 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 101' ' ' GLN . 10.0 pt20 -79.81 51.48 1.32 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.538 1.149 . . . . 73.120000000000005 110.297 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -170.13 -66.55 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.566 1.166 . . . . 61.140000000000001 109.27 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -50.28 -44.67 53.95 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.466 1.104 . . . . 72.430000000000007 109.36 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.513 ' HE2' HD23 ' A' ' 100' ' ' LEU . 1.6 m-85 -116.5 -32.27 5.28 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.514 1.134 . . . . 74.530000000000001 111.011 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.429 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 98.47 44.7 2.47 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 124.474 1.109 . . . . 64.409999999999997 110.978 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.414 HG23 ' HD3' ' A' ' 80' ' ' LYS . 8.9 mm -84.1 72.64 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.519 0.776 . . . . 71.230000000000004 109.31 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.522 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -119.9 156.69 54.01 Favored Pre-proline 0 C--N 1.324 -0.51 0 O-C-N 124.515 1.135 . . . . 74.439999999999998 109.322 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.522 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.1 Cg_endo -75.06 164.39 88.49 Favored 'Cis proline' 0 C--N 1.359 1.121 0 C-N-CA 120.994 -2.502 . . . . 65.209999999999994 110.953 0.025 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.44 125.4 5.02 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.405 1.066 . . . . 72.340000000000003 111.008 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.626 HG22 HD11 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -141.17 130.27 24.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.439 0.729 . . . . 70.310000000000002 109.271 179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 1.107 HD12 ' HB3' ' A' ' 113' ' ' ALA . 1.8 pt -94.19 148.49 4.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 124.447 1.092 . . . . 72.230000000000004 109.326 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.573 ' CE1' HD21 ' A' ' 84' ' ' LEU . 2.6 t80 -51.59 -20.25 1.88 Allowed 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.49 1.119 . . . . 70.420000000000002 110.965 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 1.107 ' HB3' HD12 ' A' ' 111' ' ' ILE . . . -78.89 -35.98 42.78 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.512 1.132 . . . . 64.439999999999998 109.288 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -83.37 -24.87 31.83 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.474 1.109 . . . . 71.400000000000006 110.327 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 42.1 tpp -37.37 110.81 0.51 Allowed Pre-proline 0 C--N 1.326 -0.45 0 O-C-N 124.536 1.147 . . . . 74.5 110.997 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.95 -16.54 20.28 Favored 'Trans proline' 0 C--N 1.36 1.158 0 O-C-N 124.525 1.803 . . . . 74.409999999999997 110.994 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -42.76 -34.12 0.86 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.514 1.134 . . . . 74.239999999999995 109.629 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' GLY . . . . . 0.509 ' HA3' HD12 ' A' ' 122' ' ' LEU . . . 179.58 165.02 32.98 Favored Glycine 0 CA--C 1.53 1.027 0 O-C-N 124.494 1.121 . . . . 63.420000000000002 110.967 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 36.6 mtt180 -41.38 -74.31 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.516 0.774 . . . . 73.129999999999995 110.345 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -133.47 -70.67 0.52 Allowed 'General case' 0 C--N 1.324 -0.535 0 O-C-N 124.553 1.158 . . . . 70.530000000000001 110.306 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -105.5 99.61 9.21 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.512 1.133 . . . . 74.010000000000005 109.571 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.806 HD13 ' N ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -110.94 -29.24 8.01 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.44 1.088 . . . . 75.030000000000001 109.279 179.995 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.635 ' H ' HD22 ' A' ' 122' ' ' LEU . 71.9 mm-40 -151.56 170.12 20.43 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.516 1.135 . . . . 72.140000000000001 110.313 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -43.97 149.84 0.3 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.491 1.119 . . . . 62.210000000000001 109.341 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.779 HD12 ' N ' ' A' ' 126' ' ' ASP . 0.7 OUTLIER -59.16 -17.37 26.6 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.564 1.165 . . . . 71.430000000000007 109.31 -179.982 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.779 ' N ' HD12 ' A' ' 125' ' ' LEU . 1.4 t70 -59.8 -20.23 55.52 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.504 1.127 . . . . 71.409999999999997 109.328 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -55.3 -21.87 16.49 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.434 1.084 . . . . 72.519999999999996 109.281 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.753 ' HB3' HD11 ' A' ' 84' ' ' LEU . . . -77.42 -40.87 41.99 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.488 1.118 . . . . 62.420000000000002 109.326 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.534 HG11 HG22 ' A' ' 170' ' ' VAL . 3.6 m -92.27 29.3 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 O-C-N 124.576 1.173 . . . . 73.530000000000001 109.26 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 24.4 m-20 -109.97 124.22 51.03 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.493 1.121 . . . . 73.120000000000005 109.283 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' GLY . . . . . 0.556 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 44.21 73.05 0.28 Allowed Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.532 1.145 . . . . 41.200000000000003 111.028 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' SER . . . . . 0.402 ' O ' ' O ' ' A' ' 167' ' ' TYR . 2.5 m -162.96 -175.79 4.56 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.491 0.76 . . . . 73.239999999999995 109.955 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.564 ' CB ' ' CE3' ' A' ' 134' ' ' TRP . . . -99.83 -77.11 0.53 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.497 1.123 . . . . 54.219999999999999 109.296 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.586 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 0.8 OUTLIER -125.18 176.16 6.91 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.544 1.153 . . . . 74.030000000000001 108.001 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.576 ' HB ' HG12 ' A' ' 82' ' ' VAL . 3.4 t -153.98 130.86 10.89 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.462 1.101 . . . . 73.329999999999998 110.423 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.763 HD13 ' HE2' ' A' ' 81' ' ' PHE . 1.4 mp -84.33 133.53 29.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.514 1.134 . . . . 64.040000000000006 109.303 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.692 HD11 ' CG1' ' A' ' 170' ' ' VAL . 10.2 mt -116.13 96.75 5.71 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.51 1.131 . . . . 75.109999999999999 109.311 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.944 HD21 ' HB2' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.34 92.08 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.522 1.139 . . . . 63.219999999999999 109.311 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.576 HD11 ' HB2' ' A' ' 172' ' ' PRO . 97.4 mt -68.43 111.04 4.42 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.513 1.133 . . . . 61.340000000000003 109.3 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.663 HG23 ' CG ' ' A' ' 178' ' ' ASN . 4.5 m -124.61 160.97 27.26 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 124.482 1.114 . . . . 72.140000000000001 110.47 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -56.04 -39.12 71.51 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.523 1.14 . . . . 73.430000000000007 110.352 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -89.6 -52.62 4.92 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.452 1.095 . . . . 71.310000000000002 109.318 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.54 ' CE2' HG21 ' A' ' 147' ' ' THR . 55.3 t80 -53.23 -24.92 12.34 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.536 1.148 . . . . 72.540000000000006 110.968 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.611 HD13 ' N ' ' A' ' 145' ' ' ARG . 2.0 tm? -70.95 -67.19 0.52 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.545 1.153 . . . . 75.340000000000003 109.304 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.611 ' N ' HD13 ' A' ' 144' ' ' LEU . 0.8 OUTLIER -46.23 -25.03 0.54 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.526 1.141 . . . . 70.319999999999993 110.296 179.99 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -81.03 -54.54 5.46 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.545 1.153 . . . . 55.100000000000001 109.263 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.545 ' O ' ' CG ' ' A' ' 151' ' ' PHE . 27.2 p -70.48 -7.54 44.23 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.497 1.123 . . . . 74.319999999999993 110.414 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.564 ' CZ2' ' HB3' ' A' ' 186' ' ' PRO . 0.8 OUTLIER -96.77 -25.75 15.39 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.447 1.092 . . . . 75.230000000000004 108.059 179.916 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 14.5 t -82.77 -39.48 21.77 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.448 1.093 . . . . 74.420000000000002 108.269 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' ASN . . . . . 0.405 ' O ' ' N ' ' A' ' 154' ' ' TYR . 4.0 m120 -68.12 -53.13 27.6 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.442 1.089 . . . . 75.150000000000006 109.269 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 1.009 ' CZ ' HD12 ' A' ' 157' ' ' LEU . 6.9 m-30 -46.43 -53.2 11.55 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.512 1.132 . . . . 74.120000000000005 111.01 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -46.83 -47.53 21.12 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.534 1.146 . . . . 74.430000000000007 110.301 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -79.54 -19.43 49.57 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.581 1.176 . . . . 74.409999999999997 110.965 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.405 ' N ' ' O ' ' A' ' 150' ' ' ASN . 3.1 m-30 -113.31 97.82 6.72 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.551 1.157 . . . . 73.540000000000006 110.998 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.49 ' O ' ' ND2' ' A' ' 159' ' ' ASN . 1.2 t -74.93 -3.01 29.63 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.509 1.131 . . . . 64.120000000000005 110.389 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 8.8 t -78.51 -67.82 0.7 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.578 1.174 . . . . 54.32 109.939 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 1.009 HD12 ' CZ ' ' A' ' 151' ' ' PHE . 0.4 OUTLIER -44.04 -51.69 7.65 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.491 1.12 . . . . 71.340000000000003 109.263 -179.933 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 158' ' ' MET . . . . . 0.488 ' HA ' ' CE ' ' A' ' 158' ' ' MET . 6.6 mmt -44.15 -43.24 6.91 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.558 1.161 . . . . 75.120000000000005 110.937 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 159' ' ' ASN . . . . . 0.49 ' ND2' ' O ' ' A' ' 155' ' ' THR . 5.2 m120 -64.24 -42.29 96.6 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 74.209999999999994 109.241 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.575 ' HB2' HG21 ' A' ' 170' ' ' VAL . 1.3 m -59.37 -35.2 73.46 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.592 1.183 . . . . 72.140000000000001 110.001 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 161' ' ' VAL . . . . . 0.861 ' O ' HD13 ' A' ' 192' ' ' ILE . 36.1 t -62.08 -18.36 19.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 O-C-N 124.577 1.173 . . . . 71.430000000000007 109.348 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -87.48 11.42 14.79 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.579 1.174 . . . . 70.319999999999993 109.282 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.697 ' NE ' HG23 ' A' ' 192' ' ' ILE . 0.6 OUTLIER 38.75 59.08 1.63 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.55 1.156 . . . . 74.5 110.271 -179.956 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -73.17 -173.11 1.23 Allowed 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.557 1.161 . . . . 74.109999999999999 110.284 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 27.6 p80 -85.59 51.04 2.08 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.528 1.143 . . . . 64.519999999999996 109.595 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.584 ' C ' HG21 ' A' ' 221' ' ' ILE . 0.0 OUTLIER -109.9 173.33 6.38 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.518 1.136 . . . . 75.450000000000003 109.23 -179.984 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 167' ' ' TYR . . . . . 0.402 ' O ' ' O ' ' A' ' 132' ' ' SER . 28.2 p90 -87.46 40.33 0.92 Allowed 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.465 1.103 . . . . 75.099999999999994 110.964 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -164.16 124.13 2.06 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.519 1.137 . . . . 71.319999999999993 109.296 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.504 ' HB3' ' CD1' ' A' ' 134' ' ' TRP . 27.6 t -118.28 105.79 12.12 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.441 1.088 . . . . 74.230000000000004 110.052 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.692 ' CG1' HD11 ' A' ' 137' ' ' LEU . 5.0 t -79.53 122.08 34.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.495 1.122 . . . . 65.510000000000005 109.319 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.597 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.3 mp -128.67 113.74 19.24 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.464 1.103 . . . . 51.310000000000002 109.251 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 172' ' ' PRO . . . . . 0.915 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.1 Cg_endo -75.04 107.43 2.48 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.502 1.791 . . . . 74.209999999999994 110.992 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 173' ' ' MET . . . . . 0.664 ' CE ' HD12 ' A' ' 195' ' ' LEU . 3.2 ttt -87.75 152.25 22.27 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.501 1.126 . . . . 64.420000000000002 110.976 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 174' ' ' ARG . . . . . 0.424 ' N ' ' HG2' ' A' ' 173' ' ' MET . 0.0 OUTLIER -100.76 112.41 64.64 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.509 1.131 . . . . 63.020000000000003 110.305 179.975 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 175' ' ' PRO . . . . . 0.413 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.2 Cg_endo -74.97 151.57 39.86 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.58 1.831 . . . . 74.019999999999996 111.026 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.873 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -86.56 -42.68 13.31 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.581 1.175 . . . . 65.219999999999999 109.33 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 177' ' ' ASN . . . . . 0.424 ' ND2' ' HG3' ' A' ' 92' ' ' GLU . 7.2 p30 -72.17 -28.0 62.94 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.528 1.142 . . . . 71.209999999999994 109.269 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 178' ' ' ASN . . . . . 0.663 ' CG ' HG23 ' A' ' 140' ' ' THR . 6.7 m-20 -110.7 98.19 36.41 Favored Pre-proline 0 C--N 1.324 -0.507 0 O-C-N 124.533 1.146 . . . . 73.400000000000006 109.325 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.98 114.98 4.15 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.565 1.824 . . . . 43.100000000000001 110.992 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.628 HD12 ' OG1' ' A' ' 185' ' ' THR . 0.4 OUTLIER -121.88 96.65 46.8 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.509 1.131 . . . . 71.310000000000002 109.313 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.05 167.49 26.89 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.44 1.758 . . . . 55.43 110.989 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 14.4 ptt180 -61.55 -25.58 67.39 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.563 1.164 . . . . 71.219999999999999 110.33 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -71.31 -9.99 59.03 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.433 1.083 . . . . 72.510000000000005 110.343 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -112.95 -28.87 7.56 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.482 1.114 . . . . 74.040000000000006 110.295 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 185' ' ' THR . . . . . 0.628 ' OG1' HD12 ' A' ' 180' ' ' LEU . 53.4 m -72.3 143.92 86.29 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.463 1.102 . . . . 70.510000000000005 110.352 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 186' ' ' PRO . . . . . 0.669 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.7 Cg_endo -74.96 146.56 32.96 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.492 1.785 . . . . 62.420000000000002 111.067 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 187' ' ' PHE . . . . . 0.606 ' O ' HG23 ' A' ' 191' ' ' THR . 24.7 p90 -61.69 -12.49 16.71 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.56 1.162 . . . . 73.540000000000006 110.991 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 188' ' ' ALA . . . . . 0.417 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -87.05 -53.62 4.77 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.53 1.144 . . . . 53.409999999999997 109.306 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.669 HD12 ' CG ' ' A' ' 186' ' ' PRO . 23.2 mt -74.53 -16.34 60.83 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.562 1.164 . . . . 53.299999999999997 109.311 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 190' ' ' GLN . . . . . 0.401 ' O ' ' CG ' ' A' ' 190' ' ' GLN . 6.2 tt0 -86.68 -8.25 57.59 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.567 1.167 . . . . 64.120000000000005 110.243 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 191' ' ' THR . . . . . 0.606 HG23 ' O ' ' A' ' 187' ' ' PHE . 31.5 p -115.73 18.71 15.63 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.515 1.134 . . . . 75.140000000000001 110.322 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.861 HD13 ' O ' ' A' ' 161' ' ' VAL . 8.8 mt -130.73 145.84 34.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.444 1.09 . . . . 54.340000000000003 109.248 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -52.77 118.53 3.73 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.504 1.127 . . . . 41.0 109.27 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 194' ' ' ALA . . . . . 0.915 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -110.95 177.6 4.61 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.5 1.125 . . . . 70.329999999999998 109.297 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 195' ' ' LEU . . . . . 0.665 HD23 HD12 ' A' ' 209' ' ' ILE . 0.2 OUTLIER -109.63 127.84 54.82 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.452 1.095 . . . . 74.099999999999994 109.238 -179.958 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -109.51 120.04 41.28 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.526 1.141 . . . . 75.349999999999994 110.258 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.873 ' HG3' HD21 ' A' ' 176' ' ' LEU . 12.0 tp10 -101.84 -22.41 14.36 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.516 1.135 . . . . 63.100000000000001 110.236 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 198' ' ' GLU . . . . . 0.432 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 1.3 pt-20 -94.06 9.88 35.9 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.455 1.097 . . . . 75.5 110.298 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 2.3 t -112.31 151.22 29.96 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.504 1.127 . . . . 64.099999999999994 109.979 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 26.5 ttt85 -64.23 -26.46 68.51 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.52 1.138 . . . . 72.540000000000006 110.286 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -89.51 26.7 8.75 Favored Glycine 0 CA--C 1.53 0.989 0 O-C-N 124.465 1.103 . . . . 63.039999999999999 111.001 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 202' ' ' PHE . . . . . 0.778 ' O ' HG23 ' A' ' 206' ' ' VAL . 3.3 t80 -68.34 -38.72 13.75 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 124.506 0.768 . . . . 73.510000000000005 110.972 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 203' ' ' PRO . . . . . 0.687 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.1 Cg_endo -74.95 -30.11 7.59 Favored 'Trans proline' 0 C--N 1.36 1.168 0 O-C-N 124.519 1.8 . . . . 62.439999999999998 111.021 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 204' ' ' THR . . . . . 0.419 HG22 ' N ' ' A' ' 205' ' ' GLN . 0.9 OUTLIER -64.14 -65.73 0.64 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.475 1.109 . . . . 72.530000000000001 110.4 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 205' ' ' GLN . . . . . 0.419 ' N ' HG22 ' A' ' 204' ' ' THR . 7.4 mt-30 -50.09 -41.82 48.92 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.49 1.118 . . . . 73.340000000000003 110.334 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 206' ' ' VAL . . . . . 0.794 HG11 HD22 ' A' ' 100' ' ' LEU . 53.7 t -59.84 -30.06 44.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.514 1.134 . . . . 62.329999999999998 109.288 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -79.81 -53.25 6.96 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.516 1.135 . . . . 70.040000000000006 110.297 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 208' ' ' ARG . . . . . 0.419 ' N ' ' HD2' ' A' ' 208' ' ' ARG . 3.2 mpt_? -55.91 -59.15 5.3 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.503 1.127 . . . . 73.319999999999993 110.305 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 209' ' ' ILE . . . . . 0.665 HD12 HD23 ' A' ' 195' ' ' LEU . 73.2 mt -54.29 -59.15 2.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.572 1.17 . . . . 73.510000000000005 109.29 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 210' ' ' PHE . . . . . 0.647 ' CD2' HG13 ' A' ' 206' ' ' VAL . 1.0 OUTLIER -92.17 62.34 4.11 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.501 1.126 . . . . 73.310000000000002 111.05 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 211' ' ' GLN . . . . . 0.536 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -110.87 145.46 38.23 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.52 1.137 . . . . 73.319999999999993 110.289 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 215' ' ' TYR . 27.8 tt0 -49.11 -55.14 13.19 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.487 1.117 . . . . 74.140000000000001 110.333 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.68 -24.23 1.3 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.517 1.136 . . . . 71.540000000000006 110.022 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.536 HG23 ' HG2' ' A' ' 211' ' ' GLN . 40.4 t -96.31 -27.46 3.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.539 1.149 . . . . 42.140000000000001 109.265 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 215' ' ' TYR . . . . . 0.447 ' N ' ' O ' ' A' ' 212' ' ' GLU . 12.0 t80 -66.08 -27.21 67.9 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.493 1.121 . . . . 64.239999999999995 110.973 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 216' ' ' LYS . . . . . 0.443 ' O ' ' N ' ' A' ' 220' ' ' THR . 12.8 mmtp -59.49 -58.27 9.35 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.382 1.051 . . . . 53.140000000000001 109.274 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 217' ' ' THR . . . . . 0.636 HG22 HD11 ' A' ' 221' ' ' ILE . 4.4 m -50.1 -62.94 1.28 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.503 1.127 . . . . 64.340000000000003 110.355 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 218' ' ' GLN . . . . . 0.475 ' HA ' HD12 ' A' ' 221' ' ' ILE . 3.5 mp0 -54.2 -27.1 32.1 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.533 1.146 . . . . 64.25 110.333 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 219' ' ' GLN . . . . . 0.444 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 30.8 tp60 -82.29 -25.86 33.63 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.464 1.102 . . . . 71.209999999999994 110.269 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 220' ' ' THR . . . . . 0.444 ' O ' ' CG ' ' A' ' 224' ' ' GLU . 1.1 m -88.09 -20.32 25.86 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.53 1.144 . . . . 74.540000000000006 110.388 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 221' ' ' ILE . . . . . 0.636 HD11 HG22 ' A' ' 217' ' ' THR . 19.8 mt -82.12 -41.76 18.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.424 1.078 . . . . 72.120000000000005 109.27 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 222' ' ' TRP . . . . . 0.816 ' O ' HG22 ' A' ' 225' ' ' THR . 13.9 t90 -64.51 -55.86 17.9 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.507 1.13 . . . . 73.329999999999998 107.999 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.02 -18.64 25.48 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.46 1.1 . . . . 73.340000000000003 109.318 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 224' ' ' GLU . . . . . 0.444 ' CG ' ' O ' ' A' ' 220' ' ' THR . 3.0 mm-40 -90.0 -33.63 16.28 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.522 1.139 . . . . 72.349999999999994 110.304 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.816 HG22 ' O ' ' A' ' 222' ' ' TRP . 4.1 t -65.17 -21.72 66.81 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.568 1.167 . . . . 72.430000000000007 110.383 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 1.1 mtm105 -77.85 -19.21 55.27 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.503 1.127 . . . . 72.519999999999996 110.275 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 227' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -87.39 -38.63 16.0 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.39 1.057 . . . . 70.329999999999998 109.316 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 9.6 mtm -60.2 -38.69 84.1 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.487 1.117 . . . . 73.450000000000003 110.989 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 229' ' ' VAL . . . . . 0.444 HG23 ' N ' ' A' ' 230' ' ' GLN . 29.4 m -70.86 -48.55 56.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 O-C-N 124.501 1.126 . . . . 61.210000000000001 109.281 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 230' ' ' GLN . . . . . 0.444 ' N ' HG23 ' A' ' 229' ' ' VAL . 0.8 OUTLIER -74.2 -5.6 42.88 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.449 1.093 . . . . 63.439999999999998 110.301 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -90.04 -82.42 0.27 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.595 1.184 . . . . 75.140000000000001 110.223 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 3.7 tp60 -141.36 35.86 1.68 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.547 1.154 . . . . 74.209999999999994 110.32 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -149.19 42.37 0.93 Allowed 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.465 1.103 . . . . 50.119999999999997 110.963 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 7.6 mm -53.2 150.74 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 O-C-N 124.488 1.118 . . . . 62.329999999999998 109.267 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.484 0 O-C-N 124.499 1.125 . . . . 75.140000000000001 109.35 179.922 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.493 ' C ' ' HB1' ' A' ' 235' ' ' ALA . . . . . . . . 0 CA--C 1.53 0.997 0 N-CA-C 110.959 -0.857 . . . . 74.340000000000003 110.959 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 159.6 41.22 Favored 'Trans proline' 0 C--N 1.36 1.137 0 O-C-N 124.483 1.78 . . . . 74.230000000000004 111.001 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.534 HD13 ' N ' ' A' ' 73' ' ' GLY . 1.1 tm? -105.45 126.55 52.25 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.501 1.126 . . . . 64.010000000000005 109.314 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.534 ' N ' HD13 ' A' ' 72' ' ' LEU . . . 56.69 82.0 0.06 OUTLIER Glycine 0 CA--C 1.531 1.032 0 O-C-N 124.515 1.134 . . . . 64.409999999999997 111.019 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.4 p -109.43 171.44 7.44 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.57 0.806 . . . . 74.219999999999999 109.995 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 76' ' ' GLU . 31.5 tp10 -56.69 153.21 10.89 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.502 1.126 . . . . 61.030000000000001 110.302 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.404 ' N ' ' HG3' ' A' ' 75' ' ' GLU . 2.1 tt0 -136.06 127.84 29.18 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.48 1.112 . . . . 64.030000000000001 110.281 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.592 HG22 ' H ' ' A' ' 79' ' ' LEU . 6.5 p -124.88 149.38 29.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 O-C-N 124.507 1.13 . . . . 74.310000000000002 109.274 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.415 ' O ' ' C ' ' A' ' 79' ' ' LEU . 34.1 t80 -80.38 12.76 2.77 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.463 1.102 . . . . 74.540000000000006 111.016 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.592 ' H ' HG22 ' A' ' 77' ' ' VAL . 15.5 tp -39.19 157.58 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.531 1.144 . . . . 71.400000000000006 109.299 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.834 ' HZ3' ' HA ' ' A' ' 106' ' ' ILE . 5.0 ptpt -100.83 -45.81 5.33 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.515 1.134 . . . . 70.349999999999994 109.333 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.833 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.7 OUTLIER -167.78 129.1 1.46 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.46 1.1 . . . . 73.299999999999997 110.963 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.953 HG12 HG22 ' A' ' 135' ' ' THR . 9.3 p -84.51 174.33 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.506 1.129 . . . . 74.140000000000001 109.317 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.861 ' CG2' ' HB1' ' A' ' 93' ' ' ALA . 2.1 mp -129.32 95.1 2.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.419 1.075 . . . . 70.439999999999998 109.344 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.814 HD11 ' HB3' ' A' ' 128' ' ' ALA . 1.0 OUTLIER -74.21 93.73 2.37 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.479 1.112 . . . . 74.409999999999997 109.232 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.706 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -112.85 174.49 5.87 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.49 1.119 . . . . 73.439999999999998 109.643 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.86 ' HB2' ' CD1' ' A' ' 143' ' ' PHE . . . -110.75 148.35 32.51 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.472 1.107 . . . . 62.530000000000001 109.276 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -50.3 -21.8 1.54 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.562 1.164 . . . . 74.519999999999996 110.411 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -77.37 -46.26 23.36 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.47 1.106 . . . . 72.439999999999998 109.299 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.68 ' CB ' HD12 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -117.05 44.46 2.07 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.581 1.176 . . . . 75.109999999999999 109.288 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.609 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -76.79 -44.1 34.12 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.478 1.112 . . . . 72.120000000000005 110.366 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -63.14 -37.67 88.13 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.487 1.117 . . . . 51.32 109.339 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.446 ' O ' ' N ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -55.63 -69.38 0.14 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.428 1.08 . . . . 61.299999999999997 110.339 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 1.154 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -47.73 -36.75 11.89 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.496 1.122 . . . . 52.229999999999997 109.268 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.646 HD23 ' O ' ' A' ' 94' ' ' LEU . 0.6 OUTLIER -67.7 -36.18 80.18 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.466 1.104 . . . . 75.420000000000002 109.364 179.936 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.446 ' N ' ' O ' ' A' ' 92' ' ' GLU . 17.5 tpp85 -61.0 -47.84 84.58 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.448 1.093 . . . . 73.540000000000006 110.32 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.622 HG21 ' HE1' ' A' ' 173' ' ' MET . 0.3 OUTLIER -69.59 -52.83 28.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.595 1.185 . . . . 74.140000000000001 109.31 179.993 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.549 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -51.8 -17.77 1.05 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.612 1.195 . . . . 71.150000000000006 110.347 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.411 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.3 OUTLIER -81.83 -52.41 7.14 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.484 1.115 . . . . 74.209999999999994 109.27 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.827 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -68.16 -22.46 64.85 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.475 1.109 . . . . 74.430000000000007 109.328 -179.937 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.827 ' N ' HD23 ' A' ' 99' ' ' LEU . 32.8 mt -66.81 -48.36 69.19 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.46 1.1 . . . . 73.040000000000006 109.298 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -79.52 52.84 1.45 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.501 1.126 . . . . 72.420000000000002 110.323 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -175.97 -64.17 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.529 1.143 . . . . 62.409999999999997 109.263 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -46.01 -45.95 16.19 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.473 1.108 . . . . 63.210000000000001 109.283 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -116.47 -32.02 5.38 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.444 1.09 . . . . 70.519999999999996 111.01 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.404 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 108.15 37.9 2.07 Favored Glycine 0 CA--C 1.53 1.02 0 O-C-N 124.538 1.148 . . . . 73.439999999999998 111.015 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.834 ' HA ' ' HZ3' ' A' ' 80' ' ' LYS . 16.6 mm -78.56 74.87 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.516 0.774 . . . . 72.150000000000006 109.362 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.557 ' H ' ' NZ ' ' A' ' 80' ' ' LYS . 0.0 OUTLIER -126.92 155.99 74.76 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.516 1.135 . . . . 72.109999999999999 109.28 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.53 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.4 Cg_endo -74.94 161.22 95.27 Favored 'Cis proline' 0 C--N 1.36 1.152 0 C-N-CA 121.026 -2.489 . . . . 61.219999999999999 111.02 -0.031 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -117.6 119.3 4.38 Favored Glycine 0 CA--C 1.53 0.97 0 O-C-N 124.422 1.076 . . . . 61.450000000000003 111.036 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.402 HD11 ' C ' ' A' ' 114' ' ' GLU . 0.0 OUTLIER -138.95 128.59 31.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.469 0.746 . . . . 72.5 109.287 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.706 HD12 ' NE2' ' A' ' 85' ' ' HIS . 39.3 pt -89.28 174.4 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.456 1.097 . . . . 72.200000000000003 109.323 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.986 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 2.4 t80 -75.2 -18.65 60.1 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.418 1.074 . . . . 71.409999999999997 110.967 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.5 -3.11 53.53 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.493 1.121 . . . . 71.319999999999993 109.256 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.402 ' C ' HD11 ' A' ' 110' ' ' ILE . 23.5 mt-10 -107.65 -26.74 10.71 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.532 1.145 . . . . 71.129999999999995 110.281 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.455 ' HG3' ' CD2' ' A' ' 117' ' ' HIS . 35.6 tpp -41.72 110.77 0.81 Allowed Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.502 1.126 . . . . 74.25 111.011 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -74.92 115.35 4.26 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.479 1.779 . . . . 74.400000000000006 111.066 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.455 ' CD2' ' HG3' ' A' ' 115' ' ' MET . 12.2 m-70 -121.02 -176.34 3.25 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.511 1.132 . . . . 75.430000000000007 109.616 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -77.37 -146.86 2.56 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.526 1.141 . . . . 61.329999999999998 111.018 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 31.2 ttp85 -107.64 42.1 1.4 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.475 0.75 . . . . 74.109999999999999 110.276 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -122.79 158.91 29.19 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.528 1.143 . . . . 70.439999999999998 110.303 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -96.29 79.71 3.15 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.462 1.101 . . . . 72.209999999999994 109.587 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.618 ' C ' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -44.2 145.45 0.78 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.517 1.135 . . . . 74.239999999999995 109.322 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -132.13 11.04 4.6 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.494 1.121 . . . . 72.129999999999995 110.283 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -113.28 116.74 30.22 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.422 1.076 . . . . 71.019999999999996 109.351 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 1.04 HD11 HD11 ' A' ' 157' ' ' LEU . 3.6 pp -85.3 -17.25 37.44 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.567 1.167 . . . . 65.129999999999995 109.304 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -63.09 -14.3 46.7 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.566 1.166 . . . . 74.549999999999997 109.332 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.48 -48.79 65.7 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.438 1.087 . . . . 51.450000000000003 109.292 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.986 ' HB2' ' CE1' ' A' ' 112' ' ' PHE . . . -65.64 -22.71 66.67 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.499 1.124 . . . . 61.240000000000002 109.357 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.627 HG12 ' O ' ' A' ' 129' ' ' VAL . 70.9 t -86.6 10.04 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.517 1.136 . . . . 72.230000000000004 109.339 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -135.64 119.34 17.15 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 124.534 1.146 . . . . 75.219999999999999 109.302 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 91.76 47.98 3.29 Favored Glycine 0 CA--C 1.53 0.974 0 O-C-N 124.474 1.109 . . . . 51.420000000000002 111.033 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' SER . . . . . 0.51 ' OG ' HD23 ' A' ' 79' ' ' LEU . 3.2 m -163.35 171.14 16.5 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.496 0.762 . . . . 75.310000000000002 109.956 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.525 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -104.85 -27.35 11.79 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.535 1.147 . . . . 60.43 109.251 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.587 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 6.6 m-90 -158.82 157.83 32.34 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.536 1.148 . . . . 74.230000000000004 108.0 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.953 HG22 HG12 ' A' ' 82' ' ' VAL . 6.3 p -140.56 128.77 22.31 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.5 1.125 . . . . 61.340000000000003 110.412 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.54 HD13 ' HE2' ' A' ' 81' ' ' PHE . 1.4 mp -84.07 149.6 4.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 124.423 1.077 . . . . 71.230000000000004 109.321 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.678 HD11 HG13 ' A' ' 170' ' ' VAL . 47.6 mt -131.35 108.02 9.35 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.507 1.13 . . . . 74.010000000000005 109.356 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 1.154 HD21 ' HB2' ' A' ' 93' ' ' ALA . 1.4 mm? -62.35 93.25 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.502 1.126 . . . . 63.32 109.306 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.853 HD21 HG23 ' A' ' 185' ' ' THR . 6.3 tp -69.12 99.15 1.08 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.55 1.156 . . . . 73.140000000000001 109.334 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.427 ' O ' ' N ' ' A' ' 144' ' ' LEU . 2.5 m -127.05 162.68 25.47 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.568 1.167 . . . . 71.219999999999999 110.401 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -69.41 -29.95 67.81 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.5 1.125 . . . . 70.5 110.329 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -89.61 -25.06 21.49 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.457 1.098 . . . . 62.229999999999997 109.318 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.86 ' CD1' ' HB2' ' A' ' 86' ' ' ALA . 82.0 t80 -90.16 -19.8 23.82 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.472 1.107 . . . . 73.019999999999996 111.016 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.584 ' C ' HD13 ' A' ' 144' ' ' LEU . 2.7 tm? -53.62 -67.61 0.24 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.602 1.188 . . . . 75.430000000000007 109.292 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.49 ' N ' HD13 ' A' ' 144' ' ' LEU . 54.6 mmm-85 -57.98 -16.38 12.25 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.545 1.153 . . . . 61.43 110.273 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -77.47 -34.68 54.27 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.522 1.139 . . . . 52.100000000000001 109.336 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.855 HG21 ' CE2' ' A' ' 143' ' ' PHE . 2.1 p -102.87 -8.3 20.85 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.555 1.16 . . . . 73.329999999999998 110.406 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.424 ' HA ' ' CE3' ' A' ' 148' ' ' TRP . 0.3 OUTLIER -95.85 -25.35 16.05 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.077 -1.082 . . . . 62.229999999999997 108.077 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 16.8 t -92.53 -37.71 12.34 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.534 1.146 . . . . 71.340000000000003 108.275 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' ASN . . . . . 0.516 ' O ' ' CG ' ' A' ' 154' ' ' TYR . 68.7 m-20 -68.47 -49.65 58.25 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.52 1.137 . . . . 73.439999999999998 109.255 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.789 ' CD1' HD13 ' A' ' 157' ' ' LEU . 6.4 m-30 -60.88 -55.33 34.34 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.505 1.128 . . . . 63.210000000000001 111.007 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 30.3 tp60 -48.1 -47.74 34.16 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.517 1.136 . . . . 54.310000000000002 110.323 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -74.1 -20.3 60.31 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.495 1.122 . . . . 74.239999999999995 110.962 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.516 ' CG ' ' O ' ' A' ' 150' ' ' ASN . 15.8 m-30 -117.79 83.2 1.95 Allowed 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.49 1.119 . . . . 71.420000000000002 111.032 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.3 t -49.7 -22.84 1.49 Allowed 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.429 1.081 . . . . 73.25 110.364 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 11.3 p -62.03 -40.58 96.22 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.49 1.119 . . . . 65.340000000000003 109.992 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 1.04 HD11 HD11 ' A' ' 125' ' ' LEU . 6.4 mt -68.5 -47.41 67.07 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.441 1.088 . . . . 65.0 109.272 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 158' ' ' MET . . . . . 0.436 ' HE2' HG11 ' A' ' 161' ' ' VAL . 5.3 mmt -47.04 -33.04 4.45 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.512 1.133 . . . . 64.420000000000002 111.0 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -66.11 -44.76 83.36 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 124.496 1.122 . . . . 52.340000000000003 109.328 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.542 ' HB3' HG21 ' A' ' 170' ' ' VAL . 1.4 m -71.83 -28.76 63.79 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.542 1.151 . . . . 74.239999999999995 110.011 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 161' ' ' VAL . . . . . 0.649 ' CG2' ' CE2' ' A' ' 151' ' ' PHE . 3.5 t -56.84 -18.08 6.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.508 1.13 . . . . 73.25 109.318 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 162' ' ' ASN . . . . . 0.479 ' O ' ' N ' ' A' ' 164' ' ' GLN . 1.5 t-20 -90.61 20.97 4.24 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.491 1.12 . . . . 74.140000000000001 109.354 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.422 ' C ' ' O ' ' A' ' 162' ' ' ASN . 0.1 OUTLIER 36.43 31.79 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.492 1.12 . . . . 71.450000000000003 110.294 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 164' ' ' GLN . . . . . 0.479 ' N ' ' O ' ' A' ' 162' ' ' ASN . 81.4 mt-30 -38.34 132.03 1.12 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.471 1.107 . . . . 65.430000000000007 110.224 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.527 ' CG ' ' O ' ' A' ' 165' ' ' HIS . 5.4 p80 -69.47 72.2 0.32 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.513 1.133 . . . . 73.430000000000007 109.565 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.502 ' O ' ' NE2' ' A' ' 218' ' ' GLN . 0.5 OUTLIER -125.13 -178.7 4.28 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.467 1.104 . . . . 63.299999999999997 109.336 179.928 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 167' ' ' TYR . . . . . 0.467 ' CD1' ' HB2' ' A' ' 168' ' ' ASN . 37.8 p90 -49.82 -35.83 24.38 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.662 1.226 . . . . 73.0 111.029 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.467 ' HB2' ' CD1' ' A' ' 167' ' ' TYR . 2.9 t30 -117.12 129.41 55.95 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.52 1.138 . . . . 74.299999999999997 109.323 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.451 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 0.4 OUTLIER -119.87 155.59 32.37 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.436 1.085 . . . . 62.509999999999998 109.992 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.804 ' C ' HD12 ' A' ' 171' ' ' ILE . 18.5 t -118.82 122.06 68.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.437 1.086 . . . . 54.210000000000001 109.26 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.804 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -127.1 112.84 21.71 Favored Pre-proline 0 C--N 1.324 -0.522 0 O-C-N 124.503 1.127 . . . . 71.340000000000003 109.348 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 172' ' ' PRO . . . . . 0.719 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.96 106.6 2.3 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.518 1.799 . . . . 75.329999999999998 111.024 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 173' ' ' MET . . . . . 0.647 ' CE ' HD12 ' A' ' 195' ' ' LEU . 11.0 ttt -82.92 166.32 18.99 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.531 1.144 . . . . 74.329999999999998 110.943 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 174' ' ' ARG . . . . . 0.424 ' N ' ' HG2' ' A' ' 173' ' ' MET . 17.0 mmm-85 -131.21 126.47 21.47 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.485 1.115 . . . . 74.209999999999994 110.356 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 175' ' ' PRO . . . . . 0.489 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.4 Cg_endo -75.01 163.18 35.83 Favored 'Trans proline' 0 C--N 1.36 1.14 0 O-C-N 124.481 1.78 . . . . 73.439999999999998 110.984 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.921 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -94.85 -47.19 6.56 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.531 1.144 . . . . 73.540000000000006 109.289 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -71.27 -25.27 62.39 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.533 1.146 . . . . 63.350000000000001 109.365 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 178' ' ' ASN . . . . . 0.489 ' CB ' ' HG2' ' A' ' 175' ' ' PRO . 7.5 m-80 -109.39 100.95 43.78 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.551 1.157 . . . . 72.519999999999996 109.305 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.03 138.92 23.59 Favored 'Trans proline' 0 C--N 1.361 1.205 0 O-C-N 124.488 1.783 . . . . 72.310000000000002 111.037 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.436 ' HA ' HD22 ' A' ' 180' ' ' LEU . 0.4 OUTLIER -141.18 96.76 7.08 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.465 1.103 . . . . 73.430000000000007 109.314 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.95 166.31 29.51 Favored 'Trans proline' 0 C--N 1.361 1.22 0 O-C-N 124.51 1.795 . . . . 42.409999999999997 111.039 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 26.2 mtm105 -60.38 -26.72 66.86 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.467 1.104 . . . . 70.519999999999996 110.283 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -61.49 -18.74 60.42 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.514 1.134 . . . . 72.409999999999997 110.367 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -113.09 -0.59 14.66 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.508 1.13 . . . . 63.130000000000003 110.265 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 185' ' ' THR . . . . . 0.853 HG23 HD21 ' A' ' 139' ' ' LEU . 20.6 m -108.53 143.66 27.94 Favored Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.493 1.12 . . . . 53.149999999999999 110.368 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 186' ' ' PRO . . . . . 0.819 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.5 Cg_endo -74.95 155.78 43.18 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.428 1.751 . . . . 75.310000000000002 111.027 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 187' ' ' PHE . . . . . 0.502 ' O ' ' CG2' ' A' ' 191' ' ' THR . 49.3 p90 -69.45 -7.27 36.43 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.541 1.151 . . . . 73.120000000000005 111.024 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.81 -52.91 4.23 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.551 1.157 . . . . 45.43 109.305 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.819 HD12 ' CG ' ' A' ' 186' ' ' PRO . 44.6 mt -68.57 -42.3 78.49 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.515 1.134 . . . . 71.340000000000003 109.285 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 190' ' ' GLN . . . . . 0.426 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 6.9 pt20 -63.73 -11.09 23.26 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.551 1.157 . . . . 75.439999999999998 110.334 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 191' ' ' THR . . . . . 0.502 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 35.5 p -113.35 6.91 17.49 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.451 1.095 . . . . 61.329999999999998 110.383 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.476 ' CG2' ' N ' ' A' ' 193' ' ' ASN . 7.5 mt -103.79 162.2 4.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.465 1.103 . . . . 74.310000000000002 109.315 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 193' ' ' ASN . . . . . 0.476 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 30.8 p-10 -66.57 74.44 0.1 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.553 1.158 . . . . 75.109999999999999 109.251 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 194' ' ' ALA . . . . . 0.719 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -79.3 128.58 33.5 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.617 1.198 . . . . 61.030000000000001 109.298 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 195' ' ' LEU . . . . . 0.647 HD12 ' CE ' ' A' ' 173' ' ' MET . 0.3 OUTLIER -68.47 124.8 24.56 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.45 1.094 . . . . 51.340000000000003 109.241 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -109.18 111.18 22.65 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.468 1.105 . . . . 72.319999999999993 110.379 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.921 ' HG3' HD21 ' A' ' 176' ' ' LEU . 35.6 tp10 -87.7 -22.45 24.63 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.547 1.154 . . . . 75.310000000000002 110.278 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 198' ' ' GLU . . . . . 0.482 ' HB3' HD12 ' A' ' 176' ' ' LEU . 7.3 pt-20 -95.08 22.86 6.16 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.451 1.095 . . . . 74.439999999999998 110.275 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 4.0 t -127.58 143.91 51.12 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.548 1.155 . . . . 74.129999999999995 109.936 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 55.1 mtt180 -58.79 -20.93 54.38 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.537 1.148 . . . . 71.230000000000004 110.29 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -88.77 11.53 68.46 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.517 1.136 . . . . 54.329999999999998 110.97 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 202' ' ' PHE . . . . . 0.848 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.1 OUTLIER -53.45 -45.19 98.64 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.531 0.783 . . . . 71.420000000000002 110.976 179.967 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 203' ' ' PRO . . . . . 0.594 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.07 -37.89 1.8 Allowed 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.518 1.799 . . . . 70.400000000000006 110.944 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.49 -49.54 72.28 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.506 1.129 . . . . 44.130000000000003 110.367 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -68.86 -41.35 78.53 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.51 1.131 . . . . 74.219999999999999 110.314 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 206' ' ' VAL . . . . . 0.848 HG23 ' O ' ' A' ' 202' ' ' PHE . 69.3 t -64.64 -27.37 42.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.476 1.11 . . . . 75.030000000000001 109.283 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -80.64 -51.1 9.1 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.45 1.094 . . . . 72.439999999999998 110.349 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 87.6 mtt-85 -64.43 -62.31 1.68 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.461 1.101 . . . . 73.430000000000007 110.278 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 209' ' ' ILE . . . . . 0.815 HG22 ' CE1' ' A' ' 210' ' ' PHE . 90.9 mt -46.87 -44.75 7.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.454 1.096 . . . . 75.109999999999999 109.286 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 210' ' ' PHE . . . . . 0.815 ' CE1' HG22 ' A' ' 209' ' ' ILE . 1.3 m-85 -111.92 67.82 0.66 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.521 1.138 . . . . 74.420000000000002 111.066 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 211' ' ' GLN . . . . . 0.528 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.1 OUTLIER -110.7 143.61 40.92 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.508 1.13 . . . . 62.049999999999997 110.267 -179.937 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.456 ' O ' ' N ' ' A' ' 215' ' ' TYR . 23.8 tt0 -49.58 -54.66 16.95 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.403 1.064 . . . . 70.120000000000005 110.273 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.89 -24.29 0.98 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.571 1.169 . . . . 72.120000000000005 110.005 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.528 HG23 ' HG2' ' A' ' 211' ' ' GLN . 40.0 t -96.15 -29.71 3.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.489 1.118 . . . . 71.310000000000002 109.294 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 215' ' ' TYR . . . . . 0.456 ' N ' ' O ' ' A' ' 212' ' ' GLU . 6.3 t80 -64.5 -34.08 77.38 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.477 1.111 . . . . 72.519999999999996 111.006 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp -55.59 -59.88 4.21 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 71.010000000000005 109.326 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 217' ' ' THR . . . . . 1.058 HG22 HD11 ' A' ' 221' ' ' ILE . 99.2 m -58.43 -66.45 0.49 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.523 1.139 . . . . 70.420000000000002 110.386 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 218' ' ' GLN . . . . . 0.821 ' HA ' HD12 ' A' ' 221' ' ' ILE . 13.9 mm100 -39.44 -40.48 0.83 Allowed 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.527 1.142 . . . . 71.420000000000002 110.313 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 219' ' ' GLN . . . . . 0.449 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 16.9 tp60 -65.96 -46.66 77.32 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.441 1.088 . . . . 70.430000000000007 110.254 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 220' ' ' THR . . . . . 0.456 ' N ' ' O ' ' A' ' 217' ' ' THR . 1.3 m -68.04 -23.1 64.94 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.506 1.129 . . . . 63.299999999999997 110.435 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 221' ' ' ILE . . . . . 1.058 HD11 HG22 ' A' ' 217' ' ' THR . 17.1 mt -78.6 -32.5 16.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 O-C-N 124.508 1.13 . . . . 75.510000000000005 109.33 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 222' ' ' TRP . . . . . 0.973 ' O ' HG22 ' A' ' 225' ' ' THR . 26.5 t90 -71.13 -50.59 31.94 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.539 1.15 . . . . 63.219999999999999 108.038 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.95 -18.04 63.85 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.425 1.078 . . . . 62.149999999999999 109.285 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -92.63 -28.1 16.91 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.47 1.106 . . . . 75.340000000000003 110.28 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.973 HG22 ' O ' ' A' ' 222' ' ' TRP . 6.2 t -62.87 -20.38 65.06 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.453 1.095 . . . . 32.149999999999999 110.362 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 1.8 mtm180 -77.8 -16.46 58.34 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.514 1.134 . . . . 72.239999999999995 110.343 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 227' ' ' ASN . . . . . 0.448 ' O ' ' N ' ' A' ' 231' ' ' ARG . 2.2 m120 -87.15 -41.37 13.82 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.496 1.123 . . . . 72.439999999999998 109.266 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 8.8 mtt -58.81 -41.06 85.92 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.528 1.142 . . . . 75.219999999999999 111.009 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 229' ' ' VAL . . . . . 0.46 HG13 ' N ' ' A' ' 230' ' ' GLN . 8.3 p -67.19 -48.72 77.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.486 1.116 . . . . 72.219999999999999 109.316 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 230' ' ' GLN . . . . . 0.46 ' N ' HG13 ' A' ' 229' ' ' VAL . 2.6 tp60 -77.54 -2.67 36.78 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.464 1.102 . . . . 73.099999999999994 110.305 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 231' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 227' ' ' ASN . 10.4 tpt180 -92.04 -75.02 0.49 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.535 1.147 . . . . 55.130000000000003 110.324 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -149.54 39.78 0.82 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.477 1.11 . . . . 70.5 110.274 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 233' ' ' PHE . . . . . 0.407 ' O ' HG23 ' A' ' 229' ' ' VAL . 0.1 OUTLIER -151.22 39.15 0.66 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 63.43 110.938 179.964 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.465 HD12 ' H ' ' A' ' 234' ' ' ILE . 2.0 mp -42.16 161.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 O-C-N 124.527 1.142 . . . . 70.409999999999997 109.288 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 235' ' ' ALA . . . . . 0.493 ' HB1' ' C ' ' A' ' 70' ' ' GLY . . . . . . . . 0 C--N 1.325 -0.473 0 O-C-N 124.453 1.096 . . . . 62.039999999999999 109.317 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.975 0 N-CA-C 111.018 -0.833 . . . . 62.009999999999998 111.018 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.02 177.04 9.13 Favored 'Trans proline' 0 C--N 1.36 1.175 0 O-C-N 124.442 1.759 . . . . 71.439999999999998 111.03 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.53 138.73 41.72 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.483 1.114 . . . . 73.430000000000007 109.297 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 37.9 58.47 1.51 Allowed Glycine 0 CA--C 1.53 1.027 0 O-C-N 124.477 1.11 . . . . 63.200000000000003 110.956 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.32 169.56 13.59 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.53 0.782 . . . . 72.25 109.992 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 76' ' ' GLU . 16.8 tp10 -88.48 163.44 15.93 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.537 1.148 . . . . 75.019999999999996 110.288 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.409 ' N ' ' HG3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -131.64 143.87 50.63 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.496 1.123 . . . . 64.099999999999994 110.277 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.41 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 5.8 p -174.65 159.2 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.47 1.106 . . . . 61.310000000000002 109.329 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.404 ' O ' ' C ' ' A' ' 79' ' ' LEU . 55.1 p90 -88.56 24.37 1.99 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.436 1.085 . . . . 74.230000000000004 110.966 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.404 ' C ' ' O ' ' A' ' 78' ' ' PHE . 6.6 tp -40.14 152.77 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.463 1.102 . . . . 74.340000000000003 109.27 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.54 ' HD3' HG23 ' A' ' 106' ' ' ILE . 6.4 ttmt -92.43 -60.29 1.87 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.522 1.139 . . . . 71.219999999999999 109.281 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.557 ' CE1' HD11 ' A' ' 83' ' ' ILE . 0.4 OUTLIER -162.14 138.69 7.95 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.532 1.145 . . . . 72.540000000000006 110.969 179.996 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.628 HG11 ' O ' ' A' ' 128' ' ' ALA . 2.8 p -89.63 160.23 2.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 O-C-N 124.567 1.167 . . . . 73.319999999999993 109.347 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.557 HD11 ' CE1' ' A' ' 81' ' ' PHE . 4.3 mp -118.13 92.46 2.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.499 1.124 . . . . 73.239999999999995 109.33 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.611 HD13 HD12 ' A' ' 125' ' ' LEU . 6.1 mt -70.18 118.73 13.38 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.54 1.15 . . . . 73.25 109.291 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.64 ' HE1' HD12 ' A' ' 111' ' ' ILE . 0.8 OUTLIER -143.89 174.53 10.75 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.463 1.102 . . . . 73.219999999999999 109.574 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -110.85 152.1 27.07 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.463 1.102 . . . . 73.219999999999999 109.273 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.09 -18.34 5.33 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.439 1.087 . . . . 70.409999999999997 110.277 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -69.97 -46.35 65.42 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.586 1.179 . . . . 65.239999999999995 109.225 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.435 ' CG ' ' ND2' ' A' ' 178' ' ' ASN . 2.5 m-20 -130.16 43.76 3.07 Favored 'General case' 0 C--N 1.323 -0.557 0 O-C-N 124.497 1.123 . . . . 73.030000000000001 109.319 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.635 HG23 ' CE1' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -73.91 -20.85 60.27 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.54 1.15 . . . . 72.310000000000002 110.412 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -81.44 -39.13 25.34 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.568 1.167 . . . . 71.409999999999997 109.301 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -59.86 -50.46 73.7 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 124.535 1.147 . . . . 71.109999999999999 110.261 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 1.053 ' HB2' ' CD2' ' A' ' 138' ' ' LEU . . . -59.93 -35.09 74.17 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.446 1.091 . . . . 61.420000000000002 109.286 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.997 ' HB2' HD13 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -68.66 -44.62 73.72 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.518 1.136 . . . . 64.25 109.306 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.705 ' N ' HD13 ' A' ' 94' ' ' LEU . 8.8 tpt180 -48.94 -31.57 7.56 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.58 1.175 . . . . 62.310000000000002 110.261 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.823 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.1 t -78.64 -65.26 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.557 1.16 . . . . 61.310000000000002 109.288 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.761 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -40.3 -27.35 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.486 1.117 . . . . 75.129999999999995 110.315 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.455 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.1 OUTLIER -71.75 -60.48 2.21 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.475 1.11 . . . . 73.040000000000006 109.288 179.979 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.852 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -61.6 -22.55 65.32 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.542 1.151 . . . . 74.219999999999999 109.339 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.852 ' N ' HD23 ' A' ' 99' ' ' LEU . 26.7 mt -65.59 -50.81 63.73 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.492 1.12 . . . . 74.230000000000004 109.277 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -76.97 55.69 1.14 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.469 1.105 . . . . 71.510000000000005 110.311 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.0 t70 179.71 -63.29 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.489 1.118 . . . . 73.140000000000001 109.299 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.559 ' HB3' ' CD1' ' A' ' 104' ' ' PHE . 64.0 t0 -43.99 -53.71 6.03 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.488 1.117 . . . . 75.319999999999993 109.292 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.683 ' CE1' HG11 ' A' ' 206' ' ' VAL . 0.3 OUTLIER -113.43 -23.87 9.61 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.496 1.123 . . . . 64.120000000000005 111.014 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.98 37.68 4.33 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.509 1.131 . . . . 50.25 111.036 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.54 HG23 ' HD3' ' A' ' 80' ' ' LYS . 8.1 mm -81.97 81.14 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.436 0.727 . . . . 75.129999999999995 109.362 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.516 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -128.21 156.76 76.06 Favored Pre-proline 0 C--N 1.325 -0.459 0 O-C-N 124.537 1.148 . . . . 65.239999999999995 109.276 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.516 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.93 152.89 98.8 Favored 'Cis proline' 0 C--N 1.36 1.141 0 C-N-CA 121.052 -2.479 . . . . 74.140000000000001 111.015 -0.062 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.436 ' O ' ' NE2' ' A' ' 97' ' ' GLN . . . -119.28 110.86 1.95 Allowed Glycine 0 CA--C 1.531 1.043 0 O-C-N 124.513 1.133 . . . . 62.329999999999998 111.018 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.445 ' CD1' ' HA ' ' A' ' 115' ' ' MET . 0.3 OUTLIER -129.02 144.68 37.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.54 0.788 . . . . 72.239999999999995 109.32 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.997 HD13 ' HB2' ' A' ' 94' ' ' LEU . 20.7 pt -97.16 -177.3 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.499 1.124 . . . . 71.329999999999998 109.275 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.509 ' CD1' ' SD ' ' A' ' 115' ' ' MET . 2.2 t80 -81.77 -18.85 42.73 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.464 1.103 . . . . 62.119999999999997 110.964 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -96.44 -2.55 45.2 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.479 1.112 . . . . 73.129999999999995 109.312 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.595 ' HG2' HD11 ' A' ' 111' ' ' ILE . 67.1 mm-40 -110.44 -26.69 9.39 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.465 1.103 . . . . 73.530000000000001 110.328 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.509 ' SD ' ' CD1' ' A' ' 112' ' ' PHE . 1.2 ptp -70.02 135.03 87.4 Favored Pre-proline 0 C--N 1.325 -0.462 0 O-C-N 124.534 1.146 . . . . 50.450000000000003 111.016 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.93 122.04 6.99 Favored 'Trans proline' 0 C--N 1.36 1.163 0 O-C-N 124.51 1.795 . . . . 53.450000000000003 111.004 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -90.73 159.9 16.1 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.495 1.122 . . . . 70.200000000000003 109.591 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -101.73 -9.58 42.93 Favored Glycine 0 CA--C 1.531 1.06 0 O-C-N 124.566 1.167 . . . . 53.420000000000002 110.954 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 22.4 mtp85 -138.26 147.77 44.0 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.526 0.78 . . . . 75.540000000000006 110.314 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -49.56 -42.07 43.28 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.531 1.144 . . . . 72.230000000000004 110.255 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -93.69 138.62 31.71 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.528 1.143 . . . . 73.409999999999997 109.624 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.718 HD13 ' N ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -127.77 36.18 4.38 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.465 1.103 . . . . 71.230000000000004 109.282 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -63.29 -16.03 59.07 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.478 1.111 . . . . 73.230000000000004 110.324 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -86.48 106.48 17.51 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.507 1.129 . . . . 73.549999999999997 109.338 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.643 HD22 ' CG ' ' A' ' 150' ' ' ASN . 1.0 OUTLIER -83.9 -17.36 41.02 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.489 1.118 . . . . 65.030000000000001 109.296 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.407 ' O ' ' N ' ' A' ' 129' ' ' VAL . 10.9 t70 -49.69 -37.49 29.05 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.47 1.106 . . . . 74.209999999999994 109.26 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -50.88 -41.31 58.14 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.551 1.157 . . . . 74.099999999999994 109.335 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.628 ' O ' HG11 ' A' ' 82' ' ' VAL . . . -69.99 -26.44 64.08 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.493 1.12 . . . . 74.420000000000002 109.246 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.662 HG12 ' O ' ' A' ' 129' ' ' VAL . 63.1 t -89.11 14.38 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.509 1.131 . . . . 64.239999999999995 109.281 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -111.55 140.06 46.47 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.464 1.102 . . . . 75.219999999999999 109.272 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' GLY . . . . . 0.484 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 39.29 77.78 0.06 OUTLIER Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.485 1.116 . . . . 23.550000000000001 110.98 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -163.48 167.02 22.04 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.475 0.75 . . . . 75.219999999999999 110.017 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.76 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -95.67 -36.0 11.38 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.549 1.156 . . . . 71.430000000000007 109.285 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.76 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.1 m-90 -161.57 170.13 20.42 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.505 1.128 . . . . 74.319999999999993 108.039 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 56.2 p -138.78 138.19 37.37 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.573 1.171 . . . . 63.030000000000001 110.41 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.744 ' O ' HD22 ' A' ' 137' ' ' LEU . 39.2 mm -84.35 140.97 15.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.491 1.119 . . . . 63.549999999999997 109.28 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.744 HD22 ' O ' ' A' ' 136' ' ' ILE . 3.3 mm? -128.61 86.97 2.51 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.509 1.131 . . . . 53.530000000000001 109.323 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 1.053 ' CD2' ' HB2' ' A' ' 93' ' ' ALA . 0.3 OUTLIER -62.74 88.06 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.48 1.112 . . . . 74.530000000000001 109.306 -179.99 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.709 HD22 ' O ' ' A' ' 137' ' ' LEU . 0.6 OUTLIER -61.81 116.64 4.99 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.503 1.127 . . . . 64.019999999999996 109.246 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.628 HG23 ' OD1' ' A' ' 178' ' ' ASN . 7.4 m -136.41 169.69 17.26 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.491 1.12 . . . . 71.530000000000001 110.381 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -64.25 -39.74 94.58 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.559 1.162 . . . . 75.519999999999996 110.275 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ASN . . . . . 0.441 ' CG ' ' N ' ' A' ' 143' ' ' PHE . 7.9 p30 -89.54 -46.74 8.46 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.45 1.094 . . . . 73.329999999999998 109.279 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.783 ' CE1' HG21 ' A' ' 147' ' ' THR . 7.1 t80 -53.07 -25.94 14.47 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.481 1.113 . . . . 64.129999999999995 110.951 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.705 ' C ' HD13 ' A' ' 144' ' ' LEU . 1.8 tm? -54.46 -68.11 0.21 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.54 1.15 . . . . 75.349999999999994 109.319 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.459 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 28.5 mmm180 -65.94 -14.33 61.38 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.415 1.072 . . . . 61.409999999999997 110.313 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -70.69 -51.87 24.82 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.511 1.132 . . . . 74.230000000000004 109.349 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.783 HG21 ' CE1' ' A' ' 143' ' ' PHE . 4.3 p -92.75 -52.99 4.35 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.513 1.133 . . . . 74.310000000000002 110.422 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.568 ' CH2' ' HB2' ' A' ' 186' ' ' PRO . 20.5 t-105 -41.87 -47.4 4.22 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.565 1.165 . . . . 71.25 107.977 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 149' ' ' CYS . . . . . 0.459 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 7.4 t -69.85 -44.54 69.66 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.436 1.085 . . . . 52.240000000000002 108.322 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 150' ' ' ASN . . . . . 0.643 ' CG ' HD22 ' A' ' 125' ' ' LEU . 34.2 t-20 -51.7 -29.52 18.63 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.465 1.103 . . . . 73.349999999999994 109.302 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.564 ' CD1' ' HG ' ' A' ' 157' ' ' LEU . 8.2 m-30 -77.6 -44.94 26.73 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.472 1.108 . . . . 75.319999999999993 111.005 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 42.2 tp60 -41.46 -39.73 1.59 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.437 1.086 . . . . 74.150000000000006 110.256 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -80.78 -34.3 34.27 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.453 1.096 . . . . 74.420000000000002 110.959 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.441 ' N ' ' O ' ' A' ' 151' ' ' PHE . 3.3 m-85 -117.05 87.52 2.72 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.558 1.161 . . . . 75.230000000000004 111.015 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 2.3 t -60.14 -25.17 65.3 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.451 1.095 . . . . 63.100000000000001 110.368 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 54.7 p -58.57 -16.88 17.62 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 124.527 1.142 . . . . 63.32 109.998 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.564 ' HG ' ' CD1' ' A' ' 151' ' ' PHE . 0.2 OUTLIER -75.85 -51.73 11.91 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.451 1.094 . . . . 73.519999999999996 109.316 -179.97 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 158' ' ' MET . . . . . 0.487 ' CE ' HG21 ' A' ' 161' ' ' VAL . 5.6 mmt -50.04 -32.99 16.79 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.436 1.085 . . . . 63.420000000000002 110.962 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -64.16 -38.6 91.63 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.524 1.14 . . . . 74.450000000000003 109.312 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.663 ' HB2' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -66.19 -33.1 75.0 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.555 1.159 . . . . 73.430000000000007 109.948 -179.962 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 161' ' ' VAL . . . . . 0.859 ' O ' HD13 ' A' ' 192' ' ' ILE . 48.3 t -59.09 -18.16 13.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.425 1.078 . . . . 61.409999999999997 109.358 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 30.8 m-20 -77.95 -27.71 49.35 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.46 1.1 . . . . 64.109999999999999 109.308 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.559 ' HE ' HD11 ' A' ' 171' ' ' ILE . 21.3 mtp180 68.78 29.06 5.3 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.464 1.102 . . . . 71.140000000000001 110.253 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 164' ' ' GLN . . . . . 0.404 ' O ' ' O ' ' A' ' 163' ' ' ARG . 21.3 mt-30 -50.75 -177.84 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.527 1.142 . . . . 72.230000000000004 110.315 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -78.93 70.64 5.3 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.577 1.173 . . . . 75.310000000000002 109.567 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.681 ' HA ' HG21 ' A' ' 221' ' ' ILE . 0.1 OUTLIER -123.92 177.47 5.75 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.496 1.122 . . . . 74.219999999999999 109.353 179.974 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 167' ' ' TYR . . . . . . . . . . . . . 49.9 p90 -90.02 29.85 1.16 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.489 1.118 . . . . 75.219999999999999 110.957 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.467 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 3.5 p30 -169.56 108.8 0.42 Allowed 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.435 1.085 . . . . 70.239999999999995 109.29 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.474 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 6.3 m -102.04 164.04 11.92 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.436 1.085 . . . . 73.420000000000002 110.003 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.838 ' O ' HD12 ' A' ' 171' ' ' ILE . 76.0 t -130.5 125.03 58.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 124.459 1.099 . . . . 53.32 109.273 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.838 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.5 mp -131.48 113.75 15.61 Favored Pre-proline 0 C--N 1.326 -0.445 0 O-C-N 124.475 1.109 . . . . 61.039999999999999 109.237 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 172' ' ' PRO . . . . . 0.664 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.04 111.72 3.39 Favored 'Trans proline' 0 C--N 1.36 1.139 0 O-C-N 124.539 1.81 . . . . 64.430000000000007 110.975 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 173' ' ' MET . . . . . 0.823 ' HE1' HG21 ' A' ' 96' ' ' VAL . 4.5 ttt -92.74 152.08 19.69 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.531 1.144 . . . . 72.019999999999996 111.004 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 174' ' ' ARG . . . . . 0.421 ' N ' ' HG2' ' A' ' 173' ' ' MET . 21.2 mtp180 -110.85 116.66 51.7 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.546 1.154 . . . . 74.510000000000005 110.239 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 175' ' ' PRO . . . . . 0.419 ' C ' HD23 ' A' ' 176' ' ' LEU . 18.3 Cg_endo -75.01 164.61 33.01 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.474 1.776 . . . . 74.439999999999998 111.006 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.879 HD22 ' HB3' ' A' ' 198' ' ' GLU . 0.1 OUTLIER -104.02 -44.4 5.02 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.597 1.186 . . . . 72.200000000000003 109.264 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -72.13 -20.81 61.56 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.409 1.068 . . . . 73.25 109.266 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 178' ' ' ASN . . . . . 0.628 ' OD1' HG23 ' A' ' 140' ' ' THR . 0.6 OUTLIER -110.2 107.49 58.64 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.539 1.149 . . . . 71.409999999999997 109.293 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 118.12 5.15 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.549 1.815 . . . . 72.439999999999998 111.041 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.576 HD13 ' HB2' ' A' ' 184' ' ' ARG . 1.1 tm? -140.42 96.56 7.78 Favored Pre-proline 0 C--N 1.325 -0.475 0 O-C-N 124.505 1.128 . . . . 73.430000000000007 109.28 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.95 168.23 25.3 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.47 1.774 . . . . 72.219999999999999 111.025 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -56.48 -27.69 57.7 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.435 1.084 . . . . 72.129999999999995 110.302 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -61.35 -26.56 67.9 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 124.474 1.109 . . . . 64.400000000000006 110.262 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 184' ' ' ARG . . . . . 0.576 ' HB2' HD13 ' A' ' 180' ' ' LEU . 69.0 mmt-85 -96.4 -24.51 16.1 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.455 1.097 . . . . 60.140000000000001 110.288 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 185' ' ' THR . . . . . 0.507 HG22 ' HD2' ' A' ' 186' ' ' PRO . 18.9 m -74.77 143.94 79.25 Favored Pre-proline 0 C--N 1.325 -0.468 0 O-C-N 124.436 1.085 . . . . 72.129999999999995 110.396 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 186' ' ' PRO . . . . . 0.743 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -74.94 155.41 43.21 Favored 'Trans proline' 0 C--N 1.36 1.142 0 O-C-N 124.476 1.777 . . . . 75.129999999999995 110.983 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 187' ' ' PHE . . . . . 0.498 ' O ' ' CG2' ' A' ' 191' ' ' THR . 17.1 p90 -69.76 -6.89 35.15 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.461 1.101 . . . . 75.310000000000002 111.035 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 188' ' ' ALA . . . . . 0.544 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -94.37 -52.96 4.11 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.491 1.12 . . . . 75.430000000000007 109.289 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.743 HD12 ' CG ' ' A' ' 186' ' ' PRO . 51.5 mt -68.45 -42.08 79.31 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.378 1.049 . . . . 74.120000000000005 109.268 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 190' ' ' GLN . . . . . 0.416 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 7.1 pt20 -64.48 -10.09 23.03 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.485 1.116 . . . . 73.230000000000004 110.327 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 191' ' ' THR . . . . . 0.498 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 39.9 p -115.08 11.12 16.32 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.545 1.153 . . . . 64.150000000000006 110.343 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.859 HD13 ' O ' ' A' ' 161' ' ' VAL . 4.0 mt -125.46 148.82 29.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.457 1.098 . . . . 74.209999999999994 109.255 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 193' ' ' ASN . . . . . 0.663 ' OD1' HD11 ' A' ' 209' ' ' ILE . 54.5 t-20 -47.55 102.64 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.392 1.058 . . . . 60.439999999999998 109.254 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 194' ' ' ALA . . . . . 0.664 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -99.54 129.84 45.74 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.499 1.124 . . . . 65.409999999999997 109.327 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 195' ' ' LEU . . . . . 0.83 HD23 HD12 ' A' ' 209' ' ' ILE . 0.6 OUTLIER -66.58 136.9 56.3 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.49 1.119 . . . . 73.450000000000003 109.316 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 196' ' ' GLU . . . . . 0.448 ' CB ' ' HB3' ' A' ' 199' ' ' SER . 31.3 mt-10 -114.93 131.48 56.87 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.463 1.102 . . . . 73.109999999999999 110.325 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.751 ' HG2' HD11 ' A' ' 176' ' ' LEU . 3.4 tt0 -109.47 -23.19 11.64 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.492 1.12 . . . . 61.409999999999997 110.321 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 198' ' ' GLU . . . . . 0.879 ' HB3' HD22 ' A' ' 176' ' ' LEU . 0.0 OUTLIER -107.09 8.44 30.22 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.483 1.115 . . . . 72.150000000000006 110.269 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 199' ' ' SER . . . . . 0.448 ' HB3' ' CB ' ' A' ' 196' ' ' GLU . 28.6 t -99.91 163.49 12.43 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.545 1.153 . . . . 75.040000000000006 109.982 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 200' ' ' ARG . . . . . 0.431 ' NE ' ' HA ' ' A' ' 200' ' ' ARG . 5.8 tpm_? -75.81 -20.83 57.88 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.477 1.111 . . . . 74.019999999999996 110.301 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -99.88 26.26 25.12 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.53 1.143 . . . . 70.409999999999997 111.045 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 202' ' ' PHE . . . . . 0.81 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.2 OUTLIER -60.87 -43.9 93.08 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.483 0.755 . . . . 71.010000000000005 110.983 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 203' ' ' PRO . . . . . 0.616 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -74.96 -37.89 1.85 Allowed 'Trans proline' 0 C--N 1.361 1.19 0 O-C-N 124.447 1.761 . . . . 61.509999999999998 110.944 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.04 -57.99 9.47 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.558 1.161 . . . . 65.420000000000002 110.431 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -59.57 -45.64 91.25 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.45 1.094 . . . . 74.310000000000002 110.293 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 206' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 202' ' ' PHE . 55.0 t -56.48 -33.8 39.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 O-C-N 124.477 1.11 . . . . 74.430000000000007 109.269 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -73.57 -60.0 2.45 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.496 1.123 . . . . 64.5 110.241 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 80.5 mtt-85 -56.06 -63.38 1.2 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.538 1.149 . . . . 74.150000000000006 110.332 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 209' ' ' ILE . . . . . 0.83 HD12 HD23 ' A' ' 195' ' ' LEU . 25.7 mt -46.45 -62.46 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.554 1.159 . . . . 72.209999999999994 109.339 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 210' ' ' PHE . . . . . 0.781 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.8 m-85 -97.09 68.8 2.29 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.502 1.126 . . . . 73.239999999999995 111.034 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 211' ' ' GLN . . . . . 0.553 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -110.79 144.52 39.65 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.497 1.123 . . . . 74.109999999999999 110.299 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 215' ' ' TYR . 39.6 tt0 -49.21 -55.16 13.41 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.479 1.112 . . . . 64.420000000000002 110.355 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.26 -23.96 1.04 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.452 1.095 . . . . 33.310000000000002 110.005 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.553 HG23 ' HG2' ' A' ' 211' ' ' GLN . 40.6 t -96.25 -29.19 3.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.412 1.07 . . . . 63.520000000000003 109.237 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 215' ' ' TYR . . . . . 0.45 ' N ' ' O ' ' A' ' 212' ' ' GLU . 5.8 t80 -62.98 -32.42 73.76 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.469 1.106 . . . . 73.310000000000002 110.966 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 45.6 mmtt -63.33 -46.95 84.24 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.51 1.131 . . . . 74.409999999999997 109.27 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 217' ' ' THR . . . . . 0.902 HG22 HD11 ' A' ' 221' ' ' ILE . 87.9 m -53.49 -66.45 0.39 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.457 1.098 . . . . 63.140000000000001 110.372 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 218' ' ' GLN . . . . . 0.501 ' HA ' HD12 ' A' ' 221' ' ' ILE . 12.5 mp0 -55.5 -18.54 7.43 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.451 1.094 . . . . 74.420000000000002 110.23 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -84.62 -33.31 23.33 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 124.471 1.107 . . . . 75.209999999999994 110.28 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 220' ' ' THR . . . . . 0.461 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 3.0 m -82.42 -28.93 31.06 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.508 1.13 . . . . 43.310000000000002 110.458 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 221' ' ' ILE . . . . . 0.902 HD11 HG22 ' A' ' 217' ' ' THR . 8.9 mt -75.07 -34.67 32.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.462 1.101 . . . . 53.119999999999997 109.323 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 222' ' ' TRP . . . . . 0.81 ' O ' HG22 ' A' ' 225' ' ' THR . 35.8 t90 -71.51 -57.84 4.05 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.492 1.12 . . . . 72.319999999999993 107.985 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 223' ' ' LYS . . . . . 0.461 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -52.74 -24.09 8.06 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.522 1.139 . . . . 74.209999999999994 109.239 179.989 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -88.16 -32.9 18.4 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.501 1.126 . . . . 62.119999999999997 110.373 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.81 HG22 ' O ' ' A' ' 222' ' ' TRP . 2.4 t -61.01 -19.43 61.32 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.48 1.113 . . . . 43.200000000000003 110.407 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -77.87 -16.77 58.01 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.455 1.097 . . . . 73.400000000000006 110.214 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 227' ' ' ASN . . . . . 0.407 ' O ' ' N ' ' A' ' 231' ' ' ARG . 2.4 m120 -86.81 -41.33 14.15 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.464 1.102 . . . . 74.329999999999998 109.239 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 52.7 mtm -58.26 -39.47 79.27 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.579 1.175 . . . . 63.200000000000003 111.027 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 229' ' ' VAL . . . . . 0.457 HG13 ' N ' ' A' ' 230' ' ' GLN . 13.4 p -68.81 -48.86 68.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.538 1.149 . . . . 71.530000000000001 109.295 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 230' ' ' GLN . . . . . 0.457 ' N ' HG13 ' A' ' 229' ' ' VAL . 0.0 OUTLIER -76.88 -1.27 27.6 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.448 1.092 . . . . 70.510000000000005 110.256 -179.942 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 231' ' ' ARG . . . . . 0.407 ' N ' ' O ' ' A' ' 227' ' ' ASN . 12.9 tpp180 -95.06 -77.56 0.47 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.476 1.11 . . . . 63.299999999999997 110.262 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -146.72 43.48 1.17 Allowed 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.444 1.09 . . . . 74.150000000000006 110.323 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -155.0 34.93 0.39 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.403 1.064 . . . . 71.439999999999998 110.953 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 58.8 mt -52.6 153.01 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.469 1.106 . . . . 64.109999999999999 109.289 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.499 0 O-C-N 124.491 1.119 . . . . 52.240000000000002 109.314 179.993 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.992 0 N-CA-C 110.967 -0.853 . . . . 62.420000000000002 110.967 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.89 169.41 22.66 Favored 'Trans proline' 0 C--N 1.36 1.175 0 O-C-N 124.48 1.779 . . . . 44.200000000000003 111.039 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.564 HD22 ' HB1' ' A' ' 235' ' ' ALA . 0.2 OUTLIER -73.19 -59.93 2.48 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.59 1.181 . . . . 72.420000000000002 109.29 179.956 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -162.44 89.47 0.11 Allowed Glycine 0 CA--C 1.53 0.999 0 O-C-N 124.519 1.137 . . . . 73.409999999999997 111.021 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.9 p -110.08 150.16 28.98 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.533 0.784 . . . . 63.100000000000001 110.049 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -39.63 127.92 1.97 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.466 1.104 . . . . 71.109999999999999 110.309 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.533 ' OE1' ' CH2' ' A' ' 222' ' ' TRP . 0.3 OUTLIER -97.44 156.15 16.6 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.513 1.133 . . . . 74.209999999999994 110.324 179.987 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.59 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 7.3 p -176.14 161.8 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.522 1.139 . . . . 74.239999999999995 109.262 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.436 ' N ' HG22 ' A' ' 77' ' ' VAL . 31.9 t80 -86.83 18.25 3.58 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.473 1.108 . . . . 74.239999999999995 110.969 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.413 ' HB2' HG13 ' A' ' 77' ' ' VAL . 3.9 tp -39.31 157.33 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.498 1.124 . . . . 74.420000000000002 109.318 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.852 ' HD3' HG22 ' A' ' 106' ' ' ILE . 4.9 ptmm? -104.69 -51.59 3.04 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.472 1.108 . . . . 71.420000000000002 109.335 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.603 ' HE2' HD11 ' A' ' 136' ' ' ILE . 0.2 OUTLIER -167.51 142.83 3.94 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.479 1.112 . . . . 73.310000000000002 111.043 179.99 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.57 HG22 ' H ' ' A' ' 83' ' ' ILE . 7.4 p -97.98 172.7 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.51 1.131 . . . . 64.340000000000003 109.272 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.883 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.3 mp -129.55 96.87 3.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.481 1.113 . . . . 71.5 109.288 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.465 ' HG ' ' CB ' ' A' ' 128' ' ' ALA . 5.5 mt -70.41 117.62 12.18 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.537 1.148 . . . . 74.519999999999996 109.317 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.765 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -142.22 174.57 10.49 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.559 1.162 . . . . 73.519999999999996 109.622 179.995 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.565 ' HB2' ' CD1' ' A' ' 143' ' ' PHE . . . -117.0 149.55 40.07 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.492 1.12 . . . . 63.549999999999997 109.282 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.08 -21.34 1.83 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.459 1.099 . . . . 73.420000000000002 110.28 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -66.66 -45.87 77.52 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.543 1.152 . . . . 60.520000000000003 109.304 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.409 ' O ' HD23 ' A' ' 138' ' ' LEU . 5.9 t0 -132.0 44.22 2.93 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.453 1.096 . . . . 74.519999999999996 109.328 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.619 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -74.73 -23.83 58.63 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.466 1.104 . . . . 73.140000000000001 110.44 179.955 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -76.3 -39.04 55.18 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.464 1.103 . . . . 75.099999999999994 109.264 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.409 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 0.1 OUTLIER -61.57 -50.54 72.2 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.482 1.114 . . . . 71.219999999999999 110.285 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 1.047 ' HB2' ' CD2' ' A' ' 138' ' ' LEU . . . -59.71 -27.95 66.9 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.569 1.168 . . . . 63.310000000000002 109.348 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.935 HD22 ' O ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -82.87 -33.38 27.02 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.524 1.14 . . . . 61.310000000000002 109.323 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.624 ' N ' HD13 ' A' ' 94' ' ' LEU . 9.3 tpp180 -57.16 -28.51 62.82 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.517 1.136 . . . . 72.329999999999998 110.368 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.842 HG21 ' HE1' ' A' ' 173' ' ' MET . 1.7 t -84.48 -65.35 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.435 1.085 . . . . 75.519999999999996 109.324 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.587 ' HA ' HD12 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -39.99 -28.12 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.538 1.149 . . . . 63.119999999999997 110.319 179.993 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.442 ' N ' ' O ' ' A' ' 96' ' ' VAL . 2.1 t-20 -69.85 -52.67 22.91 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.504 1.128 . . . . 74.129999999999995 109.252 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.822 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -71.03 -21.58 62.25 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.549 1.155 . . . . 71.340000000000003 109.355 179.981 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.822 ' N ' HD23 ' A' ' 99' ' ' LEU . 25.4 mt -60.15 -58.23 9.44 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.508 1.13 . . . . 70.099999999999994 109.277 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.477 ' HB2' ' CE ' ' A' ' 107' ' ' LYS . 5.6 pt20 -75.28 59.13 1.0 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.534 1.146 . . . . 64.230000000000004 110.336 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -178.2 -64.06 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.439 1.087 . . . . 53.310000000000002 109.241 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -49.73 -50.68 43.19 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.491 1.119 . . . . 73.420000000000002 109.324 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.565 ' CZ ' HG11 ' A' ' 206' ' ' VAL . 2.6 m-85 -114.42 -22.47 9.84 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.494 1.121 . . . . 64.140000000000001 110.997 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.49 44.7 3.93 Favored Glycine 0 CA--C 1.53 1.021 0 O-C-N 124.524 1.14 . . . . 44.409999999999997 110.987 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.852 HG22 ' HD3' ' A' ' 80' ' ' LYS . 3.6 mm -86.97 87.66 2.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.476 0.75 . . . . 73.209999999999994 109.323 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.51 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -132.36 158.5 75.46 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.555 1.159 . . . . 70.140000000000001 109.28 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.51 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.01 167.06 81.6 Favored 'Cis proline' 0 C--N 1.36 1.175 0 C-N-CA 121.033 -2.486 . . . . 73.420000000000002 110.979 0.049 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.75 129.07 6.06 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.547 1.155 . . . . 74.409999999999997 110.989 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.4 HD11 ' C ' ' A' ' 114' ' ' GLU . 0.0 OUTLIER -148.05 132.4 9.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.502 0.766 . . . . 72.040000000000006 109.318 179.989 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.78 HD13 ' HB2' ' A' ' 94' ' ' LEU . 44.2 pt -91.83 -178.35 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.457 1.098 . . . . 65.200000000000003 109.318 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -81.53 -19.1 42.84 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.522 1.139 . . . . 70.549999999999997 111.006 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -91.54 -3.05 56.92 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.455 1.097 . . . . 74.129999999999995 109.332 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.4 ' C ' HD11 ' A' ' 110' ' ' ILE . 9.7 mm-40 -109.79 -26.75 9.66 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.465 1.103 . . . . 52.25 110.314 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 23.4 tpp -39.93 111.06 0.69 Allowed Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.571 1.169 . . . . 74.299999999999997 111.017 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.99 112.02 3.46 Favored 'Trans proline' 0 C--N 1.36 1.16 0 O-C-N 124.479 1.779 . . . . 75.129999999999995 111.021 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.539 ' CD2' ' HA ' ' A' ' 121' ' ' HIS . 19.5 m80 -41.97 160.34 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.512 1.132 . . . . 73.530000000000001 109.654 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -103.02 -68.48 0.79 Allowed Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.53 1.144 . . . . 63.229999999999997 110.969 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 17.3 tpp180 -106.31 -73.52 0.68 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.5 0.765 . . . . 75.329999999999998 110.331 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -114.83 -75.11 0.59 Allowed 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.483 1.115 . . . . 72.120000000000005 110.337 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' HIS . . . . . 0.709 ' CD2' ' H ' ' A' ' 122' ' ' LEU . 17.1 t60 -159.42 173.65 15.91 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.49 1.119 . . . . 62.549999999999997 109.567 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.728 ' C ' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -131.17 146.04 52.19 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.568 1.168 . . . . 71.310000000000002 109.299 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -129.09 14.91 6.26 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.494 1.121 . . . . 63.100000000000001 110.304 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -110.24 131.22 55.25 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.507 1.129 . . . . 63.229999999999997 109.287 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.0 -17.19 47.74 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.497 1.123 . . . . 42.5 109.263 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.438 ' O ' ' N ' ' A' ' 129' ' ' VAL . 2.4 t70 -64.44 -22.24 66.9 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.526 1.141 . . . . 75.230000000000004 109.29 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -49.91 -23.48 1.98 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.501 1.126 . . . . 75.120000000000005 109.363 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.465 ' CB ' ' HG ' ' A' ' 84' ' ' LEU . . . -89.3 -33.16 17.03 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.469 1.105 . . . . 62.130000000000003 109.261 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.739 HG12 ' O ' ' A' ' 129' ' ' VAL . 73.6 t -92.94 30.48 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.499 1.124 . . . . 65.420000000000002 109.299 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -135.29 118.89 16.99 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.544 1.152 . . . . 74.329999999999998 109.234 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' GLY . . . . . 0.561 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 66.59 62.97 4.17 Favored Glycine 0 CA--C 1.531 1.033 0 O-C-N 124.51 1.131 . . . . 73.209999999999994 111.009 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -154.92 -176.87 6.15 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.552 0.796 . . . . 75.540000000000006 110.068 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.746 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -113.23 -32.22 6.36 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.438 1.086 . . . . 73.299999999999997 109.235 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.746 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.4 m-90 -161.48 160.2 28.93 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.489 1.118 . . . . 73.239999999999995 107.997 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.9 p -132.82 131.49 41.1 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.487 1.117 . . . . 63.450000000000003 110.428 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.883 ' HB ' HG23 ' A' ' 83' ' ' ILE . 9.8 mm -84.6 138.64 18.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.524 1.14 . . . . 74.030000000000001 109.334 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.766 HD11 HG13 ' A' ' 170' ' ' VAL . 4.1 mt -130.34 94.5 3.68 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.477 1.111 . . . . 62.229999999999997 109.341 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 1.047 ' CD2' ' HB2' ' A' ' 93' ' ' ALA . 0.5 OUTLIER -62.55 99.63 0.15 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.528 1.142 . . . . 64.230000000000004 109.32 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.583 HD21 ' HB2' ' A' ' 172' ' ' PRO . 0.4 OUTLIER -63.55 116.35 5.54 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.43 1.081 . . . . 64.409999999999997 109.334 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.588 HG22 ' H ' ' A' ' 141' ' ' GLU . 5.8 m -139.4 179.69 6.4 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.559 1.162 . . . . 72.519999999999996 110.397 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.588 ' H ' HG22 ' A' ' 140' ' ' THR . 5.5 mp0 -84.87 -36.67 21.39 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.482 1.114 . . . . 74.150000000000006 110.227 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -88.44 -32.82 18.09 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.494 1.121 . . . . 74.109999999999999 109.308 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.739 ' O ' HG23 ' A' ' 147' ' ' THR . 51.1 t80 -72.44 -36.75 68.63 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.437 1.086 . . . . 72.329999999999998 110.926 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.711 HD13 ' N ' ' A' ' 145' ' ' ARG . 1.5 tm? -54.7 -67.49 0.26 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.533 1.145 . . . . 71.219999999999999 109.32 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.711 ' N ' HD13 ' A' ' 144' ' ' LEU . 0.0 OUTLIER -55.39 -18.4 6.7 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.551 1.157 . . . . 73.420000000000002 110.312 -179.975 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.69 -32.93 25.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.466 1.104 . . . . 64.430000000000007 109.321 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.739 HG23 ' O ' ' A' ' 143' ' ' PHE . 80.8 p -97.39 -7.02 32.76 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.552 1.158 . . . . 44.340000000000003 110.388 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.549 ' CH2' ' HB2' ' A' ' 186' ' ' PRO . 0.1 OUTLIER -94.24 -26.55 16.59 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.951 -1.129 . . . . 74.129999999999995 107.951 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 51.6 t -95.62 -26.39 15.77 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.488 1.117 . . . . 63.439999999999998 108.316 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 9.6 m-20 -77.92 -42.79 31.97 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.506 1.129 . . . . 72.150000000000006 109.347 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.71 ' CE2' HD12 ' A' ' 157' ' ' LEU . 4.0 m-85 -69.39 -51.08 40.11 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 72.450000000000003 110.981 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -46.6 -47.78 19.84 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.518 1.136 . . . . 73.349999999999994 110.266 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -68.83 -22.66 64.22 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.54 1.15 . . . . 72.129999999999995 110.983 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -118.9 91.94 3.68 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.464 1.103 . . . . 73.030000000000001 110.949 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.6 t -60.87 -15.65 32.93 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.537 1.148 . . . . 44.039999999999999 110.372 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 93.0 p -69.86 -20.7 63.4 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.449 1.093 . . . . 70.140000000000001 109.966 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.748 ' O ' HG23 ' A' ' 161' ' ' VAL . 0.0 OUTLIER -86.27 -37.17 18.84 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.563 1.164 . . . . 73.010000000000005 109.279 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 158' ' ' MET . . . . . 0.535 ' CE ' HG11 ' A' ' 161' ' ' VAL . 18.4 mmt -62.95 -11.58 19.67 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.517 1.136 . . . . 71.510000000000005 111.001 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -62.47 -68.48 0.33 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.513 1.133 . . . . 71.200000000000003 109.29 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.467 ' HB2' ' CG2' ' A' ' 170' ' ' VAL . 0.0 OUTLIER -59.19 -34.21 71.86 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.506 1.129 . . . . 74.510000000000005 110.042 179.997 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 161' ' ' VAL . . . . . 0.813 ' CG1' ' HB1' ' A' ' 188' ' ' ALA . 87.5 t -55.68 -18.99 5.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.516 1.135 . . . . 71.340000000000003 109.357 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -92.03 35.7 0.98 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.555 1.16 . . . . 74.219999999999999 109.278 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.466 ' CD ' ' CG1' ' A' ' 192' ' ' ILE . 0.1 OUTLIER 40.18 64.31 0.93 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.494 1.121 . . . . 72.299999999999997 110.294 -179.998 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -96.28 -174.78 3.16 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.479 1.112 . . . . 73.329999999999998 110.293 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 31.9 p80 -141.72 55.75 1.5 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.479 1.112 . . . . 73.299999999999997 109.598 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.2 tptm -90.89 -175.46 4.36 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.497 1.123 . . . . 74.129999999999995 109.272 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 167' ' ' TYR . . . . . 1.164 ' CD1' HG22 ' A' ' 221' ' ' ILE . 10.8 m-85 -37.65 -46.86 0.91 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.435 1.084 . . . . 74.349999999999994 110.893 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.435 ' ND2' ' O ' ' A' ' 129' ' ' VAL . 0.6 OUTLIER -112.58 164.11 13.71 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.467 1.104 . . . . 74.439999999999998 109.305 -179.99 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.467 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 5.9 m -124.66 175.11 7.42 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.515 1.135 . . . . 72.409999999999997 110.057 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.803 ' O ' HD12 ' A' ' 171' ' ' ILE . 2.1 t -133.88 122.44 42.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 O-C-N 124.491 1.119 . . . . 75.430000000000007 109.319 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.907 HG12 HG21 ' A' ' 209' ' ' ILE . 1.4 mp -132.72 103.24 13.36 Favored Pre-proline 0 C--N 1.324 -0.506 0 O-C-N 124.583 1.177 . . . . 72.439999999999998 109.254 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 172' ' ' PRO . . . . . 0.583 ' HB2' HD21 ' A' ' 139' ' ' LEU . 18.3 Cg_endo -74.99 112.65 3.61 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.51 1.795 . . . . 72.109999999999999 111.025 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 173' ' ' MET . . . . . 0.842 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.5 ttt -92.92 157.55 16.29 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.443 1.089 . . . . 73.150000000000006 110.961 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 174' ' ' ARG . . . . . 0.439 ' N ' ' HG2' ' A' ' 173' ' ' MET . 1.4 mpt_? -113.54 120.26 39.96 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.511 1.132 . . . . 75.340000000000003 110.288 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 175' ' ' PRO . . . . . 0.474 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.3 Cg_endo -75.01 154.47 42.46 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.455 1.766 . . . . 70.5 110.963 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.907 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -88.22 -43.21 11.77 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.528 1.143 . . . . 74.219999999999999 109.249 -179.996 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -72.23 -27.15 62.34 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.461 1.101 . . . . 72.310000000000002 109.296 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 178' ' ' ASN . . . . . 0.474 ' CB ' ' HG2' ' A' ' 175' ' ' PRO . 9.8 m-20 -110.33 99.39 40.15 Favored Pre-proline 0 C--N 1.325 -0.483 0 O-C-N 124.484 1.115 . . . . 74.319999999999993 109.279 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -74.97 124.61 8.77 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.493 1.786 . . . . 74.129999999999995 111.058 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.487 HD22 ' HA ' ' A' ' 180' ' ' LEU . 0.4 OUTLIER -136.0 96.34 13.02 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.531 1.145 . . . . 71.010000000000005 109.304 -179.983 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -75.07 171.7 17.79 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.481 1.78 . . . . 73.040000000000006 110.998 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 17.2 ptt180 -59.37 -32.27 69.97 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 65.519999999999996 110.255 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -60.74 -14.82 23.58 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.487 1.117 . . . . 75.299999999999997 110.328 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 184' ' ' ARG . . . . . 0.422 ' HB2' HD13 ' A' ' 180' ' ' LEU . 30.8 mmt180 -113.79 -28.61 7.37 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.48 1.113 . . . . 72.109999999999999 110.232 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 185' ' ' THR . . . . . . . . . . . . . 61.0 m -66.51 139.47 96.1 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.49 1.119 . . . . 71.239999999999995 110.422 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 186' ' ' PRO . . . . . 0.581 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -74.96 145.4 31.53 Favored 'Trans proline' 0 C--N 1.36 1.132 0 O-C-N 124.488 1.783 . . . . 52.420000000000002 110.997 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 187' ' ' PHE . . . . . 0.479 ' O ' ' CD1' ' A' ' 187' ' ' PHE . 5.2 t80 -59.73 -13.67 11.05 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.512 1.133 . . . . 72.230000000000004 110.985 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 188' ' ' ALA . . . . . 0.813 ' HB1' ' CG1' ' A' ' 161' ' ' VAL . . . -86.92 -53.77 4.71 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.509 1.131 . . . . 74.430000000000007 109.301 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.928 ' HA ' HD12 ' A' ' 192' ' ' ILE . 23.9 mt -76.57 -11.8 59.92 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.41 1.068 . . . . 74.5 109.261 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 190' ' ' GLN . . . . . 0.499 ' CG ' ' O ' ' A' ' 190' ' ' GLN . 4.7 tt0 -86.81 -0.78 57.03 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.494 1.121 . . . . 53.140000000000001 110.283 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 191' ' ' THR . . . . . 0.401 ' OG1' ' O ' ' A' ' 188' ' ' ALA . 3.4 p -115.72 -30.7 6.05 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.517 1.135 . . . . 74.540000000000006 110.426 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.928 HD12 ' HA ' ' A' ' 189' ' ' LEU . 7.2 mt -65.1 169.36 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.507 1.129 . . . . 74.230000000000004 109.3 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 193' ' ' ASN . . . . . 0.535 ' N ' HG22 ' A' ' 192' ' ' ILE . 5.7 m-20 -76.17 57.32 1.11 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.497 1.123 . . . . 54.439999999999998 109.32 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 194' ' ' ALA . . . . . 0.477 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -43.07 142.08 1.03 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.451 1.094 . . . . 72.299999999999997 109.307 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 195' ' ' LEU . . . . . 0.594 HD12 ' CE ' ' A' ' 173' ' ' MET . 0.4 OUTLIER -88.9 126.1 35.24 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.499 1.125 . . . . 63.420000000000002 109.297 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 196' ' ' GLU . . . . . 0.404 ' HB3' ' CB ' ' A' ' 199' ' ' SER . 38.7 mt-10 -101.44 130.57 47.7 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.549 1.156 . . . . 72.420000000000002 110.326 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.907 ' HG3' HD21 ' A' ' 176' ' ' LEU . 8.8 tp10 -113.61 -23.94 9.49 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.517 1.135 . . . . 75.129999999999995 110.311 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -103.06 4.03 36.72 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.498 1.124 . . . . 72.010000000000005 110.296 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 199' ' ' SER . . . . . 0.404 ' CB ' ' HB3' ' A' ' 196' ' ' GLU . 14.7 t -97.59 174.9 6.42 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.489 1.118 . . . . 70.349999999999994 109.98 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -70.64 -60.36 2.3 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.515 1.134 . . . . 73.200000000000003 110.244 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -78.82 51.34 3.76 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.459 1.099 . . . . 71.409999999999997 110.976 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 202' ' ' PHE . . . . . 0.614 ' CD1' ' C ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -78.39 -47.27 2.0 Allowed Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.526 0.78 . . . . 74.150000000000006 110.972 -179.993 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 203' ' ' PRO . . . . . 0.654 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.3 Cg_endo -75.02 -27.44 9.97 Favored 'Trans proline' 0 C--N 1.36 1.145 0 O-C-N 124.444 1.76 . . . . 71.230000000000004 110.99 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.51 -50.77 71.38 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.615 1.197 . . . . 72.540000000000006 110.438 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 205' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 0.2 OUTLIER -58.75 -63.18 1.38 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.518 1.136 . . . . 75.120000000000005 110.31 -179.989 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 206' ' ' VAL . . . . . 0.776 HG21 HD22 ' A' ' 100' ' ' LEU . 2.7 p -38.82 -33.86 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.495 1.122 . . . . 71.200000000000003 109.304 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 207' ' ' GLU . . . . . 0.414 ' N ' ' C ' ' A' ' 205' ' ' GLN . 1.0 OUTLIER -76.39 -65.68 0.9 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.541 1.151 . . . . 71.510000000000005 110.283 -179.961 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 82.9 mtt-85 -47.82 -58.07 4.82 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.53 1.144 . . . . 71.540000000000006 110.276 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 209' ' ' ILE . . . . . 0.907 HG21 HG12 ' A' ' 171' ' ' ILE . 3.3 mt -52.56 -70.75 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.481 1.113 . . . . 73.109999999999999 109.341 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 210' ' ' PHE . . . . . 0.607 ' CD2' HG23 ' A' ' 206' ' ' VAL . 0.7 OUTLIER -84.9 65.28 9.11 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.534 1.146 . . . . 72.319999999999993 111.045 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 211' ' ' GLN . . . . . 0.447 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.2 OUTLIER -110.59 146.65 35.73 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.447 1.092 . . . . 65.109999999999999 110.262 -179.968 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' A' ' 215' ' ' TYR . 60.7 tt0 -48.33 -55.39 10.8 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 73.430000000000007 110.334 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.3 m -48.6 -25.23 1.64 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.544 1.152 . . . . 54.329999999999998 109.995 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.447 HG23 ' HG2' ' A' ' 211' ' ' GLN . 32.8 t -96.21 -26.35 4.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.485 1.116 . . . . 70.200000000000003 109.304 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 215' ' ' TYR . . . . . 0.455 ' N ' ' O ' ' A' ' 212' ' ' GLU . 8.5 t80 -69.27 -33.83 73.82 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.519 1.137 . . . . 75.430000000000007 110.987 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 216' ' ' LYS . . . . . 0.442 ' O ' ' N ' ' A' ' 220' ' ' THR . 4.2 mmtp -52.18 -54.84 25.92 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.486 1.116 . . . . 71.209999999999994 109.265 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 217' ' ' THR . . . . . 0.485 ' CG2' HD11 ' A' ' 221' ' ' ILE . 1.3 m -54.82 -65.19 0.62 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.478 1.111 . . . . 61.350000000000001 110.38 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 218' ' ' GLN . . . . . 0.657 ' HA ' HD12 ' A' ' 221' ' ' ILE . 5.3 mp0 -48.87 -28.35 3.7 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.472 1.107 . . . . 71.030000000000001 110.284 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -84.68 -27.75 26.85 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.483 1.115 . . . . 73.230000000000004 110.328 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 220' ' ' THR . . . . . 0.452 ' N ' ' O ' ' A' ' 217' ' ' THR . 1.0 OUTLIER -79.96 -17.41 53.03 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.529 1.143 . . . . 64.049999999999997 110.465 179.923 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 221' ' ' ILE . . . . . 1.164 HG22 ' CD1' ' A' ' 167' ' ' TYR . 7.4 mt -89.21 -45.58 15.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.559 1.162 . . . . 72.5 109.329 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 222' ' ' TRP . . . . . 0.59 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 41.7 t90 -68.57 -18.74 64.4 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.573 1.171 . . . . 72.25 107.982 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.76 -24.12 20.46 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.448 1.093 . . . . 62.049999999999997 109.271 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -93.35 -19.45 21.33 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.495 1.122 . . . . 72.239999999999995 110.294 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.525 ' HB ' ' CE1' ' A' ' 167' ' ' TYR . 2.1 t -70.65 -32.4 69.67 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.516 1.135 . . . . 75.140000000000001 110.384 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -75.98 -16.44 59.98 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.48 1.113 . . . . 71.129999999999995 110.3 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 227' ' ' ASN . . . . . 0.443 ' O ' ' N ' ' A' ' 231' ' ' ARG . 2.8 m-20 -82.79 -56.79 3.63 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.519 1.137 . . . . 75.019999999999996 109.263 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 20.2 mtm -46.16 -47.61 17.56 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.56 1.162 . . . . 71.310000000000002 110.992 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 229' ' ' VAL . . . . . 0.423 HG13 ' N ' ' A' ' 230' ' ' GLN . 14.7 p -59.05 -47.72 89.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 O-C-N 124.502 1.126 . . . . 63.109999999999999 109.398 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 230' ' ' GLN . . . . . 0.423 ' N ' HG13 ' A' ' 229' ' ' VAL . 0.4 OUTLIER -84.03 9.8 11.57 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.466 1.104 . . . . 70.010000000000005 110.251 179.975 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 231' ' ' ARG . . . . . 0.443 ' N ' ' O ' ' A' ' 227' ' ' ASN . 7.8 tmm_? -108.05 -67.88 0.94 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.454 1.096 . . . . 72.540000000000006 110.305 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -152.43 39.74 0.58 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.515 1.135 . . . . 61.140000000000001 110.367 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -157.88 41.24 0.28 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.521 1.138 . . . . 73.310000000000002 111.024 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.405 ' CG1' ' O ' ' A' ' 229' ' ' VAL . 7.5 mt -60.25 154.68 3.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.445 1.091 . . . . 75.120000000000005 109.243 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 235' ' ' ALA . . . . . 0.564 ' HB1' HD22 ' A' ' 72' ' ' LEU . . . . . . . . 0 C--N 1.325 -0.498 0 O-C-N 124.513 1.133 . . . . 44.32 109.3 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.985 0 N-CA-C 111.03 -0.828 . . . . 52.329999999999998 111.03 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.99 166.06 30.01 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.494 1.786 . . . . 71.019999999999996 110.986 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.627 HD13 ' O ' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -95.13 -41.69 8.97 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.556 1.16 . . . . 73.209999999999994 109.326 179.955 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -157.38 84.94 0.13 Allowed Glycine 0 CA--C 1.529 0.959 0 O-C-N 124.452 1.095 . . . . 73.439999999999998 111.012 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.3 m -143.35 164.4 30.38 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.478 0.752 . . . . 72.299999999999997 110.017 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.405 ' HG3' ' N ' ' A' ' 76' ' ' GLU . 23.4 tp10 -80.38 149.28 30.27 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.541 1.151 . . . . 62.229999999999997 110.237 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.405 ' N ' ' HG3' ' A' ' 75' ' ' GLU . 0.9 OUTLIER -99.79 153.36 19.18 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.511 1.132 . . . . 70.140000000000001 110.322 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.61 ' O ' ' CZ2' ' A' ' 222' ' ' TRP . 3.2 p -176.23 165.0 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 O-C-N 124.531 1.144 . . . . 70.439999999999998 109.257 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.488 ' N ' HG22 ' A' ' 77' ' ' VAL . 5.8 t80 -87.75 26.9 1.22 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.511 1.132 . . . . 75.450000000000003 110.969 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.634 HD11 HG22 ' A' ' 110' ' ' ILE . 4.5 tp -41.03 160.89 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.538 1.149 . . . . 73.340000000000003 109.309 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.722 ' HD3' HG22 ' A' ' 106' ' ' ILE . 6.4 ptmt -111.9 -47.22 3.15 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.529 1.143 . . . . 71.329999999999998 109.336 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.664 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.2 OUTLIER -167.32 139.58 3.31 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.516 1.135 . . . . 74.019999999999996 110.998 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.737 ' CG1' HG22 ' A' ' 135' ' ' THR . 7.3 p -96.72 165.42 2.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.544 1.152 . . . . 64.349999999999994 109.322 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.822 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.3 mp -126.01 97.2 4.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.569 1.168 . . . . 63.450000000000003 109.283 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.697 HD11 ' CB ' ' A' ' 128' ' ' ALA . 10.9 mt -70.88 117.37 12.3 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.525 1.14 . . . . 74.200000000000003 109.341 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.671 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -138.66 174.26 10.72 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.449 1.093 . . . . 70.099999999999994 109.646 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.48 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -124.83 149.08 47.83 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.499 1.125 . . . . 54.530000000000001 109.306 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -44.6 -27.05 0.43 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.436 1.085 . . . . 70.010000000000005 110.262 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 57.3 t0 -66.62 -44.83 80.99 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.542 1.151 . . . . 70.420000000000002 109.309 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.452 ' N ' ' O ' ' A' ' 86' ' ' ALA . 22.9 m-20 -124.01 41.27 3.53 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.515 1.135 . . . . 74.099999999999994 109.296 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.596 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -70.51 -41.11 73.03 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.469 1.106 . . . . 74.120000000000005 110.442 179.947 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -69.92 -31.96 70.0 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.468 1.105 . . . . 74.510000000000005 109.319 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -60.16 -69.45 0.22 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.525 1.141 . . . . 74.140000000000001 110.288 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.827 ' HB2' HD22 ' A' ' 138' ' ' LEU . . . -46.09 -28.87 1.31 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.526 1.141 . . . . 52.210000000000001 109.269 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.498 ' HG ' HD13 ' A' ' 111' ' ' ILE . 0.7 OUTLIER -69.37 -57.63 5.04 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.516 1.135 . . . . 71.129999999999995 109.286 -179.977 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 11.4 tpp180 -41.4 -36.2 0.8 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.457 1.098 . . . . 74.519999999999996 110.347 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.887 HG21 ' HE1' ' A' ' 173' ' ' MET . 1.9 t -77.75 -65.15 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 O-C-N 124.493 1.121 . . . . 74.420000000000002 109.334 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.5 ' N ' HG12 ' A' ' 96' ' ' VAL . 0.1 OUTLIER -45.14 -21.84 0.09 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.52 1.138 . . . . 72.099999999999994 110.309 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.44 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.1 OUTLIER -78.57 -59.64 2.7 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.519 1.137 . . . . 71.409999999999997 109.3 -179.975 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.845 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -61.8 -22.11 65.18 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.556 1.16 . . . . 70.129999999999995 109.312 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.845 ' N ' HD23 ' A' ' 99' ' ' LEU . 15.5 mt -64.64 -55.55 19.46 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.534 1.147 . . . . 44.420000000000002 109.252 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -78.82 54.01 1.47 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.506 1.129 . . . . 74.409999999999997 110.287 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -174.78 -67.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.515 1.135 . . . . 72.510000000000005 109.242 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -45.26 -51.86 10.29 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.523 1.14 . . . . 71.239999999999995 109.346 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.404 ' CE2' HG11 ' A' ' 206' ' ' VAL . 4.6 m-85 -113.4 -24.92 9.05 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.41 1.069 . . . . 75.219999999999999 110.942 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.406 ' C ' ' CD ' ' A' ' 107' ' ' LYS . . . 92.59 44.72 3.89 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.538 1.149 . . . . 53.32 111.031 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.722 HG22 ' HD3' ' A' ' 80' ' ' LYS . 8.5 mm -84.35 75.22 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 O-C-N 124.497 0.763 . . . . 72.420000000000002 109.35 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.536 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -119.56 156.38 53.51 Favored Pre-proline 0 C--N 1.326 -0.451 0 O-C-N 124.417 1.073 . . . . 71.209999999999994 109.282 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.536 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.95 161.36 94.99 Favored 'Cis proline' 0 C--N 1.359 1.111 0 C-N-CA 121.001 -2.499 . . . . 62.310000000000002 111.015 -0.048 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -135.91 118.7 1.89 Allowed Glycine 0 CA--C 1.53 0.995 0 O-C-N 124.422 1.076 . . . . 73.219999999999999 111.016 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.634 HG22 HD11 ' A' ' 79' ' ' LEU . 1.3 tt -136.06 149.89 27.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.55 0.794 . . . . 74.519999999999996 109.296 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.671 HD12 ' NE2' ' A' ' 85' ' ' HIS . 33.5 pt -98.11 161.0 3.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.439 1.087 . . . . 73.239999999999995 109.336 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.871 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 2.5 t80 -62.04 -19.21 62.66 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.52 1.138 . . . . 74.340000000000003 111.059 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.401 ' HB2' ' HE1' ' A' ' 85' ' ' HIS . . . -87.33 -11.6 48.96 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.517 1.136 . . . . 62.399999999999999 109.386 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.401 ' C ' HD11 ' A' ' 110' ' ' ILE . 7.7 mm-40 -104.08 -20.88 13.69 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.486 1.117 . . . . 73.409999999999997 110.321 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.471 ' CE ' ' CG2' ' A' ' 82' ' ' VAL . 21.9 tpp -44.57 134.36 4.66 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 124.464 1.102 . . . . 52.030000000000001 110.98 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.02 107.24 2.44 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.531 1.806 . . . . 54.43 110.992 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 21.0 m-70 -136.16 -175.8 4.11 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.432 1.083 . . . . 74.430000000000007 109.597 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -66.1 -159.32 0.66 Allowed Glycine 0 CA--C 1.53 1.02 0 O-C-N 124.488 1.117 . . . . 63.039999999999999 110.947 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 49.5 ttt-85 -93.56 50.84 1.51 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.496 0.762 . . . . 54.109999999999999 110.271 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -173.19 143.96 1.17 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.483 1.115 . . . . 65.450000000000003 110.287 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' HIS . . . . . 0.471 ' CG ' ' N ' ' A' ' 122' ' ' LEU . 28.6 t-80 -60.58 167.52 2.61 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.553 1.158 . . . . 72.099999999999994 109.603 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.872 HD22 ' O ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -144.55 119.0 9.64 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.41 1.069 . . . . 72.209999999999994 109.333 -179.996 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.416 ' OE1' ' HA ' ' A' ' 123' ' ' GLN . 3.7 tp60 -83.7 -13.97 52.82 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.484 1.115 . . . . 70.340000000000003 110.333 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.4 ' C ' ' O ' ' A' ' 123' ' ' GLN . 9.8 m120 -40.51 112.71 0.3 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.493 1.121 . . . . 73.409999999999997 109.294 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.769 ' HB2' HD11 ' A' ' 157' ' ' LEU . 0.1 OUTLIER -81.54 -50.63 9.15 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.476 1.11 . . . . 65.040000000000006 109.291 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.426 ' HA ' ' CG2' ' A' ' 129' ' ' VAL . 0.6 OUTLIER -41.31 -59.02 1.66 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.481 1.113 . . . . 73.299999999999997 109.307 -179.996 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -43.64 -46.95 7.54 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.492 1.12 . . . . 71.549999999999997 109.333 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.871 ' HB2' ' CE1' ' A' ' 112' ' ' PHE . . . -61.52 -46.66 89.0 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.427 1.079 . . . . 73.209999999999994 109.268 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.706 ' HA ' HG21 ' A' ' 135' ' ' THR . 35.2 m -92.38 30.94 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.525 1.14 . . . . 63.399999999999999 109.309 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.403 ' N ' ' O ' ' A' ' 126' ' ' ASP . 22.8 t-20 -148.46 118.48 7.2 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.494 1.121 . . . . 75.540000000000006 109.32 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 102.78 34.15 4.16 Favored Glycine 0 CA--C 1.53 1.028 0 O-C-N 124.515 1.135 . . . . 71.109999999999999 110.928 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' SER . . . . . 0.403 ' O ' ' O ' ' A' ' 167' ' ' TYR . 0.7 OUTLIER -163.54 -173.81 3.46 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.503 0.767 . . . . 73.109999999999999 110.025 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' A' ' 80' ' ' LYS . . . -91.09 -68.59 0.78 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.456 1.097 . . . . 74.349999999999994 109.275 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.605 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 0.9 OUTLIER -121.52 174.86 6.51 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.509 1.131 . . . . 73.409999999999997 108.021 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.737 HG22 ' CG1' ' A' ' 82' ' ' VAL . 2.5 p -143.28 136.0 27.56 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.483 1.114 . . . . 51.409999999999997 110.374 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.822 ' HB ' HG23 ' A' ' 83' ' ' ILE . 14.5 mm -89.5 113.46 25.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.477 1.111 . . . . 71.219999999999999 109.29 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.693 HD11 ' CG1' ' A' ' 170' ' ' VAL . 2.8 mt -99.06 89.65 4.34 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.536 1.147 . . . . 75.239999999999995 109.278 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.827 HD22 ' HB2' ' A' ' 93' ' ' ALA . 2.4 tp -62.2 102.3 0.29 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.472 1.107 . . . . 65.120000000000005 109.286 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.562 HD13 HG23 ' A' ' 185' ' ' THR . 55.2 mt -77.37 121.24 23.5 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.461 1.101 . . . . 63.409999999999997 109.344 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.668 HG23 ' ND2' ' A' ' 178' ' ' ASN . 10.6 m -139.74 162.19 35.73 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.523 1.14 . . . . 70.530000000000001 110.397 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -53.65 -40.86 66.21 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.566 1.166 . . . . 74.430000000000007 110.295 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -89.76 -52.32 5.05 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.442 1.089 . . . . 72.310000000000002 109.326 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.48 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 6.6 t80 -49.51 -27.64 4.58 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.481 1.113 . . . . 71.420000000000002 110.926 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.708 ' C ' HD13 ' A' ' 144' ' ' LEU . 2.1 tm? -63.0 -67.98 0.38 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.471 1.107 . . . . 60.450000000000003 109.336 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.463 ' CD ' ' C ' ' A' ' 145' ' ' ARG . 0.2 OUTLIER -65.32 -14.7 61.39 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.507 1.129 . . . . 71.310000000000002 110.242 -179.977 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 146' ' ' ASP . . . . . 0.418 ' N ' ' HD2' ' A' ' 145' ' ' ARG . 21.1 t0 -67.51 -60.64 2.4 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.498 1.124 . . . . 74.409999999999997 109.313 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.517 ' HB ' ' CE1' ' A' ' 151' ' ' PHE . 2.3 p -84.91 -47.52 10.22 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.519 1.137 . . . . 75.219999999999999 110.416 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.475 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 33.0 t-105 -45.7 -30.52 1.61 Allowed 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.517 1.136 . . . . 71.409999999999997 108.084 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 149' ' ' CYS . . . . . 0.452 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 40.5 t -78.47 -45.68 21.52 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.462 1.101 . . . . 75.319999999999993 108.27 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 150' ' ' ASN . . . . . 0.463 ' N ' ' O ' ' A' ' 147' ' ' THR . 5.4 m120 -67.41 -13.66 62.22 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.475 1.109 . . . . 75.129999999999995 109.289 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.886 ' CE1' HD22 ' A' ' 157' ' ' LEU . 5.4 m-30 -80.62 -51.05 9.17 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.505 1.128 . . . . 70.239999999999995 111.025 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -50.91 -40.36 56.78 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.541 1.151 . . . . 73.340000000000003 110.349 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 51.4 t80 -83.8 -17.37 41.29 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.489 1.118 . . . . 62.399999999999999 111.017 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.429 ' CE2' ' HB3' ' A' ' 156' ' ' SER . 1.3 t80 -136.9 105.7 5.89 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.515 1.134 . . . . 72.109999999999999 110.946 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 4.0 t -78.06 -2.96 39.8 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.411 1.07 . . . . 53.340000000000003 110.461 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 156' ' ' SER . . . . . 0.429 ' HB3' ' CE2' ' A' ' 154' ' ' TYR . 10.2 p -44.39 -49.42 9.68 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.474 1.109 . . . . 54.439999999999998 110.032 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.886 HD22 ' CE1' ' A' ' 151' ' ' PHE . 4.4 mp -70.76 -42.47 70.39 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.458 1.099 . . . . 71.209999999999994 109.278 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 158' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -50.57 -21.53 1.58 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.512 1.132 . . . . 73.510000000000005 111.002 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -82.87 -32.77 27.26 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.549 1.156 . . . . 73.340000000000003 109.289 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.605 ' HB2' HG21 ' A' ' 170' ' ' VAL . 6.0 m -79.88 -31.56 40.35 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.55 1.156 . . . . 74.040000000000006 110.014 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 161' ' ' VAL . . . . . 0.589 HG12 HD11 ' A' ' 192' ' ' ILE . 96.5 t -61.28 -18.59 18.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.482 1.114 . . . . 74.200000000000003 109.264 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -66.41 -20.54 66.09 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.526 1.141 . . . . 61.030000000000001 109.267 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.553 ' HD3' HG23 ' A' ' 192' ' ' ILE . 15.7 mmm-85 69.03 43.79 1.09 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.543 1.152 . . . . 60.520000000000003 110.301 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -69.99 176.73 3.55 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.484 1.115 . . . . 62.039999999999999 110.255 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 11.2 m80 -90.69 39.58 0.99 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.523 1.14 . . . . 71.019999999999996 109.607 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -90.74 -178.73 5.34 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.53 1.144 . . . . 73.329999999999998 109.319 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 167' ' ' TYR . . . . . 0.515 ' HB3' HG22 ' A' ' 221' ' ' ILE . 0.4 OUTLIER -85.63 44.46 1.11 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.514 1.133 . . . . 73.150000000000006 110.976 -179.983 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.465 ' O ' ' ND2' ' A' ' 168' ' ' ASN . 0.4 OUTLIER -170.36 124.27 0.71 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.505 1.128 . . . . 60.409999999999997 109.301 179.966 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.461 ' O ' ' HA ' ' A' ' 134' ' ' TRP . 2.5 m -125.0 111.52 15.49 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.486 1.116 . . . . 54.520000000000003 110.017 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.776 ' C ' HD12 ' A' ' 171' ' ' ILE . 3.8 t -79.45 112.78 17.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.57 1.168 . . . . 52.109999999999999 109.296 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.776 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -129.15 102.53 18.79 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.524 1.14 . . . . 54.210000000000001 109.264 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 172' ' ' PRO . . . . . 0.915 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.03 114.8 4.11 Favored 'Trans proline' 0 C--N 1.36 1.164 0 O-C-N 124.479 1.779 . . . . 51.409999999999997 111.056 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 173' ' ' MET . . . . . 0.887 ' HE1' HG21 ' A' ' 96' ' ' VAL . 6.1 ttt -80.2 161.55 25.14 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.527 1.142 . . . . 75.230000000000004 110.982 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 174' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 195' ' ' LEU . 75.0 mtt-85 -107.63 112.1 62.39 Favored Pre-proline 0 C--N 1.326 -0.435 0 O-C-N 124.528 1.142 . . . . 73.439999999999998 110.259 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 175' ' ' PRO . . . . . 0.727 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -74.98 154.69 42.79 Favored 'Trans proline' 0 C--N 1.36 1.168 0 O-C-N 124.446 1.761 . . . . 72.439999999999998 110.987 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.901 HD11 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -100.36 -45.34 5.61 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.453 1.095 . . . . 45.43 109.312 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -72.73 -25.12 61.1 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 73.120000000000005 109.323 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 178' ' ' ASN . . . . . 0.668 ' ND2' HG23 ' A' ' 140' ' ' THR . 8.1 t-20 -108.75 101.7 44.89 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.507 1.129 . . . . 72.430000000000007 109.211 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.05 117.61 4.96 Favored 'Trans proline' 0 C--N 1.36 1.184 0 O-C-N 124.499 1.789 . . . . 64.400000000000006 111.001 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.482 HD22 ' HA ' ' A' ' 180' ' ' LEU . 0.9 OUTLIER -132.97 96.67 17.57 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.561 1.163 . . . . 61.549999999999997 109.279 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 181' ' ' PRO . . . . . 0.45 ' HG2' ' CG ' ' A' ' 183' ' ' GLU . 18.2 Cg_endo -75.04 164.31 33.54 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.471 1.774 . . . . 63.420000000000002 110.991 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.04 -38.98 54.79 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.473 1.108 . . . . 73.239999999999995 110.279 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 183' ' ' GLU . . . . . 0.45 ' CG ' ' HG2' ' A' ' 181' ' ' PRO . 4.4 pt-20 -49.45 -33.16 13.46 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.483 1.115 . . . . 74.239999999999995 110.325 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 184' ' ' ARG . . . . . 0.475 ' HB2' HD13 ' A' ' 180' ' ' LEU . 58.7 mmt-85 -91.83 -21.77 20.47 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.584 1.178 . . . . 73.230000000000004 110.317 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 185' ' ' THR . . . . . 0.562 HG23 HD13 ' A' ' 139' ' ' LEU . 19.4 m -84.36 143.86 42.54 Favored Pre-proline 0 C--N 1.325 -0.468 0 O-C-N 124.452 1.095 . . . . 74.409999999999997 110.412 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 186' ' ' PRO . . . . . 0.823 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -74.99 156.56 43.04 Favored 'Trans proline' 0 C--N 1.36 1.164 0 O-C-N 124.496 1.787 . . . . 63.420000000000002 111.007 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 187' ' ' PHE . . . . . 0.451 ' O ' ' CG2' ' A' ' 191' ' ' THR . 32.3 p90 -70.03 -7.03 37.71 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.493 1.121 . . . . 74.109999999999999 110.996 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 188' ' ' ALA . . . . . 0.473 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -94.26 -52.9 4.16 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.46 1.1 . . . . 63.219999999999999 109.23 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.823 HD12 ' CG ' ' A' ' 186' ' ' PRO . 44.2 mt -68.48 -42.09 79.19 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.513 1.133 . . . . 72.049999999999997 109.334 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 190' ' ' GLN . . . . . 0.409 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 7.2 pt20 -64.01 -9.9 18.67 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.523 1.139 . . . . 75.450000000000003 110.27 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 191' ' ' THR . . . . . 0.451 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 41.4 p -116.56 20.0 14.32 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.451 1.095 . . . . 75.319999999999993 110.38 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.589 HD11 HG12 ' A' ' 161' ' ' VAL . 6.5 mt -120.58 154.43 23.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.478 1.111 . . . . 74.409999999999997 109.285 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 193' ' ' ASN . . . . . 0.486 ' H ' ' NH1' ' A' ' 163' ' ' ARG . 35.4 t30 -64.84 77.47 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.491 1.12 . . . . 64.439999999999998 109.294 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 194' ' ' ALA . . . . . 0.915 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -73.51 174.78 7.75 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.496 1.123 . . . . 43.130000000000003 109.28 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 195' ' ' LEU . . . . . 0.936 HD23 HD12 ' A' ' 209' ' ' ILE . 0.4 OUTLIER -108.3 150.88 26.73 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.472 1.108 . . . . 71.120000000000005 109.348 179.97 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 196' ' ' GLU . . . . . 0.512 ' N ' HD13 ' A' ' 195' ' ' LEU . 26.3 mt-10 -141.92 141.4 32.98 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.429 1.08 . . . . 73.120000000000005 110.338 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.901 ' HG3' HD11 ' A' ' 176' ' ' LEU . 1.2 pt-20 -113.21 -28.78 7.5 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.474 1.109 . . . . 72.099999999999994 110.283 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 198' ' ' GLU . . . . . 0.56 ' CG ' HD12 ' A' ' 176' ' ' LEU . 21.0 pt-20 -88.37 3.01 51.37 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.488 1.117 . . . . 74.010000000000005 110.3 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 5.5 t -97.84 144.47 27.39 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.503 1.127 . . . . 73.349999999999994 110.03 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 4.8 tpm_? -61.87 -17.52 56.82 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.454 1.096 . . . . 71.230000000000004 110.253 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -103.07 19.05 47.63 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.47 1.106 . . . . 64.329999999999998 111.02 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 202' ' ' PHE . . . . . 0.885 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.1 OUTLIER -55.03 -44.34 99.55 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.469 0.747 . . . . 71.310000000000002 111.025 179.969 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 203' ' ' PRO . . . . . 0.597 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.05 -35.01 3.35 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.516 1.798 . . . . 60.049999999999997 110.963 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.98 -48.3 78.74 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.498 1.124 . . . . 62.549999999999997 110.362 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 205' ' ' GLN . . . . . 0.454 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 3.1 mt-30 -71.34 -38.7 71.64 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.443 1.09 . . . . 74.400000000000006 110.267 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 206' ' ' VAL . . . . . 0.885 HG23 ' O ' ' A' ' 202' ' ' PHE . 70.7 t -65.71 -28.96 45.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.544 1.153 . . . . 73.310000000000002 109.327 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 207' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 2.8 mt-10 -78.04 -47.37 18.54 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.49 1.119 . . . . 72.510000000000005 110.337 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -68.97 -62.39 1.4 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.497 1.123 . . . . 62.43 110.253 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 209' ' ' ILE . . . . . 0.936 HD12 HD23 ' A' ' 195' ' ' LEU . 59.8 mt -47.92 -58.28 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.491 1.119 . . . . 64.319999999999993 109.328 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 210' ' ' PHE . . . . . 0.785 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.7 m-85 -99.46 66.68 1.48 Allowed 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.547 1.154 . . . . 61.229999999999997 110.996 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 211' ' ' GLN . . . . . 0.543 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -108.5 144.75 35.74 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.543 1.152 . . . . 75.319999999999993 110.321 179.974 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' A' ' 215' ' ' TYR . 29.3 tt0 -48.79 -55.26 12.06 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.575 1.172 . . . . 64.439999999999998 110.243 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.43 -24.85 1.39 Allowed 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.484 1.115 . . . . 74.420000000000002 110.017 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.543 HG23 ' HG2' ' A' ' 211' ' ' GLN . 43.9 t -96.71 -26.66 4.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.431 1.082 . . . . 72.120000000000005 109.277 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 215' ' ' TYR . . . . . 0.488 ' O ' ' CB ' ' A' ' 219' ' ' GLN . 1.8 t80 -69.2 -29.87 67.93 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.481 1.113 . . . . 75.120000000000005 110.98 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 29.8 mmtt -65.13 -66.32 0.56 Allowed 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.502 1.126 . . . . 74.439999999999998 109.322 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 217' ' ' THR . . . . . 0.796 HG22 HD11 ' A' ' 221' ' ' ILE . 10.1 m -44.44 -66.46 0.39 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.453 1.095 . . . . 52.229999999999997 110.376 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 218' ' ' GLN . . . . . 0.946 ' HA ' HD12 ' A' ' 221' ' ' ILE . 3.2 mp0 -47.29 -62.36 1.46 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.54 1.15 . . . . 72.450000000000003 110.285 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 219' ' ' GLN . . . . . 0.488 ' CB ' ' O ' ' A' ' 215' ' ' TYR . 33.8 tp60 -40.01 -46.03 2.02 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.452 1.095 . . . . 75.129999999999995 110.281 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.1 m -66.09 -44.39 84.52 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.463 1.102 . . . . 71.120000000000005 110.4 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 221' ' ' ILE . . . . . 0.946 HD12 ' HA ' ' A' ' 218' ' ' GLN . 15.4 mt -56.19 -24.4 17.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 O-C-N 124.559 1.162 . . . . 60.240000000000002 109.274 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 222' ' ' TRP . . . . . 0.822 ' C ' HH21 ' A' ' 226' ' ' ARG . 73.4 t90 -78.24 -74.09 0.29 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.529 1.143 . . . . 73.209999999999994 108.006 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 223' ' ' LYS . . . . . 0.43 ' HA ' ' HB2' ' A' ' 226' ' ' ARG . 0.3 OUTLIER -44.28 -26.08 0.29 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.44 1.087 . . . . 75.209999999999994 109.334 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 224' ' ' GLU . . . . . 0.436 ' N ' ' C ' ' A' ' 222' ' ' TRP . 3.2 mm-40 -58.21 -53.8 54.23 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.521 1.138 . . . . 73.310000000000002 110.263 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.779 HG22 ' O ' ' A' ' 222' ' ' TRP . 6.5 t -66.81 -16.99 64.65 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.482 1.114 . . . . 65.150000000000006 110.375 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 226' ' ' ARG . . . . . 0.822 HH21 ' C ' ' A' ' 222' ' ' TRP . 0.0 OUTLIER -59.75 -34.3 72.79 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.537 1.148 . . . . 73.120000000000005 110.269 -179.933 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 227' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -76.01 -31.37 58.89 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.505 1.128 . . . . 75.400000000000006 109.331 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 228' ' ' MET . . . . . 0.444 ' CE ' ' HA ' ' A' ' 225' ' ' THR . 29.5 mtt -61.88 -46.57 88.85 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.551 1.157 . . . . 64.439999999999998 110.949 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 229' ' ' VAL . . . . . 0.565 HG13 ' O ' ' A' ' 225' ' ' THR . 1.2 m -69.97 -42.11 79.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.511 1.132 . . . . 54.450000000000003 109.259 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 230' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.14 -10.16 59.49 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.523 1.139 . . . . 75.120000000000005 110.306 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 32.3 ttt-85 -88.27 -83.31 0.22 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.567 1.167 . . . . 75.329999999999998 110.266 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -140.95 40.02 1.81 Allowed 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.539 1.149 . . . . 62.420000000000002 110.291 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.25 37.19 0.61 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.467 1.104 . . . . 73.430000000000007 111.006 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -45.39 153.99 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.515 1.134 . . . . 75.019999999999996 109.327 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.476 0 O-C-N 124.472 1.108 . . . . 71.150000000000006 109.264 -179.972 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.03 0 N-CA-C 110.988 -0.845 . . . . 72.200000000000003 110.988 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.97 151.77 40.06 Favored 'Trans proline' 0 C--N 1.359 1.088 0 O-C-N 124.567 1.825 . . . . 72.239999999999995 110.995 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.637 HD13 ' O ' ' A' ' 72' ' ' LEU . 1.4 tm? -94.08 -46.89 6.92 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.489 1.118 . . . . 71.340000000000003 109.311 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -125.57 109.96 1.25 Allowed Glycine 0 CA--C 1.531 1.047 0 O-C-N 124.492 1.12 . . . . 51.32 110.967 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 69.2 p -157.01 159.48 38.05 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.514 0.773 . . . . 45.329999999999998 109.971 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -40.93 124.41 2.15 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.45 1.094 . . . . 73.150000000000006 110.293 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -119.79 129.44 54.46 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.498 1.124 . . . . 62.229999999999997 110.294 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.491 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.5 p -134.24 158.61 42.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.494 1.122 . . . . 70.109999999999999 109.332 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.564 ' CE2' ' HD3' ' A' ' 108' ' ' PRO . 8.5 p90 -89.61 29.35 1.15 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.422 1.076 . . . . 63.450000000000003 110.99 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 5.8 tp -39.9 155.66 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.529 1.143 . . . . 74.140000000000001 109.328 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.814 ' HZ3' HG23 ' A' ' 106' ' ' ILE . 1.4 ttpt -95.69 -58.54 2.08 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.548 1.155 . . . . 72.030000000000001 109.31 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.825 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.2 OUTLIER -165.05 146.69 7.76 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.468 1.105 . . . . 61.340000000000003 111.056 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.635 HG21 ' CE ' ' A' ' 115' ' ' MET . 12.0 p -99.62 151.37 4.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.559 1.162 . . . . 64.430000000000007 109.335 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.864 HG23 ' HB ' ' A' ' 136' ' ' ILE . 4.6 mp -114.77 99.41 8.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.525 1.141 . . . . 74.099999999999994 109.268 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.019 HD11 ' HB1' ' A' ' 128' ' ' ALA . 1.9 mp -73.45 117.46 15.24 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.566 1.166 . . . . 65.200000000000003 109.31 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.792 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -135.58 166.49 23.1 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.531 1.144 . . . . 75.510000000000005 109.611 -179.999 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.453 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -105.03 155.61 18.81 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.566 1.166 . . . . 62.520000000000003 109.341 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -57.49 -17.03 11.4 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.536 1.148 . . . . 45.119999999999997 110.349 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -82.99 -43.16 16.71 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.465 1.103 . . . . 63.520000000000003 109.292 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.463 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -119.1 42.97 2.7 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.525 1.141 . . . . 72.430000000000007 109.306 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.594 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -80.62 -25.97 38.07 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.571 1.169 . . . . 64.310000000000002 110.409 179.979 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.441 ' O ' ' N ' ' A' ' 95' ' ' ARG . 0.8 OUTLIER -79.81 -35.44 38.43 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.477 1.111 . . . . 75.530000000000001 109.334 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.462 ' O ' ' N ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -62.75 -66.89 0.47 Allowed 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.499 1.124 . . . . 44.539999999999999 110.259 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.698 ' HB2' HD22 ' A' ' 138' ' ' LEU . . . -47.31 -36.89 9.92 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.523 1.139 . . . . 53.32 109.302 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.841 HD22 ' O ' ' A' ' 94' ' ' LEU . 0.1 OUTLIER -74.97 -33.39 61.88 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 124.483 1.115 . . . . 64.120000000000005 109.298 -179.966 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 92' ' ' GLU . 11.6 tpt180 -54.09 -46.67 72.13 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.515 1.135 . . . . 73.120000000000005 110.293 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.543 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 0.3 OUTLIER -76.21 -52.39 17.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.415 1.072 . . . . 71.319999999999993 109.327 179.978 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.543 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -48.15 -23.49 0.86 Allowed 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.521 1.138 . . . . 44.439999999999998 110.343 179.951 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -75.65 -38.59 58.72 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.557 1.161 . . . . 73.420000000000002 109.298 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.71 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -83.26 -21.67 33.26 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.515 1.134 . . . . 54.420000000000002 109.318 179.954 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.852 HD22 HG21 ' A' ' 206' ' ' VAL . 51.1 mt -61.97 -51.84 66.44 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.485 1.116 . . . . 74.099999999999994 109.285 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 16.7 pt20 -76.39 55.1 0.97 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.524 1.14 . . . . 73.430000000000007 110.281 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -179.71 -67.43 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.497 1.123 . . . . 74.329999999999998 109.318 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -40.73 -60.96 1.03 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.523 1.139 . . . . 65.120000000000005 109.36 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.48 ' CZ ' HG11 ' A' ' 206' ' ' VAL . 1.3 m-85 -104.25 -19.47 14.1 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.477 1.111 . . . . 43.409999999999997 110.977 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.06 45.18 4.22 Favored Glycine 0 CA--C 1.529 0.945 0 O-C-N 124.493 1.121 . . . . 73.239999999999995 111.042 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.814 HG23 ' HZ3' ' A' ' 80' ' ' LYS . 6.6 mm -85.29 86.36 2.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.436 0.727 . . . . 73.0 109.298 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.529 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -138.06 157.2 73.39 Favored Pre-proline 0 C--N 1.326 -0.454 0 O-C-N 124.475 1.11 . . . . 74.200000000000003 109.322 179.951 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.564 ' HD3' ' CE2' ' A' ' 78' ' ' PHE . 18.0 Cg_endo -75.12 150.17 94.83 Favored 'Cis proline' 0 C--N 1.36 1.141 0 C-N-CA 120.938 -2.526 . . . . 75.420000000000002 110.987 0.173 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -122.65 137.73 11.44 Favored Glycine 0 CA--C 1.53 1.0 0 O-C-N 124.484 1.115 . . . . 73.349999999999994 110.955 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 1.2 tt -153.72 148.26 13.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.516 0.774 . . . . 73.299999999999997 109.334 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.792 HD12 ' NE2' ' A' ' 85' ' ' HIS . 32.4 pt -101.39 161.45 3.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.482 1.114 . . . . 73.019999999999996 109.272 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -61.55 -19.6 62.33 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.46 1.1 . . . . 73.329999999999998 110.95 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.429 ' HB2' ' HE1' ' A' ' 85' ' ' HIS . . . -87.64 -12.41 45.59 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.536 1.148 . . . . 71.299999999999997 109.304 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -103.83 -17.49 15.03 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.528 1.142 . . . . 64.310000000000002 110.276 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.635 ' CE ' HG21 ' A' ' 82' ' ' VAL . 9.1 ttm -50.84 143.52 14.93 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.523 1.139 . . . . 71.209999999999994 110.996 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.459 ' HD2' ' CG ' ' A' ' 115' ' ' MET . 18.1 Cg_endo -75.03 -10.11 21.02 Favored 'Trans proline' 0 C--N 1.359 1.13 0 O-C-N 124.532 1.806 . . . . 72.25 111.057 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -50.05 -50.39 47.89 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 124.444 1.09 . . . . 60.310000000000002 109.62 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 107.59 164.2 21.66 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.499 1.124 . . . . 32.450000000000003 110.958 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 43.8 mtp180 -97.26 13.07 30.74 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.537 0.787 . . . . 63.229999999999997 110.254 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -63.52 -45.59 89.92 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.431 1.082 . . . . 73.420000000000002 110.276 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -156.11 114.98 3.46 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.535 1.147 . . . . 65.430000000000007 109.598 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.774 HD13 ' N ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -110.62 60.11 0.61 Allowed 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.49 1.118 . . . . 75.25 109.297 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -116.52 44.51 1.99 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.466 1.104 . . . . 74.310000000000002 110.286 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 58.2 m-20 -140.94 107.21 5.24 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.529 1.143 . . . . 52.240000000000002 109.286 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.802 HD11 ' HB3' ' A' ' 150' ' ' ASN . 2.9 mt -84.12 -54.05 5.1 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.622 1.202 . . . . 70.099999999999994 109.339 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.474 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 0.2 OUTLIER -40.31 -44.23 1.88 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.49 1.119 . . . . 64.519999999999996 109.278 -179.995 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -50.07 -49.68 50.54 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.477 1.11 . . . . 55.310000000000002 109.362 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 1.019 ' HB1' HD11 ' A' ' 84' ' ' LEU . . . -68.87 -38.56 79.8 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.53 1.144 . . . . 73.209999999999994 109.324 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.712 HG12 ' O ' ' A' ' 129' ' ' VAL . 86.9 t -92.93 30.64 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.462 1.101 . . . . 74.400000000000006 109.288 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.474 ' CB ' ' O ' ' A' ' 126' ' ' ASP . 6.2 t30 -138.47 152.3 48.18 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.437 1.086 . . . . 75.439999999999998 109.296 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 51.35 53.51 27.83 Favored Glycine 0 CA--C 1.53 0.983 0 O-C-N 124.448 1.092 . . . . 31.41 110.982 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 1.2 p -163.4 -179.73 6.74 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.501 0.766 . . . . 74.430000000000007 109.974 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.85 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -104.25 -46.26 4.46 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.524 1.14 . . . . 33.340000000000003 109.29 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.85 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 0.5 OUTLIER -145.51 174.29 11.28 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.567 1.167 . . . . 73.439999999999998 108.042 -179.978 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.447 HG22 ' CG1' ' A' ' 82' ' ' VAL . 2.4 p -139.22 129.18 25.01 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.497 1.123 . . . . 63.299999999999997 110.387 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.864 ' HB ' HG23 ' A' ' 83' ' ' ILE . 15.0 mm -84.4 95.0 3.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.393 1.058 . . . . 52.439999999999998 109.292 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 13.2 mt -82.69 94.19 7.53 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.486 1.116 . . . . 71.420000000000002 109.344 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.698 HD22 ' HB2' ' A' ' 93' ' ' ALA . 3.3 tp -61.3 97.71 0.07 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.513 1.133 . . . . 62.420000000000002 109.345 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.748 HD11 HD13 ' A' ' 189' ' ' LEU . 2.0 tp -70.22 105.75 3.07 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.478 1.112 . . . . 74.129999999999995 109.296 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 4.8 m -133.63 154.88 50.56 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.471 1.107 . . . . 54.43 110.389 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -49.96 -39.1 39.59 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.546 1.154 . . . . 74.019999999999996 110.302 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -89.0 -53.89 4.38 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.53 1.144 . . . . 55.32 109.318 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.59 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 16.8 t80 -51.19 -20.53 1.59 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.521 1.138 . . . . 73.109999999999999 111.044 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.694 ' C ' HD13 ' A' ' 144' ' ' LEU . 2.0 tm? -60.85 -68.06 0.34 Allowed 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.45 1.094 . . . . 70.549999999999997 109.336 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.544 HH11 HD12 ' A' ' 144' ' ' LEU . 2.0 mpt_? -67.52 -12.21 59.81 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.462 1.101 . . . . 75.040000000000006 110.3 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 146' ' ' ASP . . . . . 0.4 ' O ' ' CG ' ' A' ' 150' ' ' ASN . 27.6 t0 -65.84 -61.45 2.05 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.563 1.164 . . . . 73.430000000000007 109.303 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.666 HG23 ' CZ ' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -88.23 -46.5 9.19 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.554 1.159 . . . . 62.539999999999999 110.407 -179.981 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.519 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 32.1 t-105 -44.52 -34.4 2.09 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.522 1.139 . . . . 61.020000000000003 107.979 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 149' ' ' CYS . . . . . 0.451 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 42.3 t -77.87 -45.43 24.24 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.502 1.126 . . . . 62.130000000000003 108.304 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 150' ' ' ASN . . . . . 0.802 ' HB3' HD11 ' A' ' 125' ' ' LEU . 6.6 m120 -62.51 -16.93 58.41 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.446 1.091 . . . . 74.430000000000007 109.306 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.871 ' CD1' HD21 ' A' ' 157' ' ' LEU . 8.7 m-30 -82.19 -47.8 12.05 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.515 1.135 . . . . 71.409999999999997 111.063 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -48.15 -39.83 21.93 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.499 1.124 . . . . 74.040000000000006 110.291 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -83.96 -23.23 31.18 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.47 1.106 . . . . 74.519999999999996 110.924 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.534 ' CE2' ' HB2' ' A' ' 156' ' ' SER . 5.6 t80 -129.13 97.99 4.78 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.467 1.105 . . . . 63.039999999999999 111.016 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.45 -2.7 57.64 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.523 1.139 . . . . 74.5 110.411 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 156' ' ' SER . . . . . 0.534 ' HB2' ' CE2' ' A' ' 154' ' ' TYR . 1.8 m -53.88 -38.23 64.53 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.513 1.133 . . . . 73.219999999999999 110.01 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.871 HD21 ' CD1' ' A' ' 151' ' ' PHE . 2.3 pp -89.58 -27.66 20.08 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.451 1.094 . . . . 75.109999999999999 109.315 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 158' ' ' MET . . . . . 0.427 ' HE2' ' HA ' ' A' ' 158' ' ' MET . 12.4 tpp -54.66 -26.28 32.28 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.487 1.117 . . . . 64.340000000000003 110.972 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 54.6 m-80 -66.56 -31.17 71.7 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.559 1.162 . . . . 74.120000000000005 109.322 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.462 ' HB3' ' CG2' ' A' ' 170' ' ' VAL . 0.3 OUTLIER -74.86 -28.15 60.55 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.521 1.138 . . . . 75.030000000000001 110.077 179.922 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 161' ' ' VAL . . . . . 0.771 HG13 HD11 ' A' ' 192' ' ' ILE . 82.4 t -57.39 -17.85 7.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.487 1.117 . . . . 74.310000000000002 109.348 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -91.42 35.71 0.94 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.622 1.201 . . . . 73.299999999999997 109.211 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.457 ' CD ' HG12 ' A' ' 192' ' ' ILE . 0.0 OUTLIER 47.34 32.44 2.22 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.49 1.119 . . . . 70.040000000000006 110.294 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -56.42 129.01 38.8 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.469 1.106 . . . . 71.420000000000002 110.261 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.412 ' NE2' HG21 ' A' ' 217' ' ' THR . 59.1 t60 -85.97 48.57 1.63 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.507 1.129 . . . . 74.439999999999998 109.589 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 3.0 tptp -95.63 171.89 8.39 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.506 1.129 . . . . 75.129999999999995 109.204 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 167' ' ' TYR . . . . . 0.787 ' CE2' ' CD1' ' A' ' 222' ' ' TRP . 3.4 t80 -38.45 -64.49 0.42 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.501 1.125 . . . . 64.319999999999993 111.075 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -90.78 133.07 35.47 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.428 1.08 . . . . 70.519999999999996 109.271 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.454 ' N ' ' O ' ' A' ' 133' ' ' ALA . 1.8 t -108.78 177.24 4.83 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.569 1.168 . . . . 65.439999999999998 109.98 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.725 ' C ' HD12 ' A' ' 171' ' ' ILE . 3.2 t -137.36 103.36 2.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.498 1.124 . . . . 75.310000000000002 109.279 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.725 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -121.95 99.95 43.57 Favored Pre-proline 0 C--N 1.324 -0.513 0 O-C-N 124.527 1.142 . . . . 62.200000000000003 109.274 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 172' ' ' PRO . . . . . 0.657 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.3 Cg_endo -75.03 118.85 5.4 Favored 'Trans proline' 0 C--N 1.36 1.178 0 O-C-N 124.444 1.76 . . . . 73.439999999999998 110.98 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 173' ' ' MET . . . . . 0.586 ' HB2' HG23 ' A' ' 136' ' ' ILE . 4.1 ttt -89.09 151.64 22.11 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.471 1.107 . . . . 54.329999999999998 110.962 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 174' ' ' ARG . . . . . 0.555 ' NH2' ' H ' ' A' ' 180' ' ' LEU . 0.2 OUTLIER -105.68 117.52 57.71 Favored Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.469 1.105 . . . . 65.329999999999998 110.286 -179.991 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 175' ' ' PRO . . . . . 0.509 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -75.04 150.0 37.34 Favored 'Trans proline' 0 C--N 1.359 1.112 0 O-C-N 124.515 1.797 . . . . 60.100000000000001 110.99 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.797 HD11 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -88.64 -38.86 14.48 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.528 1.142 . . . . 72.129999999999995 109.331 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -72.78 -26.48 61.55 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.459 1.099 . . . . 74.420000000000002 109.255 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 178' ' ' ASN . . . . . 0.437 ' O ' ' NH2' ' A' ' 174' ' ' ARG . 4.0 m-80 -110.76 103.03 53.9 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.55 1.156 . . . . 60.329999999999998 109.297 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.05 115.65 4.34 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.543 1.812 . . . . 71.140000000000001 110.963 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.555 ' H ' ' NH2' ' A' ' 174' ' ' ARG . 0.4 OUTLIER -116.98 97.09 50.28 Favored Pre-proline 0 C--N 1.325 -0.484 0 O-C-N 124.557 1.161 . . . . 52.229999999999997 109.3 179.969 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 164.51 33.22 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.467 1.772 . . . . 75.219999999999999 111.016 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 59.4 mtt180 -67.13 -16.64 64.45 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.544 1.152 . . . . 72.310000000000002 110.335 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -74.81 -17.09 60.67 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.512 1.133 . . . . 65.400000000000006 110.342 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -117.41 16.69 14.71 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.525 1.141 . . . . 73.409999999999997 110.357 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 185' ' ' THR . . . . . 0.498 ' OG1' ' CD1' ' A' ' 180' ' ' LEU . 19.1 m -116.86 143.6 31.82 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.456 1.098 . . . . 73.239999999999995 110.435 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 186' ' ' PRO . . . . . 0.828 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.5 Cg_endo -75.04 155.99 42.77 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.539 1.81 . . . . 73.540000000000006 111.022 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 187' ' ' PHE . . . . . 0.503 ' O ' ' CG2' ' A' ' 191' ' ' THR . 37.9 p90 -69.74 -7.26 37.95 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.516 1.135 . . . . 72.340000000000003 110.956 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.87 -52.74 4.29 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.502 1.126 . . . . 70.299999999999997 109.312 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.875 ' HA ' HD12 ' A' ' 192' ' ' ILE . 43.4 mt -68.45 -42.31 78.99 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.521 1.138 . . . . 73.420000000000002 109.29 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 190' ' ' GLN . . . . . 0.409 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 6.9 pt20 -63.98 -10.76 23.35 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.46 1.1 . . . . 75.400000000000006 110.344 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 191' ' ' THR . . . . . 0.503 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 35.7 p -113.64 19.92 16.37 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.535 1.147 . . . . 75.239999999999995 110.383 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.875 HD12 ' HA ' ' A' ' 189' ' ' LEU . 28.1 mt -113.28 160.64 12.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.486 1.116 . . . . 71.030000000000001 109.262 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 193' ' ' ASN . . . . . 0.533 ' ND2' ' OE1' ' A' ' 205' ' ' GLN . 4.3 t-20 -76.39 62.88 1.89 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.502 1.127 . . . . 71.439999999999998 109.301 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 194' ' ' ALA . . . . . 0.657 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -56.96 143.41 38.03 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.441 1.088 . . . . 53.109999999999999 109.308 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 195' ' ' LEU . . . . . 0.548 HD12 ' CE ' ' A' ' 173' ' ' MET . 0.7 OUTLIER -80.26 123.49 28.01 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.47 1.106 . . . . 71.450000000000003 109.27 -179.926 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 196' ' ' GLU . . . . . 0.407 ' O ' ' HA ' ' A' ' 202' ' ' PHE . 14.1 mt-10 -103.43 137.5 41.44 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.453 1.096 . . . . 73.319999999999993 110.294 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.797 ' HG3' HD11 ' A' ' 176' ' ' LEU . 0.6 OUTLIER -113.71 -24.73 9.02 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.552 1.157 . . . . 74.209999999999994 110.292 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 198' ' ' GLU . . . . . 0.573 ' HG2' HD12 ' A' ' 176' ' ' LEU . 6.5 pt-20 -102.51 21.72 14.75 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.518 1.136 . . . . 62.109999999999999 110.269 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -117.34 162.99 17.02 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 124.513 1.133 . . . . 63.399999999999999 110.014 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 21.5 ttt-85 -64.88 -42.77 94.55 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.499 1.124 . . . . 71.239999999999995 110.316 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -90.9 41.62 2.91 Favored Glycine 0 CA--C 1.531 1.072 0 O-C-N 124.475 1.11 . . . . 71.329999999999998 110.97 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 202' ' ' PHE . . . . . 0.611 ' CD1' ' C ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -77.63 -47.71 2.36 Favored Pre-proline 0 C--N 1.325 -0.495 0 O-C-N 124.555 0.797 . . . . 71.230000000000004 110.974 -179.983 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 203' ' ' PRO . . . . . 0.654 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.5 Cg_endo -75.02 -25.94 11.35 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.528 1.804 . . . . 73.209999999999994 111.053 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 204' ' ' THR . . . . . 0.453 ' O ' ' HB2' ' A' ' 207' ' ' GLU . 0.8 OUTLIER -61.69 -55.45 30.31 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.572 1.17 . . . . 54.030000000000001 110.407 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 205' ' ' GLN . . . . . 0.533 ' OE1' ' ND2' ' A' ' 193' ' ' ASN . 2.1 mt-30 -54.55 -62.43 1.66 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.599 1.187 . . . . 75.109999999999999 110.377 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 206' ' ' VAL . . . . . 0.852 HG21 HD22 ' A' ' 100' ' ' LEU . 3.2 p -40.75 -30.98 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.518 1.136 . . . . 71.439999999999998 109.351 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 207' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 204' ' ' THR . 0.9 OUTLIER -79.56 -65.88 0.94 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.516 1.135 . . . . 72.209999999999994 110.302 179.969 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 208' ' ' ARG . . . . . 0.429 ' HD3' ' O ' ' A' ' 204' ' ' THR . 4.8 mpt_? -46.13 -58.0 4.01 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.507 1.129 . . . . 74.319999999999993 110.264 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 209' ' ' ILE . . . . . 0.575 HG22 ' CD1' ' A' ' 210' ' ' PHE . 15.3 mt -54.57 -66.43 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 O-C-N 124.474 1.109 . . . . 65.040000000000006 109.26 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 210' ' ' PHE . . . . . 0.583 ' CD2' HG23 ' A' ' 206' ' ' VAL . 0.4 OUTLIER -90.06 65.95 6.64 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.493 1.121 . . . . 65.510000000000005 111.024 -179.986 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 211' ' ' GLN . . . . . 0.434 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.1 OUTLIER -110.31 146.35 35.88 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.595 1.184 . . . . 72.230000000000004 110.297 -179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.458 ' O ' ' N ' ' A' ' 215' ' ' TYR . 22.8 tt0 -48.88 -55.48 11.6 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 124.441 1.088 . . . . 72.0 110.293 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.41 -24.09 1.14 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.48 1.112 . . . . 74.129999999999995 109.993 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.434 HG23 ' HG2' ' A' ' 211' ' ' GLN . 24.1 t -96.16 -28.46 3.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.559 1.162 . . . . 73.109999999999999 109.297 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 215' ' ' TYR . . . . . 0.458 ' N ' ' O ' ' A' ' 212' ' ' GLU . 12.8 t80 -64.92 -23.41 67.22 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.524 1.14 . . . . 72.209999999999994 111.006 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -66.19 0.58 Allowed 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.525 1.141 . . . . 52.240000000000002 109.264 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 217' ' ' THR . . . . . 0.992 HG22 HD11 ' A' ' 221' ' ' ILE . 25.7 m -41.1 -66.12 0.36 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.514 1.134 . . . . 51.43 110.372 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 218' ' ' GLN . . . . . 0.511 ' HA ' HD12 ' A' ' 221' ' ' ILE . 0.0 OUTLIER -39.66 -53.56 2.15 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.408 1.068 . . . . 61.5 110.292 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 11.8 tp60 -53.92 -53.8 47.63 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.496 1.123 . . . . 64.200000000000003 110.261 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 220' ' ' THR . . . . . 0.428 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 1.3 m -62.87 -19.21 63.92 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.498 1.124 . . . . 64.400000000000006 110.438 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 221' ' ' ILE . . . . . 0.992 HD11 HG22 ' A' ' 217' ' ' THR . 56.3 mt -83.62 -25.36 7.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.525 1.141 . . . . 73.310000000000002 109.328 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 222' ' ' TRP . . . . . 0.787 ' CD1' ' CE2' ' A' ' 167' ' ' TYR . 6.9 t90 -78.13 -43.36 29.06 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.54 1.15 . . . . 73.150000000000006 107.999 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 223' ' ' LYS . . . . . 0.428 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -68.39 -33.57 74.47 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.542 1.151 . . . . 70.019999999999996 109.313 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 224' ' ' GLU . . . . . 0.414 ' N ' ' HD3' ' A' ' 223' ' ' LYS . 1.8 mm-40 -68.7 -41.22 79.45 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.538 1.149 . . . . 71.200000000000003 110.367 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.566 ' O ' HG13 ' A' ' 229' ' ' VAL . 3.0 t -75.61 -7.89 55.39 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.456 1.098 . . . . 75.430000000000007 110.379 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 12.0 mtp85 -84.82 -20.17 31.35 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.491 1.12 . . . . 74.319999999999993 110.26 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 227' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -91.72 -42.71 9.99 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.546 1.154 . . . . 74.329999999999998 109.312 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 228' ' ' MET . . . . . 0.409 ' HG3' ' N ' ' A' ' 229' ' ' VAL . 7.2 ptp -60.09 -37.24 79.37 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.503 1.127 . . . . 74.25 111.049 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 229' ' ' VAL . . . . . 0.566 HG13 ' O ' ' A' ' 225' ' ' THR . 32.0 m -75.01 -46.76 39.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 O-C-N 124.438 1.086 . . . . 73.340000000000003 109.37 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 230' ' ' GLN . . . . . 0.408 ' N ' HG23 ' A' ' 229' ' ' VAL . 4.1 tp-100 -69.24 -10.31 57.19 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.472 1.108 . . . . 71.519999999999996 110.28 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -92.61 -81.02 0.36 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.472 1.107 . . . . 75.040000000000006 110.25 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -145.12 56.49 1.25 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.454 1.096 . . . . 71.299999999999997 110.294 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -167.66 176.6 6.32 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.518 1.136 . . . . 70.349999999999994 111.032 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.449 HD12 HD23 ' A' ' 72' ' ' LEU . 5.1 mm -130.8 143.91 39.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.557 1.161 . . . . 75.219999999999999 109.348 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 235' ' ' ALA . . . . . 0.421 ' HB2' HG11 ' A' ' 229' ' ' VAL . . . . . . . . 0 C--N 1.325 -0.462 0 O-C-N 124.522 1.139 . . . . 64.299999999999997 109.316 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.012 0 N-CA-C 111.011 -0.836 . . . . 72.140000000000001 111.011 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.03 170.32 20.67 Favored 'Trans proline' 0 C--N 1.36 1.145 0 O-C-N 124.499 1.789 . . . . 75.219999999999999 111.012 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.409 ' O ' HD13 ' A' ' 72' ' ' LEU . 1.1 tm? -114.65 -49.65 2.81 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.564 1.165 . . . . 63.219999999999999 109.33 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -104.75 -61.25 0.65 Allowed Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.529 1.143 . . . . 42.210000000000001 111.013 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.4 m -42.66 162.72 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.477 0.751 . . . . 53.109999999999999 110.002 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -94.69 148.2 22.52 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.499 1.125 . . . . 74.109999999999999 110.32 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.484 ' OE2' ' CH2' ' A' ' 222' ' ' TRP . 2.8 tt0 -130.55 129.3 42.64 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.52 1.137 . . . . 70.140000000000001 110.319 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.471 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 4.2 p -130.79 154.05 40.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.474 1.109 . . . . 73.129999999999995 109.254 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.411 ' O ' ' C ' ' A' ' 79' ' ' LEU . 20.0 m-85 -88.39 26.88 1.34 Allowed 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.527 1.142 . . . . 74.310000000000002 110.989 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.618 HD23 ' OG ' ' A' ' 132' ' ' SER . 12.4 tp -39.65 152.05 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.497 1.123 . . . . 73.109999999999999 109.337 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.586 ' NZ ' HG23 ' A' ' 106' ' ' ILE . 1.4 ttpt -90.09 -60.4 1.94 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.553 1.158 . . . . 73.25 109.337 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.668 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.6 OUTLIER -161.28 131.61 5.05 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.515 1.134 . . . . 75.409999999999997 111.014 179.968 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.557 HG11 ' HA ' ' A' ' 128' ' ' ALA . 11.6 p -84.73 162.36 2.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 124.463 1.102 . . . . 65.209999999999994 109.29 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.668 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 4.9 mp -125.41 96.25 3.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.48 1.113 . . . . 71.040000000000006 109.274 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.436 ' O ' ' O ' ' A' ' 136' ' ' ILE . 6.8 mt -69.87 123.55 21.77 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.532 1.145 . . . . 74.430000000000007 109.292 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.743 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -146.15 174.46 11.29 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.513 1.133 . . . . 75.299999999999997 109.59 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.468 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -127.91 152.3 48.03 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.509 1.13 . . . . 74.140000000000001 109.366 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -46.31 -24.25 0.46 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.516 1.135 . . . . 75.349999999999994 110.305 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -63.45 -46.52 85.87 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.469 1.106 . . . . 73.209999999999994 109.267 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.424 ' OD1' ' N ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -134.91 44.81 2.59 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.435 1.085 . . . . 74.409999999999997 109.307 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.628 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -75.18 -26.58 59.15 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.567 1.167 . . . . 73.310000000000002 110.417 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -82.43 -21.44 35.71 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.576 1.172 . . . . 73.200000000000003 109.314 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.3 -54.89 6.13 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.597 1.185 . . . . 71.319999999999993 110.261 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.734 ' HB2' HD22 ' A' ' 138' ' ' LEU . . . -59.06 -30.48 68.09 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.495 1.122 . . . . 52.140000000000001 109.371 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.783 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -78.62 -51.6 9.65 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.481 1.113 . . . . 62.210000000000001 109.326 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.725 ' N ' HD13 ' A' ' 94' ' ' LEU . 2.2 tmt_? -41.19 -43.19 2.26 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.573 1.17 . . . . 74.549999999999997 110.264 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.55 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 0.3 OUTLIER -75.57 -52.96 16.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.479 1.112 . . . . 73.329999999999998 109.259 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.55 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -48.87 -20.89 0.55 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.436 1.085 . . . . 73.400000000000006 110.304 -179.988 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.41 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.1 OUTLIER -79.82 -41.2 26.89 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.555 1.16 . . . . 64.120000000000005 109.235 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.706 HD21 ' HZ ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -77.97 -22.09 49.96 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.44 1.088 . . . . 71.209999999999994 109.29 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.705 ' N ' HD23 ' A' ' 99' ' ' LEU . 36.8 mt -67.62 -44.72 77.35 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.513 1.133 . . . . 73.510000000000005 109.299 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -82.04 49.62 1.42 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.443 1.089 . . . . 65.120000000000005 110.237 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -174.44 -64.95 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.571 1.169 . . . . 74.140000000000001 109.294 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -41.56 -52.4 3.73 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.495 1.122 . . . . 70.129999999999995 109.241 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -111.03 -30.03 7.66 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.537 1.148 . . . . 71.409999999999997 110.995 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.464 ' O ' ' CD ' ' A' ' 107' ' ' LYS . . . 109.1 26.97 5.01 Favored Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.581 1.176 . . . . 55.420000000000002 110.979 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.586 HG23 ' NZ ' ' A' ' 80' ' ' LYS . 25.4 mm -70.82 95.42 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 O-C-N 124.473 0.749 . . . . 74.310000000000002 109.257 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.506 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -142.02 158.48 61.76 Favored Pre-proline 0 C--N 1.326 -0.451 0 O-C-N 124.487 1.117 . . . . 73.120000000000005 109.313 179.968 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.506 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.01 161.68 94.36 Favored 'Cis proline' 0 C--N 1.36 1.171 0 C-N-CA 121.009 -2.496 . . . . 73.530000000000001 111.011 0.057 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -117.29 112.12 2.41 Favored Glycine 0 CA--C 1.529 0.948 0 O-C-N 124.46 1.1 . . . . 73.230000000000004 111.009 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.402 HD11 ' C ' ' A' ' 114' ' ' GLU . 0.1 OUTLIER -135.84 128.81 47.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.44 0.729 . . . . 63.520000000000003 109.289 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.743 HD12 ' NE2' ' A' ' 85' ' ' HIS . 43.4 pt -91.44 -176.59 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.528 1.143 . . . . 63.509999999999998 109.306 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -81.67 -19.99 40.5 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.474 1.109 . . . . 52.100000000000001 110.942 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -90.49 -3.45 57.63 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.496 1.122 . . . . 75.140000000000001 109.289 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.402 ' C ' HD11 ' A' ' 110' ' ' ILE . 4.4 mm-40 -110.23 -26.58 9.55 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.577 1.173 . . . . 70.540000000000006 110.306 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 26.8 tpp -38.77 110.88 0.6 Allowed Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.512 1.132 . . . . 73.120000000000005 110.995 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 67.24 5.99 Favored 'Trans proline' 0 C--N 1.36 1.141 0 O-C-N 124.481 1.78 . . . . 63.520000000000003 110.951 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -107.39 12.96 27.48 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.531 1.144 . . . . 73.200000000000003 109.569 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 87.44 -119.6 5.3 Favored Glycine 0 CA--C 1.53 1.0 0 O-C-N 124.482 1.114 . . . . 23.329999999999998 111.038 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.23 142.46 7.21 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.516 0.774 . . . . 64.329999999999998 110.236 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.404 ' HG2' ' N ' ' A' ' 121' ' ' HIS . 0.3 OUTLIER -61.41 -28.52 69.32 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.44 1.087 . . . . 63.130000000000003 110.365 179.945 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 121' ' ' HIS . . . . . 0.404 ' N ' ' HG2' ' A' ' 120' ' ' GLN . 10.8 t-80 -53.33 96.2 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.481 1.113 . . . . 73.319999999999993 109.55 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.621 HD22 ' C ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -45.63 148.41 0.73 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.484 1.115 . . . . 72.25 109.269 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -77.27 -59.29 2.84 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.477 1.111 . . . . 75.430000000000007 110.386 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -173.16 -175.58 1.22 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.533 1.146 . . . . 74.239999999999995 109.31 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.69 HD13 ' OH ' ' A' ' 154' ' ' TYR . 0.3 OUTLIER -84.47 -50.87 7.36 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.543 1.152 . . . . 74.439999999999998 109.287 -179.945 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.4 ' C ' ' O ' ' A' ' 125' ' ' LEU . 0.7 OUTLIER -40.14 -30.02 0.09 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.557 1.161 . . . . 53.210000000000001 109.36 179.987 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.434 ' N ' ' C ' ' A' ' 125' ' ' LEU . 1.0 OUTLIER -57.78 -53.42 58.37 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.474 1.109 . . . . 71.510000000000005 109.316 179.919 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.557 ' HA ' HG11 ' A' ' 82' ' ' VAL . . . -67.21 -25.13 65.96 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.573 1.17 . . . . 72.109999999999999 109.298 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.609 ' O ' HG12 ' A' ' 129' ' ' VAL . 67.2 t -89.99 15.62 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.429 1.08 . . . . 73.319999999999993 109.263 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.406 ' O ' ' C ' ' A' ' 131' ' ' GLY . 3.9 m-20 -129.85 165.79 21.3 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.519 1.137 . . . . 74.329999999999998 109.276 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' GLY . . . . . 0.406 ' C ' ' O ' ' A' ' 130' ' ' ASN . . . 37.15 54.43 1.56 Allowed Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.448 1.093 . . . . 65.400000000000006 111.027 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' SER . . . . . 0.618 ' OG ' HD23 ' A' ' 79' ' ' LEU . 7.8 m -163.33 174.23 12.26 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.484 0.755 . . . . 73.230000000000004 110.022 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.871 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -105.45 -28.12 11.03 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.537 1.148 . . . . 62.200000000000003 109.258 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.871 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.1 m-90 -161.95 178.71 8.64 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.974 -1.121 . . . . 74.129999999999995 107.974 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.47 ' OG1' ' HA ' ' A' ' 170' ' ' VAL . 74.8 p -147.64 135.46 21.1 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.464 1.103 . . . . 44.350000000000001 110.359 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.638 ' HB ' HG23 ' A' ' 83' ' ' ILE . 6.9 mm -84.18 97.76 5.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 124.49 1.119 . . . . 73.340000000000003 109.304 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.527 ' O ' HD13 ' A' ' 139' ' ' LEU . 3.0 mm? -77.89 87.41 4.09 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.499 1.125 . . . . 54.439999999999998 109.374 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.734 HD22 ' HB2' ' A' ' 93' ' ' ALA . 2.3 tp -62.07 103.12 0.34 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.514 1.134 . . . . 72.209999999999994 109.318 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.527 HD13 ' O ' ' A' ' 137' ' ' LEU . 0.0 OUTLIER -75.25 106.46 6.78 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.435 1.085 . . . . 74.299999999999997 109.328 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.503 ' O ' ' CB ' ' A' ' 144' ' ' LEU . 2.5 m -135.24 162.64 31.98 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.344 1.027 . . . . 62.119999999999997 110.459 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -63.44 -34.8 78.54 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.507 1.129 . . . . 73.329999999999998 110.227 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ASN . . . . . 0.403 ' ND2' ' H ' ' A' ' 143' ' ' PHE . 2.2 p-10 -89.35 -53.34 4.59 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.569 1.168 . . . . 71.340000000000003 109.262 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.592 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 31.2 t80 -53.32 -36.88 61.75 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.528 1.143 . . . . 52.219999999999999 110.958 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.699 HD13 ' C ' ' A' ' 144' ' ' LEU . 2.1 tm? -60.81 -68.15 0.33 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.471 1.107 . . . . 73.120000000000005 109.293 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.517 ' N ' HD13 ' A' ' 144' ' ' LEU . 6.8 mmt85 -55.01 -18.97 5.84 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.461 1.101 . . . . 65.25 110.344 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -75.57 -73.12 0.27 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.504 1.128 . . . . 71.310000000000002 109.253 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.51 ' CG2' ' N ' ' A' ' 148' ' ' TRP . 1.2 t -65.79 -52.02 54.25 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.502 1.126 . . . . 72.120000000000005 110.317 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.585 ' HB2' HD22 ' A' ' 144' ' ' LEU . 22.7 t-105 -43.5 -50.99 6.95 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.578 1.174 . . . . 74.219999999999999 107.971 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 149' ' ' CYS . . . . . 0.404 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 4.6 t -47.31 -45.86 24.74 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.482 1.114 . . . . 75.150000000000006 108.329 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 150' ' ' ASN . . . . . 0.455 ' N ' ' O ' ' A' ' 147' ' ' THR . 23.3 m120 -64.36 -56.66 12.86 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.458 1.099 . . . . 72.099999999999994 109.316 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 1.004 ' CZ ' HD22 ' A' ' 157' ' ' LEU . 8.6 m-30 -42.93 -38.05 2.08 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.492 1.12 . . . . 73.109999999999999 111.005 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -61.29 -45.02 96.2 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.54 1.15 . . . . 72.140000000000001 110.261 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.433 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 1.7 t80 -56.6 -25.68 53.49 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.518 1.136 . . . . 73.420000000000002 110.986 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.69 ' OH ' HD13 ' A' ' 125' ' ' LEU . 20.3 p90 -163.61 125.43 2.43 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.45 1.094 . . . . 75.530000000000001 110.982 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.517 HG23 ' OD1' ' A' ' 159' ' ' ASN . 6.3 t -70.39 -6.07 32.88 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.505 1.128 . . . . 74.439999999999998 110.47 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 1.6 m -39.51 -63.65 0.55 Allowed 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.493 1.121 . . . . 55.310000000000002 109.948 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 1.004 HD22 ' CZ ' ' A' ' 151' ' ' PHE . 2.9 tt -64.89 -40.28 94.84 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.514 1.133 . . . . 74.439999999999998 109.281 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 158' ' ' MET . . . . . 0.567 ' CE ' HG21 ' A' ' 161' ' ' VAL . 3.4 tpt -58.76 -15.18 11.0 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.494 1.121 . . . . 73.420000000000002 111.027 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 159' ' ' ASN . . . . . 0.517 ' OD1' HG23 ' A' ' 155' ' ' THR . 37.7 m-20 -81.59 -44.89 16.63 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.44 1.087 . . . . 72.150000000000006 109.339 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.63 -20.63 61.26 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.466 1.104 . . . . 70.019999999999996 110.069 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 161' ' ' VAL . . . . . 0.812 ' O ' HD13 ' A' ' 192' ' ' ILE . 4.4 t -64.21 -18.01 22.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.571 1.17 . . . . 75.200000000000003 109.34 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -86.48 10.23 15.85 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.467 1.104 . . . . 73.299999999999997 109.3 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.61 ' CZ ' HG23 ' A' ' 192' ' ' ILE . 0.7 OUTLIER 53.29 63.63 2.15 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.54 1.15 . . . . 75.540000000000006 110.32 179.97 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 164' ' ' GLN . . . . . 0.414 ' NE2' ' HB3' ' A' ' 159' ' ' ASN . 19.7 mt-30 -62.35 -174.49 0.06 Allowed 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.552 1.157 . . . . 73.430000000000007 110.222 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -99.77 38.26 1.48 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.52 1.138 . . . . 72.239999999999995 109.567 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -100.9 162.26 13.03 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.586 1.178 . . . . 70.420000000000002 109.284 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 167' ' ' TYR . . . . . 0.527 ' CD1' ' C ' ' A' ' 167' ' ' TYR . 3.2 p90 -66.89 -9.09 34.29 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 124.402 1.064 . . . . 71.140000000000001 111.014 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.438 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 0.1 OUTLIER -112.01 130.13 55.97 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.506 1.129 . . . . 75.349999999999994 109.32 -179.967 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.496 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 1.2 m -128.53 172.93 10.7 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.511 1.132 . . . . 74.219999999999999 109.997 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.503 ' O ' HD13 ' A' ' 171' ' ' ILE . 0.9 OUTLIER -151.95 119.87 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.412 1.07 . . . . 73.129999999999995 109.284 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.61 HG22 ' HB2' ' A' ' 195' ' ' LEU . 11.5 mm -111.29 121.0 41.57 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 124.576 1.173 . . . . 51.399999999999999 109.308 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 172' ' ' PRO . . . . . 0.723 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.92 106.9 2.36 Favored 'Trans proline' 0 C--N 1.36 1.139 0 O-C-N 124.479 1.779 . . . . 53.409999999999997 110.997 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 173' ' ' MET . . . . . 0.589 ' HE2' ' HG2' ' A' ' 197' ' ' GLU . 4.0 ttt -94.22 153.5 18.03 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.481 1.113 . . . . 74.030000000000001 110.989 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 174' ' ' ARG . . . . . 0.436 ' N ' ' HG2' ' A' ' 173' ' ' MET . 41.8 ttm-85 -114.39 126.28 28.17 Favored Pre-proline 0 C--N 1.326 -0.448 0 O-C-N 124.477 1.11 . . . . 75.150000000000006 110.345 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 175' ' ' PRO . . . . . 0.446 ' C ' HD23 ' A' ' 176' ' ' LEU . 18.3 Cg_endo -75.0 157.49 42.74 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.443 1.76 . . . . 73.239999999999995 111.034 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.944 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.2 OUTLIER -99.58 -50.85 3.93 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.459 1.099 . . . . 62.219999999999999 109.289 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -71.74 -22.13 61.66 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.465 1.103 . . . . 72.120000000000005 109.321 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 178' ' ' ASN . . . . . 0.453 ' ND2' HG23 ' A' ' 140' ' ' THR . 0.5 OUTLIER -107.67 107.79 60.77 Favored Pre-proline 0 C--N 1.325 -0.484 0 O-C-N 124.474 1.109 . . . . 64.030000000000001 109.335 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.96 127.54 10.79 Favored 'Trans proline' 0 C--N 1.36 1.158 0 O-C-N 124.543 1.812 . . . . 64.140000000000001 111.047 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.609 HD13 ' HB2' ' A' ' 184' ' ' ARG . 0.4 OUTLIER -141.27 96.66 7.05 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.524 1.14 . . . . 73.230000000000004 109.274 179.976 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.02 168.96 23.66 Favored 'Trans proline' 0 C--N 1.36 1.166 0 O-C-N 124.495 1.787 . . . . 55.340000000000003 111.021 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 182' ' ' ARG . . . . . 0.424 ' CB ' ' OE1' ' A' ' 190' ' ' GLN . 0.2 OUTLIER -58.45 -28.42 65.28 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.511 1.132 . . . . 73.450000000000003 110.327 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -62.85 -12.74 26.79 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.425 1.078 . . . . 72.450000000000003 110.339 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 184' ' ' ARG . . . . . 0.609 ' HB2' HD13 ' A' ' 180' ' ' LEU . 39.4 mmt180 -112.87 -28.26 7.81 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.467 1.104 . . . . 75.239999999999995 110.255 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 185' ' ' THR . . . . . 0.561 HG23 ' HD2' ' A' ' 186' ' ' PRO . 31.3 m -80.0 144.13 58.64 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.417 1.073 . . . . 73.129999999999995 110.342 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 186' ' ' PRO . . . . . 0.715 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.2 Cg_endo -74.98 147.45 34.01 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.59 1.837 . . . . 74.430000000000007 110.995 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 187' ' ' PHE . . . . . 0.506 ' O ' HG23 ' A' ' 191' ' ' THR . 4.4 p90 -63.21 -11.34 20.28 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.489 1.118 . . . . 74.0 111.039 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 188' ' ' ALA . . . . . 0.675 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -87.96 -54.12 4.39 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.545 1.153 . . . . 73.099999999999994 109.298 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.746 HD23 HG13 ' A' ' 161' ' ' VAL . 24.8 mt -72.61 -19.41 61.47 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.525 1.141 . . . . 70.409999999999997 109.333 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 190' ' ' GLN . . . . . 0.484 ' O ' ' CG ' ' A' ' 190' ' ' GLN . 7.4 tt0 -86.54 -0.52 56.28 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.596 1.185 . . . . 62.299999999999997 110.295 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 191' ' ' THR . . . . . 0.506 HG23 ' O ' ' A' ' 187' ' ' PHE . 69.1 p -130.21 18.59 5.43 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.453 1.095 . . . . 75.0 110.39 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.812 HD13 ' O ' ' A' ' 161' ' ' VAL . 3.1 mt -127.79 154.63 38.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.483 1.114 . . . . 73.099999999999994 109.269 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 193' ' ' ASN . . . . . 0.455 ' ND2' HD11 ' A' ' 209' ' ' ILE . 29.8 t30 -51.52 92.38 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.433 1.083 . . . . 71.319999999999993 109.266 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 194' ' ' ALA . . . . . 0.723 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -90.79 143.54 26.62 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.546 1.153 . . . . 54.229999999999997 109.343 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 195' ' ' LEU . . . . . 0.61 ' HB2' HG22 ' A' ' 171' ' ' ILE . 0.2 OUTLIER -76.56 150.0 36.57 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 65.299999999999997 109.331 -179.971 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 196' ' ' GLU . . . . . 0.454 ' H ' HD13 ' A' ' 195' ' ' LEU . 64.1 mt-10 -143.42 132.98 23.58 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.499 1.124 . . . . 65.319999999999993 110.271 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.944 ' HG3' HD21 ' A' ' 176' ' ' LEU . 0.6 OUTLIER -113.86 -16.81 12.17 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 124.487 1.117 . . . . 62.299999999999997 110.248 -179.998 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 198' ' ' GLU . . . . . 0.834 ' HB3' HD22 ' A' ' 176' ' ' LEU . 0.3 OUTLIER -95.71 5.07 52.3 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.436 1.085 . . . . 73.099999999999994 110.266 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.92 172.91 6.93 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.523 1.139 . . . . 72.109999999999999 110.034 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -85.4 -18.39 33.82 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.468 1.105 . . . . 51.439999999999998 110.279 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -104.42 24.05 29.94 Favored Glycine 0 CA--C 1.53 1.024 0 O-C-N 124.464 1.102 . . . . 63.409999999999997 111.088 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 202' ' ' PHE . . . . . 0.849 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.2 OUTLIER -59.2 -43.01 96.26 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.521 0.777 . . . . 71.510000000000005 110.987 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 203' ' ' PRO . . . . . 0.623 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.2 Cg_endo -75.04 -35.55 3.04 Favored 'Trans proline' 0 C--N 1.36 1.158 0 O-C-N 124.566 1.824 . . . . 71.510000000000005 111.018 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.92 -57.03 12.48 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.527 1.142 . . . . 71.439999999999998 110.433 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 205' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' A' ' 209' ' ' ILE . 3.0 mt-30 -61.92 -48.73 79.15 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.543 1.152 . . . . 73.310000000000002 110.357 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 206' ' ' VAL . . . . . 0.849 HG23 ' O ' ' A' ' 202' ' ' PHE . 92.7 t -57.25 -29.97 33.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 124.473 1.108 . . . . 65.120000000000005 109.284 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -79.42 -41.12 28.37 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.457 1.098 . . . . 74.439999999999998 110.266 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -75.45 -68.09 0.6 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.514 1.134 . . . . 71.140000000000001 110.311 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 209' ' ' ILE . . . . . 0.752 HG22 ' CD1' ' A' ' 210' ' ' PHE . 98.0 mt -40.42 -48.03 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.447 1.092 . . . . 74.109999999999999 109.261 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 210' ' ' PHE . . . . . 0.752 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.9 m-85 -105.71 75.7 1.15 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.492 1.12 . . . . 65.120000000000005 110.981 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 211' ' ' GLN . . . . . 0.486 ' CG ' ' HB ' ' A' ' 214' ' ' VAL . 10.3 pt20 -111.32 141.7 44.52 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.512 1.132 . . . . 70.230000000000004 110.277 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.565 ' HA ' ' CD2' ' A' ' 215' ' ' TYR . 16.1 tt0 -53.08 -48.38 67.79 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.448 1.093 . . . . 62.25 110.265 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.4 t -52.58 -18.61 1.82 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.421 1.076 . . . . 64.239999999999995 109.969 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.486 ' HB ' ' CG ' ' A' ' 211' ' ' GLN . 2.3 t -97.66 -44.52 12.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 124.534 1.146 . . . . 74.439999999999998 109.276 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 215' ' ' TYR . . . . . 0.565 ' CD2' ' HA ' ' A' ' 212' ' ' GLU . 9.5 m-30 -37.39 -32.36 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.452 1.095 . . . . 75.299999999999997 110.964 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 216' ' ' LYS . . . . . 0.513 ' N ' ' CD ' ' A' ' 216' ' ' LYS . 5.6 mmtt -68.51 -54.59 15.87 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.482 1.113 . . . . 73.450000000000003 109.324 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 217' ' ' THR . . . . . 0.446 ' N ' ' O ' ' A' ' 214' ' ' VAL . 1.5 m -40.24 -66.41 0.31 Allowed 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.559 1.162 . . . . 70.209999999999994 110.46 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 218' ' ' GLN . . . . . 0.582 ' HA ' HD12 ' A' ' 221' ' ' ILE . 2.8 mp0 -46.76 -59.94 2.72 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.492 1.12 . . . . 74.200000000000003 110.272 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 219' ' ' GLN . . . . . 0.471 ' O ' ' N ' ' A' ' 223' ' ' LYS . 5.3 tp-100 -41.34 -61.12 1.09 Allowed 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.556 1.16 . . . . 74.239999999999995 110.357 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.1 m -46.22 -45.94 17.32 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.528 1.142 . . . . 72.25 110.369 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 221' ' ' ILE . . . . . 0.582 HD12 ' HA ' ' A' ' 218' ' ' GLN . 6.5 mt -66.95 -29.59 46.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.46 1.1 . . . . 74.540000000000006 109.334 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 222' ' ' TRP . . . . . 0.484 ' CH2' ' OE2' ' A' ' 76' ' ' GLU . 14.3 t90 -81.63 -19.44 41.78 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.574 1.171 . . . . 74.340000000000003 108.07 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 223' ' ' LYS . . . . . 0.471 ' N ' ' O ' ' A' ' 219' ' ' GLN . 0.0 OUTLIER -91.86 -20.06 21.85 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.486 1.116 . . . . 63.329999999999998 109.386 179.93 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -89.49 -38.98 13.64 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.526 1.141 . . . . 72.230000000000004 110.276 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.456 ' HA ' ' HE2' ' A' ' 228' ' ' MET . 7.3 t -55.1 -29.77 58.32 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.53 1.144 . . . . 65.219999999999999 110.427 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 226' ' ' ARG . . . . . 0.414 ' O ' HG22 ' A' ' 229' ' ' VAL . 0.6 OUTLIER -72.37 -25.82 61.66 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.465 1.103 . . . . 65.409999999999997 110.25 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 227' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -79.27 -12.8 59.95 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.468 1.105 . . . . 75.120000000000005 109.289 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 228' ' ' MET . . . . . 0.456 ' HE2' ' HA ' ' A' ' 225' ' ' THR . 45.3 mtm -84.62 -40.33 17.6 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.531 1.144 . . . . 73.340000000000003 110.997 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 229' ' ' VAL . . . . . 0.509 ' HB ' ' HB2' ' A' ' 235' ' ' ALA . 1.3 m -62.69 -44.07 99.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.554 1.159 . . . . 74.420000000000002 109.305 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 230' ' ' GLN . . . . . 0.412 ' N ' ' CG2' ' A' ' 229' ' ' VAL . 0.4 OUTLIER -75.69 -37.13 59.77 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.449 1.093 . . . . 73.230000000000004 110.299 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 7.3 ttt85 -45.37 -80.34 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.512 1.132 . . . . 70.230000000000004 110.276 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -155.23 36.91 0.39 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.49 1.118 . . . . 75.150000000000006 110.25 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 233' ' ' PHE . . . . . 0.401 ' O ' ' O ' ' A' ' 229' ' ' VAL . 0.1 OUTLIER -133.01 -174.88 3.6 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.485 1.115 . . . . 74.430000000000007 110.934 -179.973 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.4 HD13 ' C ' ' A' ' 233' ' ' PHE . 9.1 mm -102.4 159.84 4.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 O-C-N 124.574 1.171 . . . . 63.109999999999999 109.279 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 235' ' ' ALA . . . . . 0.509 ' HB2' ' HB ' ' A' ' 229' ' ' VAL . . . . . . . . 0 C--N 1.326 -0.455 0 O-C-N 124.423 1.077 . . . . 62.25 109.367 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.012 0 N-CA-C 110.993 -0.843 . . . . 52.32 110.993 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.04 -169.85 0.7 Allowed 'Trans proline' 0 C--N 1.36 1.151 0 O-C-N 124.521 1.801 . . . . 64.230000000000004 110.997 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.488 HD22 ' HB3' ' A' ' 235' ' ' ALA . 0.1 OUTLIER -113.54 -65.48 1.18 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.506 1.129 . . . . 62.409999999999997 109.265 -179.943 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -128.18 90.73 0.33 Allowed Glycine 0 CA--C 1.53 1.017 0 O-C-N 124.547 1.155 . . . . 61.229999999999997 110.966 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.9 p -114.07 141.74 47.08 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.437 0.728 . . . . 71.030000000000001 110.001 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.41 ' HG3' ' N ' ' A' ' 76' ' ' GLU . 19.0 tp10 -44.74 153.88 0.15 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.505 1.128 . . . . 74.109999999999999 110.249 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.41 ' N ' ' HG3' ' A' ' 75' ' ' GLU . 1.1 tt0 -118.15 128.13 54.43 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.48 1.113 . . . . 75.040000000000006 110.304 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.468 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 6.3 p -133.95 158.96 42.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 O-C-N 124.445 1.09 . . . . 71.129999999999995 109.32 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.558 ' CG ' ' O ' ' A' ' 78' ' ' PHE . 28.7 t80 -86.63 22.02 2.02 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.492 1.12 . . . . 73.430000000000007 110.937 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.406 ' C ' ' O ' ' A' ' 78' ' ' PHE . 6.6 tp -39.91 151.55 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.519 1.137 . . . . 74.239999999999995 109.198 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.433 ' HD3' HG23 ' A' ' 106' ' ' ILE . 8.3 ttmt -91.04 -60.65 1.85 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.535 1.147 . . . . 75.010000000000005 109.307 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.676 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.3 OUTLIER -161.44 136.46 7.42 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.424 1.078 . . . . 70.310000000000002 110.974 179.966 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.551 HG11 ' HA ' ' A' ' 128' ' ' ALA . 4.0 p -89.36 167.71 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 O-C-N 124.515 1.135 . . . . 70.420000000000002 109.35 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.792 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.2 mp -131.35 96.76 2.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.466 1.104 . . . . 62.039999999999999 109.308 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.437 ' HG ' ' CB ' ' A' ' 128' ' ' ALA . 3.1 mt -72.92 118.9 16.43 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.505 1.128 . . . . 70.120000000000005 109.296 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.742 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -141.18 174.46 10.51 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.425 1.078 . . . . 62.039999999999999 109.529 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.612 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -105.14 156.46 18.07 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.493 1.12 . . . . 71.510000000000005 109.254 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.71 -14.54 21.62 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.517 1.135 . . . . 75.530000000000001 110.317 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -84.52 -46.3 11.74 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.499 1.124 . . . . 75.450000000000003 109.316 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.728 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.5 OUTLIER -112.1 43.72 1.54 Allowed 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.519 1.137 . . . . 74.219999999999999 109.311 179.976 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.601 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -80.09 -22.25 42.41 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.55 1.156 . . . . 72.129999999999995 110.418 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -83.36 -27.21 29.83 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.425 1.078 . . . . 70.299999999999997 109.241 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -70.78 -55.56 8.3 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.529 1.143 . . . . 74.219999999999999 110.363 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.742 ' HB3' ' HD2' ' A' ' 85' ' ' HIS . . . -58.79 -34.74 71.82 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.483 1.114 . . . . 75.409999999999997 109.261 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.983 ' HB2' HD13 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -73.57 -41.6 62.69 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.532 1.145 . . . . 73.120000000000005 109.315 -179.994 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.644 ' N ' HD13 ' A' ' 94' ' ' LEU . 27.0 tpt180 -51.03 -31.17 17.54 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.479 1.112 . . . . 50.039999999999999 110.314 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.813 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.0 t -82.88 -63.69 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.437 1.085 . . . . 65.349999999999994 109.221 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.584 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -41.49 -26.27 0.06 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.473 1.108 . . . . 71.430000000000007 110.34 -180.0 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.447 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.5 t-20 -71.68 -49.69 37.4 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.496 1.123 . . . . 63.340000000000003 109.347 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.845 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -73.79 -22.88 59.67 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.463 1.102 . . . . 73.219999999999999 109.267 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.845 ' N ' HD23 ' A' ' 99' ' ' LEU . 37.2 mt -63.27 -55.26 26.25 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.528 1.143 . . . . 75.129999999999995 109.291 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.67 59.35 1.16 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.459 1.099 . . . . 71.150000000000006 110.224 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.4 t70 175.87 -65.99 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.552 1.158 . . . . 60.43 109.254 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -42.77 -55.07 3.8 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.434 1.084 . . . . 60.030000000000001 109.25 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.592 ' CZ ' HG11 ' A' ' 206' ' ' VAL . 1.9 m-85 -111.92 -20.22 12.09 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.488 1.118 . . . . 71.140000000000001 110.976 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.54 45.92 3.6 Favored Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.512 1.133 . . . . 64.230000000000004 110.997 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.433 HG23 ' HD3' ' A' ' 80' ' ' LYS . 7.2 mm -88.0 90.45 3.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.517 0.775 . . . . 74.150000000000006 109.279 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.517 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -137.7 158.24 72.06 Favored Pre-proline 0 C--N 1.324 -0.507 0 O-C-N 124.496 1.122 . . . . 74.329999999999998 109.29 -179.969 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.517 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -74.96 150.3 95.24 Favored 'Cis proline' 0 C--N 1.36 1.14 0 C-N-CA 121.0 -2.5 . . . . 71.409999999999997 110.983 -0.046 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -119.69 132.38 9.44 Favored Glycine 0 CA--C 1.531 1.061 0 O-C-N 124.491 1.12 . . . . 74.519999999999996 110.885 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.453 ' CD1' ' HA ' ' A' ' 115' ' ' MET . 0.4 OUTLIER -151.41 144.09 16.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.581 0.812 . . . . 71.230000000000004 109.255 179.95 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.983 HD13 ' HB2' ' A' ' 94' ' ' LEU . 38.6 pt -97.17 177.02 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 O-C-N 124.528 1.143 . . . . 74.329999999999998 109.273 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.459 ' CD1' ' SD ' ' A' ' 115' ' ' MET . 1.8 t80 -76.13 -18.7 59.03 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.555 1.159 . . . . 75.310000000000002 110.975 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -95.97 -2.32 47.26 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.556 1.16 . . . . 63.210000000000001 109.303 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.427 ' HB2' ' CG1' ' A' ' 111' ' ' ILE . 5.5 mt-10 -111.35 -26.56 9.06 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.458 1.099 . . . . 65.310000000000002 110.234 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.459 ' SD ' ' CD1' ' A' ' 112' ' ' PHE . 1.2 ptp -70.88 134.89 85.6 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.532 1.145 . . . . 75.129999999999995 110.977 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.96 87.17 1.34 Allowed 'Trans proline' 0 C--N 1.36 1.149 0 O-C-N 124.498 1.788 . . . . 72.150000000000006 111.034 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -174.28 121.74 0.28 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.532 1.145 . . . . 75.230000000000004 109.566 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 164.68 145.0 4.24 Favored Glycine 0 CA--C 1.53 1.025 0 O-C-N 124.478 1.112 . . . . 22.350000000000001 111.036 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 77.3 mtt180 -155.65 -176.81 6.14 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.487 0.757 . . . . 64.040000000000006 110.298 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -42.04 -31.67 0.38 Allowed 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.525 1.141 . . . . 64.129999999999995 110.331 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' HIS . . . . . 0.423 ' NE2' ' O ' ' A' ' 122' ' ' LEU . 0.7 OUTLIER -153.31 135.74 15.05 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.502 1.127 . . . . 71.200000000000003 109.659 179.978 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.423 ' O ' ' NE2' ' A' ' 121' ' ' HIS . 0.4 OUTLIER -68.44 136.27 53.0 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.495 1.122 . . . . 73.219999999999999 109.256 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -73.12 -44.56 60.1 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.486 1.116 . . . . 73.040000000000006 110.291 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -176.47 130.03 0.21 Allowed 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.449 1.093 . . . . 65.129999999999995 109.31 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.685 HD11 ' HE1' ' A' ' 151' ' ' PHE . 0.9 OUTLIER -58.4 -17.63 21.86 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.531 1.144 . . . . 55.25 109.363 179.993 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.404 ' O ' ' N ' ' A' ' 129' ' ' VAL . 0.7 OUTLIER -41.23 -30.01 0.15 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.502 1.126 . . . . 74.409999999999997 109.345 179.928 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.414 ' N ' ' C ' ' A' ' 125' ' ' LEU . 3.8 t0 -44.35 -51.66 8.32 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.484 1.115 . . . . 55.109999999999999 109.266 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.551 ' HA ' HG11 ' A' ' 82' ' ' VAL . . . -66.12 -34.42 78.01 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.514 1.134 . . . . 75.030000000000001 109.288 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.745 ' O ' HG12 ' A' ' 129' ' ' VAL . 70.2 t -92.99 30.64 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.501 1.126 . . . . 71.299999999999997 109.382 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -131.75 130.47 41.93 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.479 1.112 . . . . 73.099999999999994 109.36 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 48.5 72.62 0.43 Allowed Glycine 0 CA--C 1.531 1.063 0 O-C-N 124.488 1.118 . . . . 43.530000000000001 110.985 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.3 m -160.71 167.82 26.11 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.578 0.811 . . . . 74.530000000000001 110.047 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.809 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -100.07 -33.89 10.29 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.428 1.08 . . . . 61.130000000000003 109.317 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.809 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.0 OUTLIER -161.87 151.74 16.66 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.608 1.192 . . . . 71.439999999999998 107.965 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 47.2 p -120.22 145.37 47.08 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.466 1.104 . . . . 73.25 110.419 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.831 ' O ' HD13 ' A' ' 137' ' ' LEU . 20.6 mm -99.25 131.01 47.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.495 1.122 . . . . 62.539999999999999 109.351 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.831 HD13 ' O ' ' A' ' 136' ' ' ILE . 0.4 OUTLIER -124.74 99.65 6.26 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.493 1.121 . . . . 64.319999999999993 109.328 -179.973 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.728 HD23 ' HB2' ' A' ' 89' ' ' ASP . 0.1 OUTLIER -62.22 90.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.425 1.078 . . . . 73.140000000000001 109.243 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.53 HD11 HD13 ' A' ' 189' ' ' LEU . 0.9 OUTLIER -60.34 103.01 0.2 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.527 1.142 . . . . 71.549999999999997 109.312 179.976 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.604 HG22 ' H ' ' A' ' 141' ' ' GLU . 6.7 m -130.49 179.95 5.63 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.426 1.079 . . . . 52.009999999999998 110.427 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.604 ' H ' HG22 ' A' ' 140' ' ' THR . 33.9 mt-10 -75.54 -39.55 58.11 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.466 1.104 . . . . 75.230000000000004 110.313 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -89.46 -50.85 5.86 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.556 1.16 . . . . 73.200000000000003 109.352 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.612 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 52.9 t80 -50.26 -21.24 1.29 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 71.239999999999995 110.94 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.706 HD13 ' C ' ' A' ' 144' ' ' LEU . 1.8 tm? -64.45 -67.84 0.4 Allowed 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.53 1.143 . . . . 71.140000000000001 109.253 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.619 ' N ' HD13 ' A' ' 144' ' ' LEU . 0.0 OUTLIER -60.18 -15.29 22.81 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.521 1.138 . . . . 74.340000000000003 110.247 -179.957 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -67.5 -64.57 0.83 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.467 1.104 . . . . 72.099999999999994 109.277 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.515 HG23 ' CE2' ' A' ' 151' ' ' PHE . 1.0 OUTLIER -85.43 -48.18 9.25 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.502 1.126 . . . . 34.420000000000002 110.41 179.961 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.622 ' HB2' HD22 ' A' ' 144' ' ' LEU . 26.0 t-105 -42.51 -48.34 5.26 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.577 1.173 . . . . 65.310000000000002 108.022 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 149' ' ' CYS . . . . . 0.445 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 27.0 t -65.14 -44.98 86.87 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.495 1.122 . . . . 53.409999999999997 108.242 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 150' ' ' ASN . . . . . 0.624 ' OD1' HD22 ' A' ' 125' ' ' LEU . 6.1 t-20 -48.13 -41.28 26.12 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.589 1.18 . . . . 75.329999999999998 109.331 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.685 ' HE1' HD11 ' A' ' 125' ' ' LEU . 14.4 m-30 -66.99 -35.85 80.86 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.482 1.114 . . . . 64.299999999999997 111.01 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -49.25 -46.44 46.13 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.486 1.116 . . . . 61.329999999999998 110.332 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -85.33 -15.19 44.09 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.532 1.145 . . . . 61.310000000000002 111.04 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -132.9 85.66 2.24 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.501 1.125 . . . . 74.310000000000002 111.036 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.58 -14.25 40.47 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 124.526 1.141 . . . . 75.239999999999995 110.402 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 23.2 m -53.68 -22.89 9.84 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.471 1.107 . . . . 61.100000000000001 109.978 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.562 HD12 ' CE1' ' A' ' 151' ' ' PHE . 0.6 OUTLIER -82.89 -45.89 13.66 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.467 1.105 . . . . 72.409999999999997 109.251 -179.95 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 158' ' ' MET . . . . . 0.544 ' CE ' HG21 ' A' ' 161' ' ' VAL . 26.6 mmt -42.34 -32.74 0.55 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.507 1.129 . . . . 71.510000000000005 111.026 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -65.27 -49.77 68.29 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.524 1.14 . . . . 73.209999999999994 109.313 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.718 ' HB2' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -68.66 -29.04 67.43 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.527 1.142 . . . . 61.450000000000003 109.994 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 161' ' ' VAL . . . . . 0.544 HG21 ' CE ' ' A' ' 158' ' ' MET . 6.2 t -55.06 -19.49 4.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.543 1.152 . . . . 71.209999999999994 109.344 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 162' ' ' ASN . . . . . 0.468 ' O ' ' N ' ' A' ' 164' ' ' GLN . 6.6 t-20 -91.05 20.84 4.62 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.539 1.149 . . . . 74.450000000000003 109.321 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.43 ' C ' ' O ' ' A' ' 162' ' ' ASN . 0.5 OUTLIER 35.6 33.55 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.514 1.133 . . . . 75.530000000000001 110.297 -179.956 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 164' ' ' GLN . . . . . 0.468 ' N ' ' O ' ' A' ' 162' ' ' ASN . 2.6 mt-30 -48.22 176.74 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.49 1.118 . . . . 54.210000000000001 110.291 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 4.8 p-80 -93.42 71.96 4.41 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.425 1.078 . . . . 62.140000000000001 109.586 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.554 ' HG3' ' CD2' ' A' ' 167' ' ' TYR . 2.2 tppt? -123.13 157.12 33.61 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.551 1.157 . . . . 72.439999999999998 109.306 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 167' ' ' TYR . . . . . 0.723 ' CE1' ' ND2' ' A' ' 168' ' ' ASN . 45.0 p90 -38.75 -45.94 1.19 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.501 1.126 . . . . 74.420000000000002 110.99 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.723 ' ND2' ' CE1' ' A' ' 167' ' ' TYR . 10.4 p30 -99.34 129.92 45.59 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.482 1.114 . . . . 75.319999999999993 109.237 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.483 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 14.0 m -110.73 158.35 18.75 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.457 1.098 . . . . 61.439999999999998 109.968 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.718 HG21 ' HB2' ' A' ' 160' ' ' SER . 42.9 t -116.56 111.35 34.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.481 1.113 . . . . 63.329999999999998 109.323 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.502 HG22 ' HB2' ' A' ' 195' ' ' LEU . 21.9 mm -122.86 93.75 48.06 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.514 1.134 . . . . 60.210000000000001 109.325 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 172' ' ' PRO . . . . . 0.953 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 17.9 Cg_endo -75.01 107.65 2.53 Favored 'Trans proline' 0 C--N 1.36 1.142 0 O-C-N 124.566 1.824 . . . . 72.310000000000002 110.976 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 173' ' ' MET . . . . . 0.813 ' HE1' HG21 ' A' ' 96' ' ' VAL . 4.1 ttt -83.65 152.8 24.59 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.475 1.109 . . . . 65.540000000000006 110.996 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 174' ' ' ARG . . . . . 0.414 ' N ' ' HG2' ' A' ' 173' ' ' MET . 25.5 mmm-85 -110.88 118.21 48.77 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.453 1.096 . . . . 71.340000000000003 110.32 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 175' ' ' PRO . . . . . 0.644 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -75.0 154.96 42.86 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.508 1.794 . . . . 71.349999999999994 111.012 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.866 HD21 ' CG ' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -95.58 -38.09 10.56 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 124.53 1.144 . . . . 70.430000000000007 109.372 179.951 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -72.8 -22.38 60.83 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.461 1.101 . . . . 75.109999999999999 109.35 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -110.42 108.35 58.44 Favored Pre-proline 0 C--N 1.326 -0.441 0 O-C-N 124.44 1.087 . . . . 51.210000000000001 109.275 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.96 124.06 8.37 Favored 'Trans proline' 0 C--N 1.36 1.149 0 O-C-N 124.5 1.789 . . . . 74.340000000000003 110.987 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -139.94 96.98 8.09 Favored Pre-proline 0 C--N 1.324 -0.525 0 O-C-N 124.49 1.119 . . . . 72.450000000000003 109.354 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.02 155.43 42.82 Favored 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.474 1.776 . . . . 75.340000000000003 111.012 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.2 -28.3 39.9 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 124.541 1.151 . . . . 71.230000000000004 110.232 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -53.55 -29.33 36.5 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.496 1.122 . . . . 74.319999999999993 110.346 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 27.4 mmt180 -99.42 -16.72 18.28 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.492 1.12 . . . . 64.230000000000004 110.282 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 185' ' ' THR . . . . . 0.485 HG22 ' HD2' ' A' ' 186' ' ' PRO . 20.8 m -80.08 144.02 58.12 Favored Pre-proline 0 C--N 1.325 -0.458 0 O-C-N 124.534 1.146 . . . . 72.200000000000003 110.382 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 186' ' ' PRO . . . . . 0.788 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -74.96 155.58 43.12 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.466 1.771 . . . . 75.439999999999998 110.974 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 187' ' ' PHE . . . . . 0.509 ' O ' ' CG2' ' A' ' 191' ' ' THR . 7.7 p90 -69.44 -7.09 34.71 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.462 1.101 . . . . 72.439999999999998 110.972 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 188' ' ' ALA . . . . . 0.453 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -94.08 -52.88 4.19 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.484 1.115 . . . . 73.430000000000007 109.314 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.788 HD12 ' CG ' ' A' ' 186' ' ' PRO . 48.3 mt -68.48 -42.28 78.93 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.494 1.121 . . . . 72.329999999999998 109.365 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 190' ' ' GLN . . . . . 0.411 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 6.7 pt20 -64.04 -10.46 22.15 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 124.45 1.094 . . . . 72.329999999999998 110.306 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 191' ' ' THR . . . . . 0.509 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 33.5 p -113.4 17.74 18.24 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 124.525 1.141 . . . . 72.299999999999997 110.396 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.476 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 4.8 mt -117.57 157.87 18.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.54 1.15 . . . . 52.310000000000002 109.334 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 193' ' ' ASN . . . . . 0.407 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 9.8 t-20 -78.58 70.33 4.91 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.551 1.157 . . . . 63.32 109.305 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 194' ' ' ALA . . . . . 0.953 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -61.76 178.21 0.35 Allowed 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.494 1.121 . . . . 72.299999999999997 109.267 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 195' ' ' LEU . . . . . 0.642 HD23 HD12 ' A' ' 209' ' ' ILE . 0.8 OUTLIER -105.88 122.99 47.25 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.465 1.103 . . . . 74.299999999999997 109.314 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -102.27 141.82 34.5 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.423 1.077 . . . . 74.230000000000004 110.332 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.866 ' CG ' HD21 ' A' ' 176' ' ' LEU . 15.5 tp10 -111.67 -22.27 11.27 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.488 1.118 . . . . 63.130000000000003 110.292 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 198' ' ' GLU . . . . . 0.403 ' HB3' HD12 ' A' ' 176' ' ' LEU . 2.4 pp20? -106.2 11.24 31.45 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.548 1.155 . . . . 74.439999999999998 110.268 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 32.8 t -94.68 171.5 8.75 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.523 1.139 . . . . 41.130000000000003 110.028 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -77.74 -42.16 35.2 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.511 1.132 . . . . 65.540000000000006 110.34 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -90.33 16.74 56.81 Favored Glycine 0 CA--C 1.53 1.009 0 O-C-N 124.442 1.089 . . . . 63.340000000000003 111.018 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 202' ' ' PHE . . . . . 0.619 ' C ' ' CD1' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -48.75 -47.58 71.89 Favored Pre-proline 0 C--N 1.326 -0.454 0 O-C-N 124.532 0.784 . . . . 61.240000000000002 111.013 -179.991 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 203' ' ' PRO . . . . . 0.642 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.0 Cg_endo -75.04 -28.11 9.38 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.533 1.807 . . . . 74.230000000000004 110.969 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.88 -48.01 80.85 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.412 1.07 . . . . 74.150000000000006 110.439 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 205' ' ' GLN . . . . . 0.473 ' HB2' ' CD2' ' A' ' 195' ' ' LEU . 9.3 mt-30 -60.89 -61.91 2.24 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.477 1.111 . . . . 72.430000000000007 110.299 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 206' ' ' VAL . . . . . 0.693 HG21 ' CD2' ' A' ' 100' ' ' LEU . 2.7 p -39.58 -34.05 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 124.547 1.154 . . . . 74.450000000000003 109.298 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 207' ' ' GLU . . . . . 0.404 ' N ' ' C ' ' A' ' 205' ' ' GLN . 3.2 mm-40 -75.06 -65.06 0.92 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.486 1.116 . . . . 75.140000000000001 110.265 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -49.62 -59.58 3.65 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.567 1.167 . . . . 74.239999999999995 110.337 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 209' ' ' ILE . . . . . 0.731 HG22 ' CD1' ' A' ' 210' ' ' PHE . 64.5 mt -50.04 -68.82 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.436 1.085 . . . . 53.149999999999999 109.335 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 210' ' ' PHE . . . . . 0.731 ' CD1' HG22 ' A' ' 209' ' ' ILE . 0.4 OUTLIER -89.42 66.92 7.57 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.491 1.12 . . . . 73.200000000000003 110.999 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 211' ' ' GLN . . . . . 0.532 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.2 OUTLIER -110.48 148.19 32.58 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.539 1.149 . . . . 61.210000000000001 110.261 -179.992 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.426 ' O ' ' HB3' ' A' ' 215' ' ' TYR . 5.8 tt0 -53.75 -52.38 60.38 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.566 1.166 . . . . 72.420000000000002 110.285 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 213' ' ' SER . . . . . 0.405 ' N ' ' HG3' ' A' ' 211' ' ' GLN . 0.6 OUTLIER -50.42 -21.3 1.39 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.449 1.093 . . . . 74.430000000000007 109.97 -179.993 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.532 HG23 ' HG2' ' A' ' 211' ' ' GLN . 21.7 t -95.21 -37.5 7.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.533 1.145 . . . . 74.430000000000007 109.339 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 215' ' ' TYR . . . . . 0.469 ' HH ' ' HZ ' ' A' ' 78' ' ' PHE . 5.1 t80 -51.7 -47.55 63.87 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.43 1.081 . . . . 74.329999999999998 110.967 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 2.8 mtmt -43.17 -55.28 4.01 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.467 1.104 . . . . 65.230000000000004 109.259 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 217' ' ' THR . . . . . 1.09 HG22 HD11 ' A' ' 221' ' ' ILE . 33.9 m -56.11 -66.43 0.43 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.435 1.085 . . . . 73.150000000000006 110.392 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 218' ' ' GLN . . . . . 0.448 ' HA ' HD12 ' A' ' 221' ' ' ILE . 41.5 mm-40 -47.99 -23.53 0.82 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.438 1.086 . . . . 74.439999999999998 110.278 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 219' ' ' GLN . . . . . 0.443 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 19.9 tp60 -82.36 -37.76 25.19 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.51 1.131 . . . . 73.200000000000003 110.312 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 220' ' ' THR . . . . . 0.418 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 1.2 m -78.57 -21.42 48.67 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.493 1.121 . . . . 65.230000000000004 110.343 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 221' ' ' ILE . . . . . 1.09 HD11 HG22 ' A' ' 217' ' ' THR . 12.7 mt -83.81 -37.17 12.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.477 1.111 . . . . 75.150000000000006 109.346 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 222' ' ' TRP . . . . . 0.941 ' O ' HG22 ' A' ' 225' ' ' THR . 27.3 t90 -66.84 -44.44 81.06 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.548 1.155 . . . . 71.239999999999995 107.963 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 223' ' ' LYS . . . . . 0.418 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -68.13 -23.01 64.84 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.516 1.135 . . . . 63.100000000000001 109.283 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -87.94 -28.86 21.22 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.399 1.062 . . . . 73.219999999999999 110.359 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.941 HG22 ' O ' ' A' ' 222' ' ' TRP . 5.0 t -62.53 -20.13 64.33 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.592 1.182 . . . . 74.450000000000003 110.429 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 1.3 mtm180 -79.77 -16.14 56.12 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.507 1.13 . . . . 61.439999999999998 110.281 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 227' ' ' ASN . . . . . 0.453 ' O ' ' N ' ' A' ' 231' ' ' ARG . 2.6 m-20 -86.34 -56.93 3.21 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.421 1.076 . . . . 70.329999999999998 109.325 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 21.9 ptp -48.87 -40.65 30.48 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.52 1.138 . . . . 74.109999999999999 111.033 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 229' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 233' ' ' PHE . 7.7 p -66.17 -47.8 83.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 124.455 1.097 . . . . 61.240000000000002 109.343 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 230' ' ' GLN . . . . . 0.437 ' N ' HG13 ' A' ' 229' ' ' VAL . 0.6 OUTLIER -81.79 6.34 15.86 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.541 1.151 . . . . 60.140000000000001 110.314 -179.988 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 231' ' ' ARG . . . . . 0.453 ' N ' ' O ' ' A' ' 227' ' ' ASN . 0.0 OUTLIER -103.92 -67.26 0.9 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.439 1.087 . . . . 54.310000000000002 110.322 179.985 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 232' ' ' GLN . . . . . 0.436 ' HB2' ' CD ' ' A' ' 231' ' ' ARG . 7.0 mt-30 -156.49 44.85 0.41 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.479 1.112 . . . . 72.140000000000001 110.324 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 233' ' ' PHE . . . . . 0.488 ' O ' HG23 ' A' ' 229' ' ' VAL . 0.1 OUTLIER -158.8 47.04 0.32 Allowed 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.536 1.147 . . . . 75.409999999999997 111.031 179.98 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.485 ' CG2' ' N ' ' A' ' 235' ' ' ALA . 1.6 mp -61.73 162.93 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.535 1.147 . . . . 72.400000000000006 109.253 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 235' ' ' ALA . . . . . 0.488 ' HB3' HD22 ' A' ' 72' ' ' LEU . . . . . . . . 0 C--N 1.326 -0.447 0 O-C-N 124.552 1.157 . . . . 63.219999999999999 109.234 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.428 ' N ' ' OD1' ' A' ' 126' ' ' ASP . . . . . . . . 0 CA--C 1.529 0.961 0 N-CA-C 111.004 -0.838 . . . . 74.420000000000002 111.004 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.95 141.04 26.3 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.459 1.768 . . . . 63.130000000000003 110.999 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.756 HD12 ' HB1' ' A' ' 235' ' ' ALA . 0.2 OUTLIER -113.64 -44.02 3.24 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.592 1.183 . . . . 73.109999999999999 109.275 -179.986 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -85.34 70.53 3.07 Favored Glycine 0 CA--C 1.53 0.998 0 O-C-N 124.49 1.119 . . . . 54.020000000000003 111.01 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.456 ' OG ' ' N ' ' A' ' 75' ' ' GLU . 0.9 OUTLIER -128.47 175.9 8.16 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.526 0.78 . . . . 62.420000000000002 110.039 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.456 ' N ' ' OG ' ' A' ' 74' ' ' SER . 10.5 tt0 -38.44 150.28 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.478 1.111 . . . . 72.040000000000006 110.335 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -115.98 151.15 36.0 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.566 1.166 . . . . 74.329999999999998 110.305 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.591 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 9.0 p -162.73 157.75 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.517 1.136 . . . . 74.310000000000002 109.333 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.477 ' CE2' ' OH ' ' A' ' 215' ' ' TYR . 3.3 t80 -87.48 20.73 2.76 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.463 1.102 . . . . 73.329999999999998 111.038 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.407 ' C ' ' O ' ' A' ' 78' ' ' PHE . 6.3 tp -39.31 156.84 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.416 1.072 . . . . 74.409999999999997 109.286 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 1.099 ' NZ ' HG22 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -104.47 -57.28 2.05 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.516 1.135 . . . . 64.340000000000003 109.293 -179.973 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.807 ' CE1' HD11 ' A' ' 83' ' ' ILE . 0.1 OUTLIER -161.92 150.7 15.45 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.559 1.162 . . . . 55.030000000000001 110.945 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.417 ' CG1' HG22 ' A' ' 135' ' ' THR . 3.9 p -103.13 159.48 4.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.484 1.115 . . . . 75.329999999999998 109.331 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.832 HG23 ' HB ' ' A' ' 136' ' ' ILE . 4.2 mp -122.36 88.29 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.439 1.087 . . . . 65.109999999999999 109.336 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.055 HD11 ' HB1' ' A' ' 128' ' ' ALA . 5.1 mp -70.01 114.88 8.6 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.452 1.095 . . . . 64.010000000000005 109.245 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.726 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -131.52 174.79 9.74 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.466 1.104 . . . . 74.120000000000005 109.529 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -111.21 157.3 20.25 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.489 1.118 . . . . 75.329999999999998 109.322 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.17 -11.27 19.41 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.426 1.079 . . . . 64.540000000000006 110.225 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -84.25 -40.28 18.23 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.556 1.16 . . . . 64.430000000000007 109.288 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.704 ' HB2' HD12 ' A' ' 138' ' ' LEU . 1.3 p30 -127.25 41.0 3.6 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.409 1.068 . . . . 73.549999999999997 109.303 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.613 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -74.28 -53.61 9.37 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.578 1.174 . . . . 45.130000000000003 110.36 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.18 -17.85 21.68 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.476 1.11 . . . . 72.340000000000003 109.252 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -78.84 -55.84 4.85 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.521 1.138 . . . . 75.310000000000002 110.247 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 1.011 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -65.15 -20.24 66.36 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.597 1.185 . . . . 54.149999999999999 109.29 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.623 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -86.13 -52.9 5.38 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.482 1.114 . . . . 73.129999999999995 109.35 179.964 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.617 ' N ' HD13 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -43.47 -36.2 1.91 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.445 1.091 . . . . 65.340000000000003 110.249 179.986 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.59 HG13 ' N ' ' A' ' 97' ' ' GLN . 11.0 p -80.34 -55.84 7.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 124.526 1.141 . . . . 73.219999999999999 109.296 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.59 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -47.77 -23.43 0.72 Allowed 'General case' 0 C--N 1.323 -0.547 0 O-C-N 124.493 1.12 . . . . 75.209999999999994 110.323 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.24 -38.91 55.69 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.494 1.121 . . . . 74.230000000000004 109.359 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.741 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -80.66 -23.13 39.86 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.503 1.127 . . . . 71.540000000000006 109.261 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.741 ' N ' HD23 ' A' ' 99' ' ' LEU . 32.5 mt -62.76 -44.38 96.36 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.475 1.11 . . . . 73.310000000000002 109.288 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.522 ' HB2' ' CD ' ' A' ' 107' ' ' LYS . 1.2 pp0? -85.76 55.44 3.52 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.521 1.138 . . . . 73.420000000000002 110.302 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -178.18 -63.46 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.513 1.133 . . . . 44.530000000000001 109.273 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -43.79 -56.04 4.09 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.481 1.113 . . . . 65.430000000000007 109.378 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -109.43 -28.12 9.1 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.496 1.122 . . . . 73.109999999999999 110.998 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 101.02 39.52 3.08 Favored Glycine 0 CA--C 1.53 0.982 0 O-C-N 124.561 1.163 . . . . 61.509999999999998 111.023 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 1.099 HG22 ' NZ ' ' A' ' 80' ' ' LYS . 8.2 mm -83.37 90.05 2.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 O-C-N 124.5 0.765 . . . . 74.420000000000002 109.33 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.522 ' CD ' ' HB2' ' A' ' 101' ' ' GLN . 0.0 OUTLIER -142.72 161.82 47.3 Favored Pre-proline 0 C--N 1.325 -0.484 0 O-C-N 124.48 1.112 . . . . 65.109999999999999 109.332 179.98 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.51 ' HA ' ' CB ' ' A' ' 107' ' ' LYS . 18.6 Cg_endo -74.98 149.43 93.83 Favored 'Cis proline' 0 C--N 1.36 1.177 0 C-N-CA 120.983 -2.507 . . . . 71.439999999999998 111.043 -0.047 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -121.95 131.07 8.29 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.456 1.098 . . . . 60.509999999999998 111.039 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -142.76 148.01 20.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 O-C-N 124.513 0.772 . . . . 71.549999999999997 109.327 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.726 HD12 ' NE2' ' A' ' 85' ' ' HIS . 32.2 pt -102.09 -177.16 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.477 1.11 . . . . 65.299999999999997 109.259 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.517 ' CD1' ' HG ' ' A' ' 84' ' ' LEU . 2.6 t80 -81.81 -23.21 36.65 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.569 1.168 . . . . 53.409999999999997 110.973 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -86.71 -5.32 59.16 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.465 1.103 . . . . 50.520000000000003 109.329 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -109.44 -26.61 9.89 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.507 1.129 . . . . 74.209999999999994 110.273 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.412 ' CE ' HG21 ' A' ' 82' ' ' VAL . 13.0 ttm -41.84 110.69 0.81 Allowed Pre-proline 0 C--N 1.325 -0.482 0 O-C-N 124.456 1.098 . . . . 72.450000000000003 110.996 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.04 152.65 40.83 Favored 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.481 1.78 . . . . 75.420000000000002 110.985 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.467 ' CG ' ' HA ' ' A' ' 121' ' ' HIS . 3.1 m80 -124.12 178.26 5.41 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.488 1.118 . . . . 74.340000000000003 109.586 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -109.06 -71.66 0.71 Allowed Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.548 1.155 . . . . 72.140000000000001 110.97 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 23.4 ttp85 -112.6 -36.65 5.15 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.524 0.779 . . . . 74.150000000000006 110.235 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -133.78 145.7 50.03 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.417 1.073 . . . . 53.039999999999999 110.328 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' HIS . . . . . 0.467 ' HA ' ' CG ' ' A' ' 117' ' ' HIS . 0.1 OUTLIER -81.58 128.97 34.49 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.536 1.147 . . . . 74.239999999999995 109.597 -179.976 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.667 HD22 ' C ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -62.64 143.65 57.1 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.543 1.152 . . . . 74.120000000000005 109.241 -179.964 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.2 pp0? -129.83 11.45 5.64 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.479 1.112 . . . . 73.129999999999995 110.325 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -113.88 139.99 48.73 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.473 1.108 . . . . 61.030000000000001 109.335 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.648 ' O ' ' HB3' ' A' ' 128' ' ' ALA . 4.0 pp -69.91 -17.52 63.34 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.456 1.097 . . . . 73.310000000000002 109.25 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.443 ' O ' ' N ' ' A' ' 129' ' ' VAL . 1.7 t70 -42.22 -65.27 0.48 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.582 1.176 . . . . 72.239999999999995 109.298 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -46.49 -40.66 12.81 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.398 1.061 . . . . 72.400000000000006 109.326 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 1.055 ' HB1' HD11 ' A' ' 84' ' ' LEU . . . -58.47 -38.96 78.66 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.501 1.126 . . . . 72.430000000000007 109.294 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.699 ' O ' HG12 ' A' ' 129' ' ' VAL . 77.1 t -90.45 18.41 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.54 1.15 . . . . 74.439999999999998 109.35 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -127.55 152.11 48.03 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.535 1.147 . . . . 64.129999999999995 109.322 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 47.5 56.17 8.56 Favored Glycine 0 CA--C 1.529 0.954 0 O-C-N 124.522 1.139 . . . . 71.329999999999998 111.031 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.9 p -163.76 163.73 23.95 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.473 0.749 . . . . 72.140000000000001 109.979 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.607 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -103.58 -23.78 13.46 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.451 1.094 . . . . 60.329999999999998 109.327 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.607 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.6 m-90 -161.79 157.5 24.27 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.026 -1.102 . . . . 72.5 108.026 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.512 ' HB ' HD13 ' A' ' 84' ' ' LEU . 33.8 p -131.15 127.02 37.17 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.464 1.103 . . . . 50.439999999999998 110.381 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.867 ' O ' HD23 ' A' ' 137' ' ' LEU . 4.3 mm -84.32 141.53 14.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.51 1.132 . . . . 73.329999999999998 109.301 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.867 HD23 ' O ' ' A' ' 136' ' ' ILE . 34.0 mt -134.97 110.66 9.24 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.457 1.098 . . . . 63.420000000000002 109.268 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 1.011 HD21 ' HB2' ' A' ' 93' ' ' ALA . 1.1 mm? -63.06 88.58 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.51 1.131 . . . . 61.219999999999999 109.27 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.51 HD12 ' HA ' ' A' ' 139' ' ' LEU . 6.7 tp -60.43 100.64 0.11 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.538 1.149 . . . . 71.010000000000005 109.304 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.671 HG22 ' H ' ' A' ' 141' ' ' GLU . 11.0 m -129.68 -177.55 4.32 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 72.319999999999993 110.417 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.671 ' H ' HG22 ' A' ' 140' ' ' THR . 59.4 mt-10 -79.24 -35.95 40.71 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.485 1.116 . . . . 75.219999999999999 110.31 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 17.6 p30 -89.51 -34.49 16.37 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.503 1.127 . . . . 71.439999999999998 109.295 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.578 ' CE1' HG21 ' A' ' 147' ' ' THR . 6.6 t80 -71.63 -39.34 70.48 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.566 1.166 . . . . 73.420000000000002 111.048 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.8 HD13 ' N ' ' A' ' 145' ' ' ARG . 1.1 tm? -51.32 -67.47 0.25 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.47 1.106 . . . . 73.319999999999993 109.336 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.8 ' N ' HD13 ' A' ' 144' ' ' LEU . 0.0 OUTLIER -54.6 -19.14 5.4 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.56 1.163 . . . . 72.400000000000006 110.321 179.946 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -74.66 -43.13 56.81 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.582 1.177 . . . . 74.530000000000001 109.311 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.578 HG21 ' CE1' ' A' ' 143' ' ' PHE . 9.4 p -93.69 -7.57 43.36 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.453 1.096 . . . . 71.430000000000007 110.445 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.436 ' N ' ' O ' ' A' ' 144' ' ' LEU . 2.7 t-105 -86.53 -27.08 24.2 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.554 1.159 . . . . 62.439999999999998 108.01 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 13.2 t -83.57 -45.16 13.84 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.494 1.121 . . . . 51.200000000000003 108.366 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -63.27 -42.49 99.15 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.53 1.144 . . . . 61.32 109.35 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.632 ' CE1' HD12 ' A' ' 157' ' ' LEU . 5.1 m-30 -62.9 -34.66 77.89 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.542 1.151 . . . . 70.329999999999998 111.027 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -55.34 -48.76 73.72 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.515 1.135 . . . . 64.310000000000002 110.268 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.485 ' CG ' ' O ' ' A' ' 153' ' ' PHE . 11.5 t80 -86.78 0.28 55.06 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.476 1.11 . . . . 74.219999999999999 110.978 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.524 ' CE1' ' HB3' ' A' ' 156' ' ' SER . 0.4 OUTLIER -134.13 86.69 2.3 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.512 1.132 . . . . 70.120000000000005 111.003 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -67.26 -16.12 64.09 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.467 1.105 . . . . 71.549999999999997 110.412 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 156' ' ' SER . . . . . 0.524 ' HB3' ' CE1' ' A' ' 154' ' ' TYR . 1.8 t -61.85 -22.99 65.98 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.5 1.125 . . . . 63.009999999999998 110.004 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.632 HD12 ' CE1' ' A' ' 151' ' ' PHE . 2.4 mm? -87.93 -26.35 22.74 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.52 1.137 . . . . 52.210000000000001 109.274 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 158' ' ' MET . . . . . 0.509 ' O ' ' CG2' ' A' ' 161' ' ' VAL . 25.2 mmt -66.23 -22.25 66.33 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.563 1.164 . . . . 74.230000000000004 111.041 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 9.9 m-20 -93.88 -17.79 22.66 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.486 1.116 . . . . 73.129999999999995 109.294 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.478 ' HB2' ' CG2' ' A' ' 170' ' ' VAL . 69.4 p -81.2 -34.6 32.17 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.485 1.116 . . . . 71.310000000000002 110.028 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 161' ' ' VAL . . . . . 0.638 ' O ' HD13 ' A' ' 192' ' ' ILE . 1.5 m -51.07 -21.51 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.601 1.188 . . . . 54.240000000000002 109.267 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 162' ' ' ASN . . . . . 0.415 ' O ' ' C ' ' A' ' 163' ' ' ARG . 75.1 m-20 -90.09 25.75 2.06 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.538 1.149 . . . . 64.010000000000005 109.297 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 160' ' ' SER . 0.1 OUTLIER 37.91 34.22 0.06 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.478 1.111 . . . . 74.340000000000003 110.313 -179.948 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 164' ' ' GLN . . . . . 0.402 ' C ' ' O ' ' A' ' 163' ' ' ARG . 37.5 mt-30 -38.7 126.88 1.52 Allowed 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.495 1.122 . . . . 65.409999999999997 110.339 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 39.5 m-70 -72.03 68.52 0.69 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.56 1.163 . . . . 70.349999999999994 109.654 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.452 ' O ' ' NE2' ' A' ' 218' ' ' GLN . 0.1 OUTLIER -122.54 -174.39 2.9 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.486 1.116 . . . . 72.310000000000002 109.281 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 167' ' ' TYR . . . . . 0.749 ' CE1' ' CD1' ' A' ' 222' ' ' TRP . 8.2 t80 -45.56 -39.6 7.72 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.428 1.08 . . . . 74.010000000000005 110.992 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.486 ' ND2' ' O ' ' A' ' 129' ' ' VAL . 4.8 p30 -128.17 149.02 50.62 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.569 1.168 . . . . 75.400000000000006 109.273 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.426 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 1.5 t -126.56 168.38 14.36 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.502 1.126 . . . . 65.219999999999999 110.034 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.478 ' CG2' ' HB2' ' A' ' 160' ' ' SER . 2.0 t -129.52 117.06 41.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 O-C-N 124.557 1.161 . . . . 73.310000000000002 109.285 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.563 HG22 ' HB2' ' A' ' 195' ' ' LEU . 17.1 mm -124.25 99.91 36.53 Favored Pre-proline 0 C--N 1.326 -0.441 0 O-C-N 124.446 1.091 . . . . 60.439999999999998 109.287 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 172' ' ' PRO . . . . . 0.877 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.95 106.95 2.37 Favored 'Trans proline' 0 C--N 1.361 1.199 0 O-C-N 124.446 1.761 . . . . 70.140000000000001 111.017 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 173' ' ' MET . . . . . 0.529 ' HE1' ' HB2' ' A' ' 197' ' ' GLU . 3.5 ttt -87.77 152.44 22.12 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.442 1.088 . . . . 75.519999999999996 111.017 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 174' ' ' ARG . . . . . 0.428 ' N ' ' HG2' ' A' ' 173' ' ' MET . 60.0 mtp180 -106.43 123.9 37.39 Favored Pre-proline 0 C--N 1.325 -0.499 0 O-C-N 124.495 1.122 . . . . 74.450000000000003 110.293 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 175' ' ' PRO . . . . . 0.673 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.3 Cg_endo -74.94 155.0 43.19 Favored 'Trans proline' 0 C--N 1.36 1.175 0 O-C-N 124.528 1.804 . . . . 72.219999999999999 110.974 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.975 HD21 ' HG2' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -96.0 -38.0 10.41 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.487 1.117 . . . . 72.530000000000001 109.304 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -72.9 -23.92 60.77 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.438 1.086 . . . . 71.040000000000006 109.336 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -110.38 110.24 58.12 Favored Pre-proline 0 C--N 1.325 -0.491 0 O-C-N 124.518 1.137 . . . . 65.349999999999994 109.313 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.93 115.5 4.31 Favored 'Trans proline' 0 C--N 1.359 1.094 0 O-C-N 124.525 1.802 . . . . 74.120000000000005 111.031 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.5 ' CD1' ' OG1' ' A' ' 185' ' ' THR . 0.7 OUTLIER -118.11 96.98 50.41 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.535 1.147 . . . . 71.549999999999997 109.331 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.02 169.38 22.76 Favored 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.479 1.778 . . . . 63.049999999999997 110.996 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 12.3 ptt180 -70.55 -16.06 62.84 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.49 1.119 . . . . 63.32 110.374 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -78.74 -2.41 39.28 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.556 1.16 . . . . 64.329999999999998 110.318 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -128.4 8.04 5.93 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.473 1.108 . . . . 70.319999999999993 110.289 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 185' ' ' THR . . . . . 0.5 ' OG1' ' CD1' ' A' ' 180' ' ' LEU . 19.6 m -110.03 143.69 28.49 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.585 1.178 . . . . 74.510000000000005 110.371 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 186' ' ' PRO . . . . . 0.709 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -74.95 155.87 43.18 Favored 'Trans proline' 0 C--N 1.36 1.146 0 O-C-N 124.545 1.813 . . . . 64.439999999999998 110.983 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 187' ' ' PHE . . . . . 0.503 ' O ' ' CG2' ' A' ' 191' ' ' THR . 28.9 p90 -69.34 -7.38 36.78 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.488 1.118 . . . . 71.310000000000002 111.008 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.76 -53.17 4.13 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.449 1.093 . . . . 64.430000000000007 109.29 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.76 HD22 ' HG3' ' A' ' 172' ' ' PRO . 61.1 mt -68.27 -42.33 79.75 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.484 1.115 . . . . 53.32 109.328 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 190' ' ' GLN . . . . . 0.413 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 6.8 pt20 -63.77 -11.04 23.15 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.563 1.164 . . . . 65.030000000000001 110.279 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 191' ' ' THR . . . . . 0.503 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 34.4 p -113.0 -3.9 13.97 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.518 1.136 . . . . 71.230000000000004 110.411 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.638 HD13 ' O ' ' A' ' 161' ' ' VAL . 7.9 mt -93.18 157.07 3.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 O-C-N 124.406 1.066 . . . . 64.439999999999998 109.301 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 193' ' ' ASN . . . . . 0.549 ' ND2' ' OE1' ' A' ' 205' ' ' GLN . 26.2 t-20 -76.97 56.95 1.27 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.417 1.073 . . . . 54.32 109.31 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 194' ' ' ALA . . . . . 0.877 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -50.99 163.18 0.21 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.58 1.175 . . . . 63.539999999999999 109.364 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 195' ' ' LEU . . . . . 0.638 HD23 ' CD1' ' A' ' 209' ' ' ILE . 0.2 OUTLIER -86.65 127.87 34.96 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 74.420000000000002 109.29 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -108.35 128.84 55.11 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.543 1.152 . . . . 62.299999999999997 110.345 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.975 ' HG2' HD21 ' A' ' 176' ' ' LEU . 5.6 tp10 -109.74 -22.09 12.08 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.482 1.114 . . . . 74.25 110.322 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 198' ' ' GLU . . . . . 0.537 ' HB3' HD12 ' A' ' 176' ' ' LEU . 2.2 pt-20 -94.82 19.12 10.59 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.495 1.122 . . . . 60.329999999999998 110.279 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -127.59 146.81 50.41 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.51 1.131 . . . . 61.310000000000002 110.001 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 12.6 tpp85 -63.18 -12.16 26.04 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.467 1.104 . . . . 72.439999999999998 110.298 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -93.76 16.43 60.82 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.545 1.153 . . . . 60.310000000000002 111.007 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 202' ' ' PHE . . . . . 0.802 ' O ' HG23 ' A' ' 206' ' ' VAL . 5.3 t80 -67.83 -38.35 14.37 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.533 0.784 . . . . 74.230000000000004 110.986 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 203' ' ' PRO . . . . . 0.701 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.5 Cg_endo -74.98 -30.13 7.52 Favored 'Trans proline' 0 C--N 1.361 1.187 0 O-C-N 124.5 1.789 . . . . 62.350000000000001 111.073 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -64.08 -65.46 0.68 Allowed 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.521 1.138 . . . . 61.030000000000001 110.392 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 205' ' ' GLN . . . . . 0.549 ' OE1' ' ND2' ' A' ' 193' ' ' ASN . 6.4 mt-30 -51.1 -42.28 60.55 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.423 1.077 . . . . 74.319999999999993 110.244 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 206' ' ' VAL . . . . . 0.802 HG23 ' O ' ' A' ' 202' ' ' PHE . 55.2 t -58.85 -28.41 37.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.487 1.117 . . . . 65.109999999999999 109.331 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -82.88 -47.6 11.66 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.521 1.138 . . . . 64.299999999999997 110.27 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 208' ' ' ARG . . . . . 0.442 ' N ' ' HD2' ' A' ' 208' ' ' ARG . 1.9 mpt_? -64.25 -64.01 0.99 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.459 1.099 . . . . 71.439999999999998 110.278 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 209' ' ' ILE . . . . . 0.71 HG22 ' CD1' ' A' ' 210' ' ' PHE . 54.2 mt -48.35 -53.01 6.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.515 1.135 . . . . 63.439999999999998 109.297 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 210' ' ' PHE . . . . . 0.71 ' CD1' HG22 ' A' ' 209' ' ' ILE . 0.8 OUTLIER -101.84 66.15 1.03 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.526 1.142 . . . . 75.25 111.016 179.993 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 211' ' ' GLN . . . . . 0.443 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.1 OUTLIER -110.92 146.37 36.69 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.504 1.128 . . . . 75.420000000000002 110.271 179.974 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.452 ' O ' ' N ' ' A' ' 215' ' ' TYR . 63.9 tt0 -48.86 -55.62 11.13 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.503 1.127 . . . . 51.119999999999997 110.275 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -48.24 -24.03 1.06 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.522 1.138 . . . . 73.430000000000007 110.011 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.443 HG23 ' HG2' ' A' ' 211' ' ' GLN . 22.6 t -95.86 -29.02 3.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.493 1.121 . . . . 71.430000000000007 109.281 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 215' ' ' TYR . . . . . 0.477 ' OH ' ' CE2' ' A' ' 78' ' ' PHE . 12.3 t80 -65.1 -20.26 66.39 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 124.535 1.147 . . . . 72.409999999999997 110.922 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 216' ' ' LYS . . . . . 0.46 ' O ' ' CB ' ' A' ' 220' ' ' THR . 5.9 mmpt? -69.23 -57.3 5.52 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.57 1.169 . . . . 62.43 109.372 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 1.2 m -47.87 -53.66 15.03 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.505 1.128 . . . . 73.349999999999994 110.41 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 218' ' ' GLN . . . . . 0.452 ' NE2' ' O ' ' A' ' 166' ' ' LYS . 94.5 mm-40 -55.78 -66.94 0.34 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.455 1.097 . . . . 73.150000000000006 110.325 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 219' ' ' GLN . . . . . 0.456 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 40.2 tp60 -54.57 -18.79 4.83 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.547 1.154 . . . . 71.450000000000003 110.304 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 220' ' ' THR . . . . . 0.46 ' CB ' ' O ' ' A' ' 216' ' ' LYS . 2.9 m -83.27 -28.41 29.16 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.565 1.165 . . . . 34.240000000000002 110.399 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 221' ' ' ILE . . . . . 0.442 HG22 ' HB2' ' A' ' 167' ' ' TYR . 14.0 mt -83.81 -17.66 10.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.453 1.096 . . . . 73.209999999999994 109.263 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 222' ' ' TRP . . . . . 0.8 ' O ' HG22 ' A' ' 225' ' ' THR . 7.9 t90 -89.09 -59.63 2.17 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.957 -1.127 . . . . 72.140000000000001 107.957 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.14 -20.45 6.7 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.496 1.123 . . . . 73.420000000000002 109.327 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -86.59 -30.3 21.94 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.48 1.113 . . . . 74.129999999999995 110.286 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.8 HG22 ' O ' ' A' ' 222' ' ' TRP . 4.6 t -72.94 -22.8 60.66 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.497 1.123 . . . . 72.129999999999995 110.381 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 10.9 mtm180 -75.56 -14.4 60.39 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.502 1.127 . . . . 71.239999999999995 110.327 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 227' ' ' ASN . . . . . 0.442 ' O ' ' N ' ' A' ' 231' ' ' ARG . 3.7 m-20 -85.12 -59.23 2.39 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.478 1.111 . . . . 71.450000000000003 109.238 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 20.8 ptp -44.87 -40.52 6.32 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.481 1.113 . . . . 54.140000000000001 111.01 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 229' ' ' VAL . . . . . 0.443 ' CG1' ' N ' ' A' ' 230' ' ' GLN . 0.5 OUTLIER -68.38 -45.55 82.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.467 1.104 . . . . 73.439999999999998 109.314 179.999 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 230' ' ' GLN . . . . . 0.443 ' N ' ' CG1' ' A' ' 229' ' ' VAL . 0.1 OUTLIER -88.87 18.36 4.87 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.478 1.111 . . . . 74.010000000000005 110.292 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 231' ' ' ARG . . . . . 0.442 ' N ' ' O ' ' A' ' 227' ' ' ASN . 14.6 ttt85 -114.91 -50.16 2.78 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 124.59 1.181 . . . . 73.219999999999999 110.34 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 41.6 tt0 -176.05 39.19 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.434 1.084 . . . . 71.310000000000002 110.238 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 233' ' ' PHE . . . . . 0.401 ' O ' ' O ' ' A' ' 229' ' ' VAL . 0.4 OUTLIER -152.13 179.02 8.86 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.466 1.104 . . . . 75.409999999999997 111.014 -179.998 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.473 HD13 ' HA ' ' A' ' 234' ' ' ILE . 23.4 mm -143.63 146.19 21.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.52 1.137 . . . . 65.209999999999994 109.294 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 235' ' ' ALA . . . . . 0.756 ' HB1' HD12 ' A' ' 72' ' ' LEU . . . . . . . . 0 C--N 1.325 -0.483 0 O-C-N 124.488 1.118 . . . . 74.25 109.298 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.038 0 N-CA-C 110.982 -0.847 . . . . 52.030000000000001 110.982 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.93 141.45 26.88 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.54 1.81 . . . . 63.439999999999998 111.079 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.571 ' O ' HD13 ' A' ' 72' ' ' LEU . 0.3 OUTLIER -57.0 -44.33 82.65 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.512 1.133 . . . . 60.219999999999999 109.299 -179.986 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -168.98 112.74 0.49 Allowed Glycine 0 CA--C 1.53 0.985 0 O-C-N 124.5 1.125 . . . . 52.109999999999999 111.023 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -150.14 164.39 35.74 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.517 0.774 . . . . 70.200000000000003 110.039 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.43 ' CG ' ' N ' ' A' ' 76' ' ' GLU . 27.6 tt0 -60.71 156.69 16.29 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.489 1.118 . . . . 71.129999999999995 110.325 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.43 ' N ' ' CG ' ' A' ' 75' ' ' GLU . 0.5 OUTLIER -121.62 149.82 42.62 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.532 1.145 . . . . 71.340000000000003 110.336 179.977 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.554 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 5.9 p -161.23 163.87 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.526 1.142 . . . . 73.239999999999995 109.272 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.479 ' N ' HG22 ' A' ' 77' ' ' VAL . 1.5 t80 -87.36 20.92 2.62 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.486 1.116 . . . . 74.209999999999994 110.985 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.469 ' HB2' HG13 ' A' ' 77' ' ' VAL . 6.5 tp -41.2 160.9 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.445 1.091 . . . . 63.340000000000003 109.341 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.616 ' O ' ' HB3' ' A' ' 133' ' ' ALA . 6.5 ptmt -111.08 -49.58 3.01 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 124.499 1.125 . . . . 75.209999999999994 109.308 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.925 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.2 OUTLIER -165.62 136.69 3.82 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.571 1.169 . . . . 74.010000000000005 111.04 -179.955 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.539 HG22 ' N ' ' A' ' 83' ' ' ILE . 8.0 p -91.09 169.25 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.509 1.131 . . . . 71.299999999999997 109.293 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.925 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 4.7 mp -133.04 96.97 2.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.478 1.111 . . . . 74.239999999999995 109.319 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.843 HD11 ' HB3' ' A' ' 128' ' ' ALA . 8.0 mt -69.59 124.15 23.19 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.468 1.105 . . . . 73.140000000000001 109.348 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.797 ' NE2' HD12 ' A' ' 111' ' ' ILE . 2.8 p80 -146.06 174.72 11.04 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.447 1.092 . . . . 74.049999999999997 109.658 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.467 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -131.8 164.65 25.56 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.442 1.089 . . . . 64.340000000000003 109.336 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -55.62 -17.29 5.33 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.47 1.106 . . . . 72.340000000000003 110.268 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -76.47 -46.53 26.46 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.529 1.143 . . . . 41.439999999999998 109.313 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.442 ' OD2' ' ND2' ' A' ' 178' ' ' ASN . 21.8 m-20 -125.35 45.14 2.64 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.492 1.12 . . . . 60.020000000000003 109.318 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.619 ' HG1' ' CE1' ' A' ' 85' ' ' HIS . 0.9 OUTLIER -75.05 -37.59 61.65 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 72.329999999999998 110.378 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.82 -19.99 43.45 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.467 1.104 . . . . 54.439999999999998 109.295 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.42 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -75.46 -59.97 2.51 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.436 1.085 . . . . 74.099999999999994 110.24 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.753 ' HB2' ' CD2' ' A' ' 138' ' ' LEU . . . -60.56 -23.17 64.42 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.581 1.176 . . . . 64.209999999999994 109.287 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.848 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -85.8 -41.42 15.07 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.498 1.123 . . . . 73.549999999999997 109.279 -179.992 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -53.19 -34.78 58.42 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.496 1.122 . . . . 74.420000000000002 110.347 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.589 HG13 ' N ' ' A' ' 97' ' ' GLN . 9.5 p -83.19 -56.08 6.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.49 1.119 . . . . 74.239999999999995 109.308 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.593 ' HA ' HD12 ' A' ' 100' ' ' LEU . 0.1 OUTLIER -47.67 -23.27 0.65 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.466 1.104 . . . . 62.399999999999999 110.273 -179.955 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -77.24 -43.33 33.91 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.472 1.108 . . . . 40.219999999999999 109.308 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.72 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -75.53 -22.28 57.22 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.519 1.137 . . . . 72.340000000000003 109.321 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.72 ' N ' HD23 ' A' ' 99' ' ' LEU . 73.4 mt -65.02 -49.67 69.25 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.483 1.114 . . . . 64.120000000000005 109.326 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -78.7 53.24 1.31 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.527 1.142 . . . . 71.230000000000004 110.321 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -176.91 -66.56 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.526 1.141 . . . . 74.329999999999998 109.336 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -41.54 -48.53 3.96 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.579 1.175 . . . . 74.310000000000002 109.276 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -115.8 -29.96 6.25 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.512 1.132 . . . . 75.409999999999997 110.993 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 106.61 35.92 2.73 Favored Glycine 0 CA--C 1.53 0.972 0 O-C-N 124.474 1.109 . . . . 73.439999999999998 111.011 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.56 HG22 ' HD3' ' A' ' 80' ' ' LYS . 23.5 mm -75.84 87.77 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.539 0.788 . . . . 74.219999999999999 109.3 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.514 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -137.75 158.32 71.87 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.529 1.143 . . . . 71.400000000000006 109.292 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.514 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.4 Cg_endo -74.94 158.25 99.1 Favored 'Cis proline' 0 C--N 1.36 1.177 0 C-N-CA 121.023 -2.49 . . . . 70.219999999999999 111.038 -0.071 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -114.97 134.25 11.52 Favored Glycine 0 CA--C 1.53 1.005 0 O-C-N 124.524 1.14 . . . . 54.25 111.02 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -154.09 128.26 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.531 0.783 . . . . 42.0 109.277 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.797 HD12 ' NE2' ' A' ' 85' ' ' HIS . 44.6 pt -89.68 -171.63 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 124.469 1.105 . . . . 72.409999999999997 109.26 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.557 ' CZ ' ' HB2' ' A' ' 122' ' ' LEU . 2.3 t80 -81.33 -40.01 24.26 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.522 1.139 . . . . 74.109999999999999 111.037 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.5 ' HB2' ' HE1' ' A' ' 85' ' ' HIS . . . -73.97 -4.45 35.27 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.539 1.15 . . . . 72.010000000000005 109.261 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -106.69 -26.57 11.27 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.515 1.135 . . . . 73.420000000000002 110.298 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 31.9 tpp -44.48 110.88 1.1 Allowed Pre-proline 0 C--N 1.326 -0.443 0 O-C-N 124.386 1.054 . . . . 65.519999999999996 110.996 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.9 90.97 1.03 Allowed 'Trans proline' 0 C--N 1.359 1.118 0 O-C-N 124.515 1.797 . . . . 64.109999999999999 111.043 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 3.1 p-80 -115.95 -173.07 2.28 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.554 1.159 . . . . 54.350000000000001 109.594 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -109.64 -128.2 5.53 Favored Glycine 0 CA--C 1.529 0.949 0 O-C-N 124.483 1.114 . . . . 51.299999999999997 111.017 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.4 ' O ' ' C ' ' A' ' 120' ' ' GLN . 4.3 mmm180 -52.48 -69.04 0.12 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.516 0.774 . . . . 75.230000000000004 110.318 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.4 ' C ' ' O ' ' A' ' 119' ' ' ARG . 44.6 mt-30 -39.05 136.31 0.82 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.407 1.067 . . . . 72.409999999999997 110.302 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' HIS . . . . . 0.48 ' CD2' ' HB2' ' A' ' 123' ' ' GLN . 1.3 p-80 -111.71 42.7 1.67 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.521 1.138 . . . . 62.43 109.571 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.845 ' H ' HD23 ' A' ' 122' ' ' LEU . 0.7 OUTLIER 39.85 53.85 2.59 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.538 1.149 . . . . 74.239999999999995 109.302 179.968 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.48 ' HB2' ' CD2' ' A' ' 121' ' ' HIS . 43.7 tt0 -62.17 -24.55 67.25 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.567 1.167 . . . . 64.329999999999998 110.267 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 30.9 m-80 -118.32 128.09 54.33 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.484 1.115 . . . . 70.120000000000005 109.289 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.625 HD21 ' OD1' ' A' ' 150' ' ' ASN . 0.1 OUTLIER -56.76 -18.58 13.13 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.466 1.104 . . . . 61.210000000000001 109.336 179.927 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.446 ' H ' HD12 ' A' ' 125' ' ' LEU . 7.7 p-10 -46.54 -25.96 0.79 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.55 1.156 . . . . 73.519999999999996 109.307 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.408 ' N ' ' C ' ' A' ' 125' ' ' LEU . 2.1 t70 -65.27 -55.46 18.27 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.506 1.129 . . . . 73.010000000000005 109.27 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.843 ' HB3' HD11 ' A' ' 84' ' ' LEU . . . -61.02 -15.24 29.74 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.479 1.112 . . . . 61.329999999999998 109.313 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.677 HG21 ' CD2' ' A' ' 157' ' ' LEU . 89.9 t -86.6 10.53 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.496 1.123 . . . . 70.140000000000001 109.258 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 14.5 t30 -127.61 158.97 36.08 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.494 1.121 . . . . 44.25 109.311 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 42.67 55.43 4.64 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 124.489 1.118 . . . . 65.230000000000004 111.028 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -162.53 165.54 25.94 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.532 0.784 . . . . 54.119999999999997 110.036 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.616 ' HB3' ' O ' ' A' ' 80' ' ' LYS . . . -110.08 -25.49 10.19 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.493 1.121 . . . . 74.129999999999995 109.355 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.598 ' CD1' ' O ' ' A' ' 133' ' ' ALA . 4.0 m-90 -158.45 150.61 21.66 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.477 1.111 . . . . 72.230000000000004 108.062 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.845 HG23 ' O ' ' A' ' 169' ' ' SER . 7.0 p -125.94 154.8 42.32 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.529 1.143 . . . . 75.150000000000006 110.411 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.663 ' HB ' HG23 ' A' ' 83' ' ' ILE . 15.7 mm -105.42 91.65 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.461 1.1 . . . . 65.549999999999997 109.263 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.405 ' CB ' ' HA ' ' A' ' 172' ' ' PRO . 0.6 OUTLIER -73.59 87.08 1.63 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.534 1.146 . . . . 70.439999999999998 109.3 179.959 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.753 ' CD2' ' HB2' ' A' ' 93' ' ' ALA . 1.4 tp -62.1 96.2 0.07 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.495 1.122 . . . . 71.140000000000001 109.324 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.504 HD11 HD13 ' A' ' 189' ' ' LEU . 0.1 OUTLIER -71.98 121.46 19.16 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.496 1.122 . . . . 74.430000000000007 109.303 -179.984 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.719 HG22 ' H ' ' A' ' 141' ' ' GLU . 7.0 m -137.9 -173.64 3.56 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.49 1.119 . . . . 63.43 110.394 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.719 ' H ' HG22 ' A' ' 140' ' ' THR . 4.0 mt-10 -84.93 -40.62 16.77 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 72.230000000000004 110.317 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' ASN . . . . . 0.409 ' ND2' ' N ' ' A' ' 143' ' ' PHE . 3.8 p-10 -89.67 -49.67 6.52 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.506 1.129 . . . . 60.140000000000001 109.32 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.749 ' O ' HG23 ' A' ' 147' ' ' THR . 43.1 t80 -50.39 -28.04 7.42 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.473 1.108 . . . . 64.530000000000001 111.008 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.444 HD13 ' C ' ' A' ' 144' ' ' LEU . 3.0 tm? -63.68 -67.85 0.39 Allowed 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.488 1.118 . . . . 62.149999999999999 109.263 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -48.59 -28.75 3.65 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.535 1.147 . . . . 75.239999999999995 110.389 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' ASP . . . . . 0.541 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 5.3 m-20 -71.48 -71.63 0.26 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.491 1.119 . . . . 71.519999999999996 109.35 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.749 HG23 ' O ' ' A' ' 143' ' ' PHE . 65.7 p -49.08 -55.87 10.83 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.49 1.119 . . . . 72.430000000000007 110.404 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.561 ' CZ2' ' HB3' ' A' ' 186' ' ' PRO . 0.0 OUTLIER -46.39 -31.77 2.82 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.545 1.153 . . . . 74.120000000000005 108.009 -179.963 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 149' ' ' CYS . . . . . 0.541 ' CB ' ' O ' ' A' ' 146' ' ' ASP . 1.8 t -57.86 -46.21 85.17 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.546 1.154 . . . . 52.049999999999997 108.288 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 150' ' ' ASN . . . . . 0.625 ' OD1' HD21 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -67.05 -41.6 86.22 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.525 1.14 . . . . 73.409999999999997 109.288 -179.996 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.879 ' CZ ' HD12 ' A' ' 157' ' ' LEU . 13.1 m-85 -55.34 -21.75 16.43 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.61 1.194 . . . . 75.430000000000007 111.064 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -85.49 -33.01 21.93 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.549 1.156 . . . . 72.519999999999996 110.366 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.525 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 2.5 t80 -110.25 21.19 17.02 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.513 1.133 . . . . 63.43 111.035 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.452 ' N ' ' O ' ' A' ' 150' ' ' ASN . 2.3 t80 -163.75 106.0 0.95 Allowed 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.52 1.137 . . . . 74.340000000000003 111.011 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 6.3 t -85.92 -10.75 54.72 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.478 1.111 . . . . 72.540000000000006 110.456 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 3.1 t -62.55 -23.11 66.82 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.536 1.148 . . . . 75.120000000000005 110.007 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.879 HD12 ' CZ ' ' A' ' 151' ' ' PHE . 0.2 OUTLIER -77.11 -37.86 53.33 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.526 1.141 . . . . 65.319999999999993 109.302 -179.993 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 158' ' ' MET . . . . . 0.47 ' CE ' ' HA ' ' A' ' 158' ' ' MET . 17.0 mmt -57.0 -35.83 69.67 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.439 1.087 . . . . 70.420000000000002 111.0 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 33.9 m-80 -71.23 -38.01 72.0 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.527 1.142 . . . . 52.340000000000003 109.342 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.633 ' OG ' HG11 ' A' ' 170' ' ' VAL . 1.3 p -67.19 -35.34 79.43 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.496 1.122 . . . . 71.319999999999993 109.995 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 161' ' ' VAL . . . . . 0.882 ' O ' HD13 ' A' ' 192' ' ' ILE . 64.7 t -58.56 -22.92 21.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.474 1.108 . . . . 73.540000000000006 109.302 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 68.9 m-20 -83.18 -22.71 33.16 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.459 1.1 . . . . 75.129999999999995 109.306 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 54.47 35.16 22.63 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.571 1.169 . . . . 74.409999999999997 110.271 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -52.56 -173.5 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.488 1.117 . . . . 72.340000000000003 110.316 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 12.2 p-80 -73.21 66.79 0.9 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.49 1.119 . . . . 73.239999999999995 109.622 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.32 160.39 26.8 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.485 1.116 . . . . 75.150000000000006 109.308 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 167' ' ' TYR . . . . . 0.74 ' HB3' HG22 ' A' ' 221' ' ' ILE . 4.6 p90 -70.0 -6.12 31.13 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.456 1.098 . . . . 72.239999999999995 110.89 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.516 ' ND2' ' CZ ' ' A' ' 167' ' ' TYR . 0.3 OUTLIER -122.81 137.44 54.93 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 124.493 1.12 . . . . 54.399999999999999 109.31 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.845 ' O ' HG23 ' A' ' 135' ' ' THR . 0.7 OUTLIER -143.01 150.79 40.09 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.552 1.158 . . . . 45.409999999999997 110.024 179.997 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.633 HG11 ' OG ' ' A' ' 160' ' ' SER . 1.0 OUTLIER -126.18 150.5 31.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.474 1.109 . . . . 70.310000000000002 109.287 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.643 HG22 ' HB2' ' A' ' 195' ' ' LEU . 12.1 mm -139.65 112.51 7.71 Favored Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 124.532 1.145 . . . . 75.409999999999997 109.27 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 172' ' ' PRO . . . . . 0.813 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -75.0 106.9 2.37 Favored 'Trans proline' 0 C--N 1.36 1.183 0 O-C-N 124.548 1.815 . . . . 70.299999999999997 111.034 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 173' ' ' MET . . . . . 0.575 ' CE ' HD12 ' A' ' 195' ' ' LEU . 3.9 ttt -96.39 154.0 17.51 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.501 1.126 . . . . 70.129999999999995 110.974 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 174' ' ' ARG . . . . . 0.442 ' N ' ' HG2' ' A' ' 173' ' ' MET . 57.8 mtm180 -110.66 121.53 40.86 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.476 1.11 . . . . 54.020000000000003 110.319 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 175' ' ' PRO . . . . . 0.473 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.2 Cg_endo -74.97 151.66 39.96 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.458 1.767 . . . . 72.299999999999997 111.037 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.913 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -85.15 -43.54 13.75 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.458 1.099 . . . . 72.010000000000005 109.318 -179.996 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -71.82 -28.34 63.52 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.496 1.123 . . . . 53.25 109.28 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 178' ' ' ASN . . . . . 0.67 ' OD1' HG23 ' A' ' 140' ' ' THR . 2.6 m-80 -110.44 99.63 41.57 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.547 1.155 . . . . 73.120000000000005 109.242 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.98 115.09 4.18 Favored 'Trans proline' 0 C--N 1.359 1.122 0 O-C-N 124.512 1.796 . . . . 73.400000000000006 110.99 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.608 HD13 ' HB2' ' A' ' 184' ' ' ARG . 0.6 OUTLIER -122.81 96.91 44.71 Favored Pre-proline 0 C--N 1.324 -0.518 0 O-C-N 124.528 1.143 . . . . 74.519999999999996 109.325 179.964 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 181' ' ' PRO . . . . . 0.444 ' HG2' ' CG ' ' A' ' 183' ' ' GLU . 18.4 Cg_endo -74.99 169.13 23.31 Favored 'Trans proline' 0 C--N 1.36 1.159 0 O-C-N 124.502 1.79 . . . . 62.039999999999999 111.013 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 182' ' ' ARG . . . . . 0.428 ' CG ' ' N ' ' A' ' 183' ' ' GLU . 23.1 ptt180 -53.1 -39.34 63.32 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.518 1.136 . . . . 63.130000000000003 110.3 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 183' ' ' GLU . . . . . 0.444 ' CG ' ' HG2' ' A' ' 181' ' ' PRO . 5.4 pt-20 -52.01 -36.09 48.9 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.439 1.087 . . . . 73.299999999999997 110.375 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 184' ' ' ARG . . . . . 0.608 ' HB2' HD13 ' A' ' 180' ' ' LEU . 35.3 mmt180 -89.58 -18.43 26.58 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.427 1.079 . . . . 75.109999999999999 110.278 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 185' ' ' THR . . . . . 0.493 HG22 ' HD2' ' A' ' 186' ' ' PRO . 20.7 m -82.2 143.91 49.61 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.494 1.121 . . . . 60.210000000000001 110.361 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 186' ' ' PRO . . . . . 0.751 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -74.96 155.15 43.12 Favored 'Trans proline' 0 C--N 1.36 1.134 0 O-C-N 124.5 1.79 . . . . 70.409999999999997 111.022 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 187' ' ' PHE . . . . . 0.505 ' O ' ' CG2' ' A' ' 191' ' ' THR . 23.3 p90 -68.93 -7.09 31.76 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.582 1.176 . . . . 73.140000000000001 111.006 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 188' ' ' ALA . . . . . 0.567 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -93.92 -53.11 4.12 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.592 1.182 . . . . 62.32 109.283 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.751 HD12 ' CG ' ' A' ' 186' ' ' PRO . 51.7 mt -68.54 -42.36 78.55 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.542 1.151 . . . . 73.209999999999994 109.326 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 190' ' ' GLN . . . . . 0.41 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 6.5 pt20 -63.62 -11.36 24.46 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.518 1.136 . . . . 72.340000000000003 110.316 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 191' ' ' THR . . . . . 0.505 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 29.1 p -111.81 19.55 17.87 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.48 1.113 . . . . 55.310000000000002 110.396 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.882 HD13 ' O ' ' A' ' 161' ' ' VAL . 5.3 mt -138.21 139.33 42.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 O-C-N 124.5 1.125 . . . . 73.140000000000001 109.306 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 193' ' ' ASN . . . . . 0.505 ' ND2' HD11 ' A' ' 209' ' ' ILE . 12.5 t30 -47.26 97.06 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.525 1.141 . . . . 73.099999999999994 109.315 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 194' ' ' ALA . . . . . 0.813 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -88.83 141.29 28.62 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.52 1.137 . . . . 45.119999999999997 109.31 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 195' ' ' LEU . . . . . 0.643 ' HB2' HG22 ' A' ' 171' ' ' ILE . 0.2 OUTLIER -61.47 136.09 57.91 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.51 1.131 . . . . 71.200000000000003 109.297 179.991 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -116.54 129.7 56.33 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.459 1.1 . . . . 63.450000000000003 110.349 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.913 ' HG3' HD21 ' A' ' 176' ' ' LEU . 41.6 tp10 -113.16 -29.12 7.4 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.493 1.12 . . . . 71.099999999999994 110.335 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.1 21.24 6.01 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.521 1.138 . . . . 55.32 110.317 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 1.2 t -128.63 145.4 51.16 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.555 1.16 . . . . 62.219999999999999 109.997 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.17 -14.05 44.28 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.475 1.11 . . . . 73.219999999999999 110.258 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -92.82 16.22 60.82 Favored Glycine 0 CA--C 1.531 1.04 0 O-C-N 124.542 1.151 . . . . 51.32 111.004 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 202' ' ' PHE . . . . . 0.81 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.5 OUTLIER -61.15 -41.67 81.97 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.447 0.733 . . . . 74.019999999999996 110.997 -179.996 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 203' ' ' PRO . . . . . 0.642 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.05 -34.71 3.57 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.445 1.76 . . . . 52.100000000000001 111.013 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.09 -55.43 31.12 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.495 1.122 . . . . 61.0 110.407 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -65.51 -40.05 92.55 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.495 1.122 . . . . 73.310000000000002 110.34 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 206' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 202' ' ' PHE . 72.9 t -64.45 -28.83 45.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.544 1.153 . . . . 73.120000000000005 109.239 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -83.07 -38.74 22.1 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.5 1.125 . . . . 72.430000000000007 110.305 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 79.3 mtt-85 -74.05 -65.49 0.83 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.545 1.153 . . . . 75.530000000000001 110.354 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 209' ' ' ILE . . . . . 0.645 HG22 ' CD1' ' A' ' 210' ' ' PHE . 90.8 mt -46.26 -50.03 5.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 124.447 1.092 . . . . 71.230000000000004 109.358 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 210' ' ' PHE . . . . . 0.645 ' CD1' HG22 ' A' ' 209' ' ' ILE . 0.9 OUTLIER -100.98 71.82 1.44 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.483 1.114 . . . . 72.140000000000001 111.006 179.943 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 211' ' ' GLN . . . . . 0.477 ' CG ' ' HB ' ' A' ' 214' ' ' VAL . 11.1 pt20 -110.9 138.64 47.05 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.49 1.119 . . . . 73.310000000000002 110.261 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.422 ' C ' ' N ' ' A' ' 214' ' ' VAL . 6.8 tt0 -51.49 -50.97 58.87 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 63.049999999999997 110.339 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.4 t -47.26 -21.55 0.29 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.554 1.159 . . . . 74.0 110.009 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.477 ' HB ' ' CG ' ' A' ' 211' ' ' GLN . 2.0 t -96.95 -43.07 12.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.544 1.153 . . . . 63.119999999999997 109.269 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 215' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -46.0 -40.05 9.95 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.526 1.141 . . . . 64.109999999999999 111.026 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -54.13 -66.31 0.42 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.491 1.119 . . . . 72.310000000000002 109.249 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 217' ' ' THR . . . . . 0.548 HG22 HD11 ' A' ' 221' ' ' ILE . 2.0 m -46.1 -66.54 0.39 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.51 1.131 . . . . 73.120000000000005 110.367 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 218' ' ' GLN . . . . . 0.89 ' HA ' HD12 ' A' ' 221' ' ' ILE . 18.5 mm-40 -39.55 -64.47 0.47 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.561 1.163 . . . . 74.439999999999998 110.284 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 219' ' ' GLN . . . . . 0.416 ' NE2' ' HB2' ' A' ' 223' ' ' LYS . 25.6 tp60 -44.14 -52.42 7.3 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.501 1.126 . . . . 64.030000000000001 110.304 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.83 -33.03 47.47 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.549 1.156 . . . . 55.340000000000003 110.42 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 221' ' ' ILE . . . . . 0.89 HD12 ' HA ' ' A' ' 218' ' ' GLN . 12.5 mt -74.67 -48.32 34.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.519 1.137 . . . . 71.129999999999995 109.299 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 222' ' ' TRP . . . . . 0.581 ' O ' HG22 ' A' ' 225' ' ' THR . 78.3 t90 -67.32 -17.96 64.98 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.032 -1.099 . . . . 73.010000000000005 108.032 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 223' ' ' LYS . . . . . 0.416 ' HB2' ' NE2' ' A' ' 219' ' ' GLN . 0.0 OUTLIER -84.63 -49.42 8.56 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.453 1.096 . . . . 61.549999999999997 109.284 -179.994 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -64.06 -35.97 82.47 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 75.530000000000001 110.372 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.581 HG22 ' O ' ' A' ' 222' ' ' TRP . 2.3 t -54.62 -30.4 54.69 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.547 1.155 . . . . 75.230000000000004 110.409 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -81.78 -19.05 42.08 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.526 1.142 . . . . 74.230000000000004 110.347 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 227' ' ' ASN . . . . . 0.401 ' O ' ' CG ' ' A' ' 231' ' ' ARG . 2.9 m-20 -84.65 -42.53 15.26 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.46 1.1 . . . . 72.040000000000006 109.305 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 56.0 mtm -59.55 -41.0 89.08 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 124.576 1.172 . . . . 74.120000000000005 110.99 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 229' ' ' VAL . . . . . 0.509 HG13 ' N ' ' A' ' 230' ' ' GLN . 11.3 p -67.69 -51.36 51.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.507 1.129 . . . . 74.329999999999998 109.315 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 230' ' ' GLN . . . . . 0.509 ' N ' HG13 ' A' ' 229' ' ' VAL . 2.5 tp60 -71.04 -7.99 50.26 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.503 1.127 . . . . 74.409999999999997 110.275 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 231' ' ' ARG . . . . . 0.401 ' CG ' ' O ' ' A' ' 227' ' ' ASN . 9.0 mmm180 -88.66 -88.58 0.15 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.485 1.116 . . . . 75.310000000000002 110.255 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -135.61 47.15 2.3 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.469 1.106 . . . . 74.010000000000005 110.342 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -158.15 37.59 0.25 Allowed 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.519 1.137 . . . . 74.129999999999995 110.949 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 5.0 mm -45.48 139.38 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.495 1.122 . . . . 73.420000000000002 109.275 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 235' ' ' ALA . . . . . 0.412 ' HB1' ' O ' ' A' ' 72' ' ' LEU . . . . . . . . 0 C--N 1.326 -0.446 0 O-C-N 124.413 1.071 . . . . 54.149999999999999 109.216 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.978 0 N-CA-C 111.057 -0.817 . . . . 61.100000000000001 111.057 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.469 ' CG ' ' HB3' ' A' ' 74' ' ' SER . 18.1 Cg_endo -74.95 167.43 27.08 Favored 'Trans proline' 0 C--N 1.36 1.156 0 O-C-N 124.475 1.776 . . . . 72.239999999999995 111.037 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.08 -64.73 0.88 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.53 1.144 . . . . 64.219999999999999 109.309 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -126.19 53.75 0.78 Allowed Glycine 0 CA--C 1.529 0.949 0 O-C-N 124.438 1.086 . . . . 33.43 111.029 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.469 ' HB3' ' CG ' ' A' ' 71' ' ' PRO . 0.2 OUTLIER -135.78 174.37 10.69 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.448 0.734 . . . . 65.209999999999994 109.964 -179.922 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -118.07 148.56 42.16 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.553 1.158 . . . . 72.349999999999994 110.294 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -125.92 135.19 51.61 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.544 1.152 . . . . 73.439999999999998 110.262 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.595 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 2.7 p -142.98 158.02 17.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 O-C-N 124.439 1.087 . . . . 75.310000000000002 109.291 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.407 ' CE2' ' HG3' ' A' ' 108' ' ' PRO . 51.3 p90 -89.61 31.33 0.94 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.481 1.113 . . . . 73.409999999999997 111.035 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.488 HD11 HG22 ' A' ' 110' ' ' ILE . 9.3 tp -40.23 139.1 0.77 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.506 1.129 . . . . 71.400000000000006 109.338 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.657 ' HZ1' HD12 ' A' ' 106' ' ' ILE . 2.4 mtpt -76.54 -63.43 1.34 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.492 1.12 . . . . 64.109999999999999 109.29 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.975 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.8 OUTLIER -160.81 127.9 4.21 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.562 1.164 . . . . 71.319999999999993 110.918 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.657 ' CG1' HG22 ' A' ' 135' ' ' THR . 12.3 p -84.55 169.59 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.549 1.155 . . . . 55.340000000000003 109.281 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.975 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 1.7 mp -129.65 94.41 2.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.514 1.134 . . . . 74.120000000000005 109.246 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.831 HD11 ' HB3' ' A' ' 128' ' ' ALA . 3.0 mt -71.71 93.64 1.29 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.473 1.108 . . . . 70.439999999999998 109.299 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.695 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -115.05 174.51 5.94 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.487 1.117 . . . . 74.409999999999997 109.602 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -100.68 164.09 12.03 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.564 1.165 . . . . 54.299999999999997 109.316 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.47 ' CG ' ' O ' ' A' ' 87' ' ' GLU . 13.4 tt0 -71.23 -5.6 33.28 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.496 1.123 . . . . 71.319999999999993 110.3 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -91.06 -45.46 8.68 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.466 1.103 . . . . 63.32 109.296 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.722 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -114.7 44.23 1.79 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.48 1.113 . . . . 63.520000000000003 109.31 179.954 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.607 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -76.91 -34.69 57.7 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.515 1.134 . . . . 61.229999999999997 110.396 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.52 -19.54 59.29 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.493 1.121 . . . . 72.340000000000003 109.33 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -78.53 -57.07 3.96 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.444 1.09 . . . . 71.120000000000005 110.336 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.775 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -63.13 -16.46 60.11 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 73.140000000000001 109.3 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.715 HD13 ' N ' ' A' ' 95' ' ' ARG . 0.1 OUTLIER -89.51 -53.75 4.39 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.486 1.116 . . . . 74.230000000000004 109.345 179.976 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.715 ' N ' HD13 ' A' ' 94' ' ' LEU . 20.3 tpp180 -44.1 -29.62 0.64 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.5 1.125 . . . . 72.140000000000001 110.306 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.594 HG13 ' N ' ' A' ' 97' ' ' GLN . 10.6 p -86.13 -56.23 5.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 O-C-N 124.403 1.064 . . . . 71.010000000000005 109.286 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.67 HE21 HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -47.44 -23.74 0.67 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.454 1.096 . . . . 71.349999999999994 110.309 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.75 -39.19 57.58 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.515 1.135 . . . . 74.230000000000004 109.318 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.751 ' C ' HD23 ' A' ' 99' ' ' LEU . 0.0 OUTLIER -83.73 -19.52 35.03 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.505 1.128 . . . . 72.109999999999999 109.344 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.907 HD22 HG11 ' A' ' 206' ' ' VAL . 87.7 mt -79.33 -20.17 48.52 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.477 1.111 . . . . 51.509999999999998 109.234 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.512 ' O ' ' CD ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -89.47 -11.98 41.45 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.475 1.109 . . . . 64.510000000000005 110.247 -179.96 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.468 ' O ' ' C ' ' A' ' 103' ' ' ASP . 29.2 t70 -116.07 -57.21 2.24 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.434 1.084 . . . . 73.150000000000006 109.342 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.542 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 7.2 t0 -34.41 -65.68 0.19 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.516 1.135 . . . . 70.129999999999995 109.347 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.455 ' HE1' HD23 ' A' ' 100' ' ' LEU . 4.3 m-85 -102.63 -31.88 10.16 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.475 1.109 . . . . 64.439999999999998 111.02 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.473 ' O ' ' N ' ' A' ' 107' ' ' LYS . . . 108.57 28.47 4.55 Favored Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.488 1.118 . . . . 62.119999999999997 110.987 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.657 HD12 ' HZ1' ' A' ' 80' ' ' LYS . 24.1 mm -65.29 73.89 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.479 0.752 . . . . 70.299999999999997 109.325 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.539 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.8 OUTLIER -127.45 156.34 75.26 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.504 1.127 . . . . 73.420000000000002 109.295 -179.936 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.1 Cg_endo -75.05 132.14 26.57 Favored 'Cis proline' 0 C--N 1.361 1.192 0 C-N-CA 120.98 -2.508 . . . . 74.409999999999997 110.991 0.091 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.434 ' N ' ' HA ' ' A' ' 107' ' ' LYS . . . -107.02 117.19 5.23 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.444 1.09 . . . . 74.230000000000004 110.959 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.488 HG22 HD11 ' A' ' 79' ' ' LEU . 1.0 OUTLIER -131.38 150.3 34.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 O-C-N 124.484 0.756 . . . . 71.319999999999993 109.307 179.957 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.695 HD12 ' NE2' ' A' ' 85' ' ' HIS . 45.3 pt -99.2 -175.56 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.499 1.125 . . . . 72.109999999999999 109.322 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.839 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 0.4 OUTLIER -81.82 -18.7 43.08 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.542 1.151 . . . . 71.319999999999993 111.059 179.994 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.87 -3.61 51.51 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.481 1.113 . . . . 74.129999999999995 109.266 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.422 ' CB ' HG12 ' A' ' 110' ' ' ILE . 3.6 mt-10 -106.82 -24.85 11.93 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.532 1.145 . . . . 63.210000000000001 110.321 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.422 ' HG2' ' CE1' ' A' ' 117' ' ' HIS . 15.0 ttm -55.9 110.97 2.64 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.509 1.13 . . . . 71.439999999999998 110.993 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.08 124.5 8.62 Favored 'Trans proline' 0 C--N 1.361 1.188 0 O-C-N 124.497 1.788 . . . . 64.239999999999995 110.935 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.422 ' CE1' ' HG2' ' A' ' 115' ' ' MET . 30.4 m80 -124.74 176.83 6.33 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.546 1.154 . . . . 75.25 109.685 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -104.74 -157.47 23.43 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.557 1.161 . . . . 45.310000000000002 111.054 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 -38.88 -57.46 1.23 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.498 0.763 . . . . 74.129999999999995 110.258 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -45.33 158.58 0.07 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.466 1.104 . . . . 62.210000000000001 110.295 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -93.15 175.99 6.57 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.465 1.103 . . . . 75.140000000000001 109.689 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.508 ' H ' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -107.64 27.01 9.59 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 124.516 1.135 . . . . 73.409999999999997 109.309 -179.983 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -63.69 -16.94 62.36 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.521 1.138 . . . . 73.219999999999999 110.332 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -78.72 113.19 16.57 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.439 1.087 . . . . 71.040000000000006 109.291 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.788 HD12 ' N ' ' A' ' 126' ' ' ASP . 0.9 OUTLIER -82.31 -17.29 46.31 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.44 1.088 . . . . 64.109999999999999 109.26 -179.987 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.788 ' N ' HD12 ' A' ' 125' ' ' LEU . 7.4 p-10 -78.85 -14.55 59.18 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.486 1.116 . . . . 73.230000000000004 109.322 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -58.15 -52.59 64.91 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.51 1.131 . . . . 54.0 109.309 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.839 ' HB2' ' CE1' ' A' ' 112' ' ' PHE . . . -67.4 -14.52 63.0 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.48 1.112 . . . . 44.149999999999999 109.304 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.647 HG12 ' O ' ' A' ' 129' ' ' VAL . 52.0 t -87.46 11.67 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.539 1.149 . . . . 61.399999999999999 109.25 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -141.09 124.51 16.67 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.556 1.16 . . . . 63.299999999999997 109.288 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 90.84 41.57 5.29 Favored Glycine 0 CA--C 1.53 0.987 0 O-C-N 124.608 1.193 . . . . 74.010000000000005 111.003 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.77 166.23 24.5 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.491 0.759 . . . . 51.439999999999998 110.021 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.77 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -87.58 -56.46 3.34 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.464 1.102 . . . . 73.209999999999994 109.296 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.77 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.8 m-90 -131.21 177.23 7.62 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.973 -1.121 . . . . 71.140000000000001 107.973 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.657 HG22 ' CG1' ' A' ' 82' ' ' VAL . 25.9 p -152.4 132.62 13.58 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.462 1.101 . . . . 62.130000000000003 110.454 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.647 ' O ' HD22 ' A' ' 137' ' ' LEU . 1.3 mp -84.32 140.78 15.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.464 1.102 . . . . 75.129999999999995 109.274 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.647 HD22 ' O ' ' A' ' 136' ' ' ILE . 2.8 mm? -126.73 96.71 4.74 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.609 1.193 . . . . 44.219999999999999 109.283 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.775 HD21 ' HB2' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.65 97.85 0.11 Allowed 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.47 1.106 . . . . 74.150000000000006 109.302 179.988 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.609 HD21 HG23 ' A' ' 185' ' ' THR . 3.2 tp -66.84 103.72 1.19 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.577 1.173 . . . . 65.540000000000006 109.321 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.598 ' C ' HD23 ' A' ' 180' ' ' LEU . 2.7 m -121.39 177.85 5.03 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.482 1.114 . . . . 62.420000000000002 110.409 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.483 ' H ' HG22 ' A' ' 140' ' ' THR . 2.2 mp0 -83.83 -35.9 23.88 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.431 1.082 . . . . 75.519999999999996 110.298 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 142' ' ' ASN . . . . . 0.44 ' OD1' ' N ' ' A' ' 143' ' ' PHE . 15.3 p30 -85.79 -41.92 14.64 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.47 1.106 . . . . 74.340000000000003 109.286 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.52 ' CE1' HG21 ' A' ' 147' ' ' THR . 61.3 t80 -63.67 -21.39 66.36 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.462 1.102 . . . . 70.010000000000005 110.974 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.699 ' C ' HD13 ' A' ' 144' ' ' LEU . 2.0 tm? -63.88 -67.52 0.42 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.504 1.127 . . . . 65.420000000000002 109.337 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 52.6 mmm-85 -56.71 -17.41 8.84 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.558 1.161 . . . . 72.150000000000006 110.292 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.19 -66.5 0.72 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.482 1.113 . . . . 74.129999999999995 109.296 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.562 ' HB ' ' CZ ' ' A' ' 151' ' ' PHE . 2.5 p -68.29 -53.94 20.93 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.494 1.121 . . . . 73.099999999999994 110.376 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 3.6 t-105 -43.31 -41.99 4.28 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.482 1.114 . . . . 64.329999999999998 108.025 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' CYS . . . . . 0.453 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 41.7 t -71.94 -45.43 61.13 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.53 1.144 . . . . 72.329999999999998 108.244 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 150' ' ' ASN . . . . . 0.434 ' HB3' HD21 ' A' ' 125' ' ' LEU . 27.9 m120 -52.42 -30.83 31.4 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.427 1.079 . . . . 64.329999999999998 109.299 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 1.09 ' CE1' HD12 ' A' ' 157' ' ' LEU . 7.7 m-30 -73.14 -36.11 66.62 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.546 1.153 . . . . 74.099999999999994 110.969 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -65.05 -29.95 70.88 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.519 1.137 . . . . 61.439999999999998 110.317 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -93.64 -32.05 14.23 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.452 1.095 . . . . 73.200000000000003 111.029 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.42 ' CD2' ' HB3' ' A' ' 156' ' ' SER . 1.6 t80 -132.76 97.92 4.18 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.537 1.148 . . . . 75.25 111.037 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 2.9 t -65.64 -10.99 40.86 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.468 1.105 . . . . 73.530000000000001 110.409 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 156' ' ' SER . . . . . 0.42 ' HB3' ' CD2' ' A' ' 154' ' ' TYR . 3.4 t -52.02 -36.01 48.67 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.46 1.1 . . . . 74.439999999999998 110.042 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 1.09 HD12 ' CE1' ' A' ' 151' ' ' PHE . 1.7 tm? -87.66 -28.92 21.54 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.467 1.105 . . . . 70.5 109.21 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 158' ' ' MET . . . . . 0.769 ' HE2' HG21 ' A' ' 161' ' ' VAL . 1.6 tpt -62.85 -16.52 58.93 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.498 1.124 . . . . 74.530000000000001 110.992 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -90.63 -10.8 41.96 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.546 1.154 . . . . 74.430000000000007 109.311 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.641 ' CB ' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -81.46 -38.57 26.18 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.529 1.143 . . . . 74.129999999999995 110.008 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 161' ' ' VAL . . . . . 0.769 HG21 ' HE2' ' A' ' 158' ' ' MET . 4.1 m -59.85 -18.28 15.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.485 1.116 . . . . 71.019999999999996 109.317 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -63.91 -13.16 43.28 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.521 1.138 . . . . 70.030000000000001 109.258 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.64 ' HG3' HG23 ' A' ' 192' ' ' ILE . 4.8 mmm180 63.02 39.79 9.81 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.467 1.104 . . . . 54.520000000000003 110.344 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -52.51 -174.1 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.553 1.158 . . . . 72.540000000000006 110.333 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -127.34 50.7 1.97 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.49 1.119 . . . . 74.040000000000006 109.618 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.424 ' HA ' HG21 ' A' ' 221' ' ' ILE . 0.7 OUTLIER -98.43 -174.37 2.8 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.55 1.156 . . . . 70.019999999999996 109.344 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 167' ' ' TYR . . . . . 0.603 ' CD1' ' N ' ' A' ' 168' ' ' ASN . 26.4 p90 -54.81 -42.68 72.15 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.543 1.152 . . . . 70.299999999999997 111.024 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.603 ' N ' ' CD1' ' A' ' 167' ' ' TYR . 11.9 p30 -98.05 134.94 40.44 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.411 1.07 . . . . 73.450000000000003 109.272 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.445 ' N ' ' O ' ' A' ' 133' ' ' ALA . 16.1 m -123.55 146.76 47.87 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.459 1.099 . . . . 63.130000000000003 109.968 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.641 HG21 ' CB ' ' A' ' 160' ' ' SER . 43.5 t -103.33 137.94 29.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 O-C-N 124.44 1.088 . . . . 61.140000000000001 109.314 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.612 HD13 ' O ' ' A' ' 170' ' ' VAL . 15.9 mm -141.86 104.99 5.76 Favored Pre-proline 0 C--N 1.325 -0.463 0 O-C-N 124.542 1.151 . . . . 53.43 109.283 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 172' ' ' PRO . . . . . 0.755 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.3 Cg_endo -74.96 106.2 2.23 Favored 'Trans proline' 0 C--N 1.36 1.167 0 O-C-N 124.478 1.778 . . . . 72.329999999999998 111.015 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 173' ' ' MET . . . . . 0.477 ' HE3' HD12 ' A' ' 195' ' ' LEU . 4.4 ttt -94.06 154.27 17.71 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.437 1.086 . . . . 62.039999999999999 111.034 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 174' ' ' ARG . . . . . 0.442 ' N ' ' HG2' ' A' ' 173' ' ' MET . 0.5 OUTLIER -113.66 116.46 45.68 Favored Pre-proline 0 C--N 1.325 -0.475 0 O-C-N 124.533 1.145 . . . . 73.420000000000002 110.265 -179.952 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 175' ' ' PRO . . . . . 0.572 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.4 Cg_endo -74.98 153.65 42.0 Favored 'Trans proline' 0 C--N 1.359 1.129 0 O-C-N 124.476 1.777 . . . . 64.019999999999996 110.948 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.837 ' N ' HD13 ' A' ' 176' ' ' LEU . 0.0 OUTLIER -91.25 -39.32 12.15 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.508 1.13 . . . . 72.430000000000007 109.293 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -72.61 -23.38 60.93 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.509 1.13 . . . . 65.140000000000001 109.258 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 178' ' ' ASN . . . . . 0.491 ' OD1' HG23 ' A' ' 140' ' ' THR . 1.1 m-80 -110.75 108.21 57.95 Favored Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.493 1.121 . . . . 73.319999999999993 109.339 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.96 125.23 9.21 Favored 'Trans proline' 0 C--N 1.36 1.134 0 O-C-N 124.511 1.795 . . . . 63.329999999999998 110.971 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.598 HD23 ' C ' ' A' ' 140' ' ' THR . 1.2 tm? -140.68 97.02 7.41 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.455 1.097 . . . . 72.430000000000007 109.327 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.02 153.77 41.94 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.567 1.825 . . . . 51.340000000000003 111.004 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.44 -29.06 61.19 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.577 1.173 . . . . 74.030000000000001 110.323 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -58.71 -31.62 68.42 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.555 1.159 . . . . 73.049999999999997 110.306 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 -99.41 13.24 33.95 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.463 1.102 . . . . 64.25 110.298 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 185' ' ' THR . . . . . 0.609 HG23 HD21 ' A' ' 139' ' ' LEU . 46.5 m -106.53 144.13 28.39 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.537 1.148 . . . . 70.040000000000006 110.384 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 186' ' ' PRO . . . . . 0.683 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -75.04 146.04 32.04 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.527 1.804 . . . . 74.230000000000004 111.012 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 187' ' ' PHE . . . . . 0.433 ' O ' HG23 ' A' ' 191' ' ' THR . 14.0 p90 -62.4 -11.94 18.64 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.475 1.109 . . . . 72.409999999999997 110.994 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 188' ' ' ALA . . . . . 0.474 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -87.2 -53.79 4.66 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.586 1.179 . . . . 64.349999999999994 109.23 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.683 HD12 ' CG ' ' A' ' 186' ' ' PRO . 22.4 mt -74.19 -17.67 60.87 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.496 1.123 . . . . 73.329999999999998 109.267 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 190' ' ' GLN . . . . . 0.48 ' CG ' ' O ' ' A' ' 190' ' ' GLN . 6.8 tt0 -86.41 0.69 53.54 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.443 1.089 . . . . 60.350000000000001 110.331 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 191' ' ' THR . . . . . 0.433 HG23 ' O ' ' A' ' 187' ' ' PHE . 34.1 p -127.87 16.18 6.86 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.488 1.117 . . . . 71.409999999999997 110.383 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.64 HG23 ' HG3' ' A' ' 163' ' ' ARG . 19.1 mt -117.08 152.12 18.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.481 1.113 . . . . 64.010000000000005 109.335 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 21.9 t30 -61.73 97.86 0.08 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.478 1.111 . . . . 73.310000000000002 109.343 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 194' ' ' ALA . . . . . 0.755 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -89.39 164.85 14.7 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.465 1.103 . . . . 45.329999999999998 109.28 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 195' ' ' LEU . . . . . 0.756 HD23 HD12 ' A' ' 209' ' ' ILE . 0.3 OUTLIER -103.09 126.4 50.25 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.429 1.081 . . . . 63.530000000000001 109.368 179.952 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -103.54 128.98 50.67 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.503 1.127 . . . . 73.239999999999995 110.289 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.754 ' HG2' HD21 ' A' ' 176' ' ' LEU . 4.2 tt0 -106.75 -30.48 8.92 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.499 1.124 . . . . 63.509999999999998 110.256 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 198' ' ' GLU . . . . . 0.613 ' HG2' HD12 ' A' ' 176' ' ' LEU . 4.0 pt-20 -92.51 25.24 3.1 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.511 1.132 . . . . 73.209999999999994 110.342 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.24 151.28 51.64 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.561 1.163 . . . . 63.409999999999997 109.987 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 9.9 tpt85 -67.62 -11.88 59.19 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.461 1.101 . . . . 72.219999999999999 110.312 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -93.62 15.37 63.2 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.503 1.127 . . . . 73.109999999999999 110.966 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 202' ' ' PHE . . . . . 0.791 ' CZ ' HD21 ' A' ' 100' ' ' LEU . 8.5 t80 -66.29 -38.84 23.27 Favored Pre-proline 0 C--N 1.325 -0.463 0 O-C-N 124.443 0.731 . . . . 64.400000000000006 111.046 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 203' ' ' PRO . . . . . 0.683 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -74.95 -42.04 0.58 Allowed 'Trans proline' 0 C--N 1.36 1.162 0 O-C-N 124.556 1.819 . . . . 74.140000000000001 110.944 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -48.38 -63.13 1.16 Allowed 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.529 1.143 . . . . 74.400000000000006 110.406 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 205' ' ' GLN . . . . . 0.448 ' O ' ' N ' ' A' ' 209' ' ' ILE . 7.7 mt-30 -55.46 -55.48 31.22 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.468 1.105 . . . . 64.040000000000006 110.312 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 206' ' ' VAL . . . . . 0.907 HG11 HD22 ' A' ' 100' ' ' LEU . 75.4 t -47.24 -31.07 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.541 1.151 . . . . 70.129999999999995 109.256 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -81.15 -39.05 26.15 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.515 1.134 . . . . 51.119999999999997 110.266 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -77.03 -66.64 0.8 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.475 1.11 . . . . 72.319999999999993 110.34 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 209' ' ' ILE . . . . . 0.756 HD12 HD23 ' A' ' 195' ' ' LEU . 92.9 mt -44.53 -47.23 2.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.487 1.117 . . . . 74.329999999999998 109.301 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 210' ' ' PHE . . . . . 0.713 ' CD1' HG22 ' A' ' 209' ' ' ILE . 0.7 OUTLIER -107.66 66.87 0.67 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.466 1.104 . . . . 75.439999999999998 110.985 179.99 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 211' ' ' GLN . . . . . 0.541 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.4 OUTLIER -110.8 146.3 36.64 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.547 1.154 . . . . 65.349999999999994 110.318 179.953 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.441 ' O ' ' N ' ' A' ' 215' ' ' TYR . 29.6 tt0 -48.85 -55.18 12.4 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.552 1.157 . . . . 52.229999999999997 110.351 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.04 -24.6 1.63 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.449 1.093 . . . . 52.340000000000003 109.995 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.541 HG23 ' HG2' ' A' ' 211' ' ' GLN . 40.3 t -96.22 -26.45 4.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.585 1.178 . . . . 75.310000000000002 109.29 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 215' ' ' TYR . . . . . 0.441 ' N ' ' O ' ' A' ' 212' ' ' GLU . 4.2 t80 -67.46 -34.18 76.66 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.549 1.155 . . . . 73.340000000000003 111.021 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 216' ' ' LYS . . . . . 0.419 ' O ' ' CB ' ' A' ' 220' ' ' THR . 41.3 mmtt -54.32 -59.45 4.66 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.493 1.121 . . . . 74.319999999999993 109.255 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 217' ' ' THR . . . . . 0.868 HG22 HD11 ' A' ' 221' ' ' ILE . 7.6 m -52.78 -66.51 0.37 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.444 1.09 . . . . 73.549999999999997 110.406 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 218' ' ' GLN . . . . . 0.406 ' HA ' HD12 ' A' ' 221' ' ' ILE . 2.0 mp0 -39.74 -65.33 0.4 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.508 1.13 . . . . 73.319999999999993 110.271 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -55.51 -30.44 60.69 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.491 1.12 . . . . 65.329999999999998 110.249 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 220' ' ' THR . . . . . 0.432 ' N ' ' O ' ' A' ' 217' ' ' THR . 2.1 m -76.63 -20.59 56.54 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.49 1.119 . . . . 71.530000000000001 110.393 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 221' ' ' ILE . . . . . 0.868 HD11 HG22 ' A' ' 217' ' ' THR . 15.2 mt -90.15 -28.46 5.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.523 1.14 . . . . 61.299999999999997 109.317 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 222' ' ' TRP . . . . . 0.617 ' O ' HG22 ' A' ' 225' ' ' THR . 23.9 t90 -69.62 -29.22 66.66 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.514 1.134 . . . . 75.430000000000007 107.972 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 223' ' ' LYS . . . . . 0.446 ' HG3' ' N ' ' A' ' 224' ' ' GLU . 0.5 OUTLIER -86.85 -27.91 23.2 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.473 1.108 . . . . 71.329999999999998 109.302 -179.976 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 224' ' ' GLU . . . . . 0.446 ' N ' ' HG3' ' A' ' 223' ' ' LYS . 1.6 mm-40 -80.86 -26.42 36.95 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.5 1.125 . . . . 54.539999999999999 110.273 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.738 ' O ' HG13 ' A' ' 229' ' ' VAL . 6.9 t -72.08 -21.9 61.44 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.488 1.117 . . . . 72.109999999999999 110.413 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 226' ' ' ARG . . . . . 0.42 ' CG ' ' O ' ' A' ' 222' ' ' TRP . 0.7 OUTLIER -80.58 -8.57 59.64 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.517 1.136 . . . . 74.230000000000004 110.261 179.994 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 227' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -91.97 -58.36 2.43 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.492 1.12 . . . . 73.409999999999997 109.273 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 1.4 ptp -52.72 -33.88 49.96 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.505 1.128 . . . . 62.149999999999999 111.04 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 229' ' ' VAL . . . . . 0.738 HG13 ' O ' ' A' ' 225' ' ' THR . 20.4 m -73.38 -53.2 18.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.487 1.117 . . . . 75.230000000000004 109.329 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 230' ' ' GLN . . . . . 0.541 ' N ' HG23 ' A' ' 229' ' ' VAL . 4.6 tp60 -63.74 -13.23 41.78 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.466 1.103 . . . . 72.010000000000005 110.292 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 6.6 mmt180 -90.19 -79.94 0.33 Allowed 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.547 1.154 . . . . 64.420000000000002 110.324 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -148.61 59.9 1.07 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.478 1.111 . . . . 72.25 110.353 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 233' ' ' PHE . . . . . 0.798 ' O ' HD13 ' A' ' 234' ' ' ILE . 0.7 OUTLIER -169.25 -177.93 3.02 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.522 1.138 . . . . 54.439999999999998 110.989 -179.975 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.798 HD13 ' O ' ' A' ' 233' ' ' PHE . 4.8 mm -137.24 140.54 42.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.473 1.108 . . . . 63.299999999999997 109.285 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 235' ' ' ALA . . . . . 0.53 ' HB2' HG11 ' A' ' 229' ' ' VAL . . . . . . . . 0 C--N 1.324 -0.514 0 O-C-N 124.495 1.122 . . . . 74.150000000000006 109.27 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.989 0 N-CA-C 110.978 -0.849 . . . . 62.109999999999999 110.978 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.99 142.05 27.4 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.451 1.764 . . . . 64.25 110.987 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.508 HD22 ' HA ' ' A' ' 72' ' ' LEU . 0.7 OUTLIER -82.56 125.86 31.63 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.456 1.097 . . . . 62.420000000000002 109.355 179.956 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 37.82 85.46 0.01 OUTLIER Glycine 0 CA--C 1.531 1.039 0 O-C-N 124.475 1.109 . . . . 64.319999999999993 111.001 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.45 10.42 15.24 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.543 0.79 . . . . 71.140000000000001 109.953 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -159.81 135.04 8.13 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.534 1.146 . . . . 72.099999999999994 110.282 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -121.58 129.63 52.99 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.531 1.145 . . . . 62.109999999999999 110.34 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.587 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.2 p -129.32 164.26 32.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 O-C-N 124.518 1.136 . . . . 73.409999999999997 109.249 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.482 ' CE2' ' OH ' ' A' ' 215' ' ' TYR . 13.7 t80 -88.71 25.41 1.75 Allowed 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.47 1.106 . . . . 72.019999999999996 111.019 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.676 HD11 HG22 ' A' ' 110' ' ' ILE . 4.7 tp -39.79 158.33 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.474 1.109 . . . . 75.0 109.298 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.633 ' NZ ' HG23 ' A' ' 106' ' ' ILE . 6.9 ttpt -104.97 -51.86 2.96 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.597 1.185 . . . . 70.349999999999994 109.261 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.621 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.4 OUTLIER -165.46 132.69 2.91 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.461 1.101 . . . . 75.109999999999999 111.039 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.533 HG22 ' N ' ' A' ' 83' ' ' ILE . 2.7 p -86.25 166.8 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.489 1.118 . . . . 71.319999999999993 109.324 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.766 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.0 mp -129.64 93.18 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.51 1.132 . . . . 71.519999999999996 109.27 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.913 HD11 ' HB3' ' A' ' 128' ' ' ALA . 5.0 mt -70.16 116.19 10.23 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.513 1.133 . . . . 73.5 109.396 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.596 ' CE1' ' OG1' ' A' ' 90' ' ' THR . 0.0 OUTLIER -134.15 174.36 10.59 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.492 1.12 . . . . 74.450000000000003 109.578 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.454 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -113.22 164.4 13.58 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.609 1.193 . . . . 75.129999999999995 109.263 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.451 ' CG ' ' O ' ' A' ' 87' ' ' GLU . 16.7 tt0 -68.41 -7.64 33.38 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.584 1.177 . . . . 72.549999999999997 110.318 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -89.54 -26.74 20.7 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.522 1.139 . . . . 73.219999999999999 109.286 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.502 ' O ' ' CD2' ' A' ' 138' ' ' LEU . 1.3 m-20 -142.56 44.25 1.62 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.526 1.142 . . . . 74.030000000000001 109.314 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.596 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -76.82 -33.69 57.95 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.435 1.085 . . . . 73.040000000000006 110.385 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -73.89 -41.33 62.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.479 1.112 . . . . 54.439999999999998 109.31 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.405 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 4.8 tp10 -58.65 -52.36 66.03 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.566 1.167 . . . . 73.409999999999997 110.355 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.953 ' HB2' ' CD2' ' A' ' 138' ' ' LEU . . . -59.25 -25.79 64.35 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.527 1.142 . . . . 73.129999999999995 109.296 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.952 HD22 ' O ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -82.26 -34.57 28.7 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.533 1.145 . . . . 71.209999999999994 109.321 179.919 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.614 ' N ' HD13 ' A' ' 94' ' ' LEU . 6.0 tpt180 -55.58 -29.6 59.34 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.486 1.116 . . . . 70.5 110.294 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.885 HG21 ' HE1' ' A' ' 173' ' ' MET . 1.7 t -83.1 -65.1 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.547 1.155 . . . . 51.329999999999998 109.33 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.73 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -40.27 -27.69 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.47 1.106 . . . . 64.030000000000001 110.29 179.995 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.449 ' N ' ' C ' ' A' ' 96' ' ' VAL . 2.0 t-20 -70.53 -54.57 11.65 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.469 1.106 . . . . 72.239999999999995 109.253 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.846 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -67.74 -22.88 65.21 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.464 1.102 . . . . 64.329999999999998 109.334 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.846 ' N ' HD23 ' A' ' 99' ' ' LEU . 28.5 mt -61.43 -57.96 10.09 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.539 1.149 . . . . 73.140000000000001 109.305 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -75.27 59.97 1.06 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.489 1.118 . . . . 74.109999999999999 110.341 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.4 t70 177.99 -65.46 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.528 1.143 . . . . 73.409999999999997 109.298 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.565 ' OD1' ' CE1' ' A' ' 104' ' ' PHE . 9.2 t70 -47.24 -50.26 21.56 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.484 1.115 . . . . 73.120000000000005 109.312 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.566 ' CZ ' HG11 ' A' ' 206' ' ' VAL . 2.0 m-85 -114.55 -26.51 7.88 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.416 1.073 . . . . 64.239999999999995 111.069 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.47 45.92 2.65 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.523 1.139 . . . . 33.140000000000001 110.99 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.633 HG23 ' NZ ' ' A' ' 80' ' ' LYS . 4.9 mm -86.91 84.13 2.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.436 0.727 . . . . 72.239999999999995 109.379 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.538 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -132.71 156.7 79.79 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.444 1.09 . . . . 74.040000000000006 109.271 179.999 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.538 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.95 152.45 98.23 Favored 'Cis proline' 0 C--N 1.36 1.152 0 C-N-CA 120.948 -2.522 . . . . 70.329999999999998 111.006 -0.053 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.82 138.34 10.23 Favored Glycine 0 CA--C 1.529 0.921 0 O-C-N 124.531 1.145 . . . . 73.439999999999998 111.038 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.676 HG22 HD11 ' A' ' 79' ' ' LEU . 1.8 tt -156.01 150.54 10.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.415 0.715 . . . . 73.129999999999995 109.338 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.923 HD13 ' HB2' ' A' ' 94' ' ' LEU . 9.8 pt -101.35 168.7 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.525 1.141 . . . . 64.319999999999993 109.293 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.505 ' HE1' ' HB2' ' A' ' 128' ' ' ALA . 1.8 t80 -67.18 -19.8 65.63 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.513 1.133 . . . . 74.439999999999998 111.073 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.626 ' HB3' HD12 ' A' ' 111' ' ' ILE . . . -87.2 -14.29 41.54 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.519 1.137 . . . . 64.129999999999995 109.292 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -102.85 -19.11 14.79 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.446 1.091 . . . . 71.040000000000006 110.287 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.461 ' CG ' ' HD2' ' A' ' 116' ' ' PRO . 6.5 ttm -46.56 144.05 3.67 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.512 1.132 . . . . 54.409999999999997 111.042 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.461 ' HD2' ' CG ' ' A' ' 115' ' ' MET . 18.4 Cg_endo -74.94 67.95 5.79 Favored 'Trans proline' 0 C--N 1.359 1.119 0 O-C-N 124.462 1.77 . . . . 62.039999999999999 111.0 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 9.3 t-80 -147.69 139.71 24.2 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.53 1.144 . . . . 75.239999999999995 109.566 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.54 162.29 33.83 Favored Glycine 0 CA--C 1.531 1.049 0 O-C-N 124.379 1.049 . . . . 53.340000000000003 111.0 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -107.0 45.13 1.0 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.631 0.842 . . . . 73.129999999999995 110.284 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -82.29 -53.71 5.82 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.469 1.106 . . . . 74.129999999999995 110.327 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' HIS . . . . . 0.463 ' O ' ' CG ' ' A' ' 121' ' ' HIS . 8.1 p-80 -157.11 114.14 3.06 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.472 1.108 . . . . 74.109999999999999 109.533 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.436 HD12 ' H ' ' A' ' 122' ' ' LEU . 6.8 mp -56.69 152.25 12.54 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.496 1.122 . . . . 63.020000000000003 109.256 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -123.18 -174.05 2.86 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.509 1.13 . . . . 72.25 110.301 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -42.96 141.75 1.06 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.542 1.151 . . . . 74.120000000000005 109.27 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.773 HD11 ' CD2' ' A' ' 157' ' ' LEU . 0.6 OUTLIER -84.78 -17.46 38.16 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.551 1.157 . . . . 73.310000000000002 109.349 179.955 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.423 ' OD2' ' N ' ' A' ' 127' ' ' ASP . 6.9 p-10 -55.99 -21.57 21.92 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.46 1.1 . . . . 71.420000000000002 109.321 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.423 ' N ' ' OD2' ' A' ' 126' ' ' ASP . 1.0 OUTLIER -53.97 -52.89 59.28 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.455 1.097 . . . . 72.349999999999994 109.275 179.984 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.913 ' HB3' HD11 ' A' ' 84' ' ' LEU . . . -62.94 -26.77 68.98 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.438 1.086 . . . . 74.430000000000007 109.323 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.757 ' HA ' HG21 ' A' ' 135' ' ' THR . 3.0 t -78.26 -0.56 3.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.51 1.131 . . . . 71.430000000000007 109.263 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -126.27 126.02 43.3 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.535 1.147 . . . . 64.329999999999998 109.282 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 87.29 49.65 3.89 Favored Glycine 0 CA--C 1.53 0.978 0 O-C-N 124.489 1.118 . . . . 52.229999999999997 111.002 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' SER . . . . . 0.403 ' O ' ' O ' ' A' ' 167' ' ' TYR . 0.3 OUTLIER -163.71 177.39 8.73 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.498 0.763 . . . . 70.209999999999994 109.988 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.81 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -104.42 -25.58 12.76 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.519 1.137 . . . . 71.209999999999994 109.268 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.81 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 4.1 m-90 -160.68 153.67 21.39 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.548 1.155 . . . . 70.140000000000001 107.995 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.757 HG21 ' HA ' ' A' ' 129' ' ' VAL . 2.0 p -123.03 128.13 49.74 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.484 1.115 . . . . 72.150000000000006 110.338 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.766 ' HB ' HG23 ' A' ' 83' ' ' ILE . 23.9 mm -84.19 134.2 27.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.528 1.143 . . . . 74.409999999999997 109.296 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.51 HD23 ' O ' ' A' ' 136' ' ' ILE . 20.0 mt -127.91 97.69 4.89 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.49 1.119 . . . . 75.439999999999998 109.307 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.953 ' CD2' ' HB2' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -62.33 99.3 0.13 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.465 1.103 . . . . 65.219999999999999 109.329 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.647 HD11 HD13 ' A' ' 189' ' ' LEU . 0.2 OUTLIER -70.76 105.05 3.06 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.405 1.066 . . . . 74.219999999999999 109.311 -179.977 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.691 HG22 ' H ' ' A' ' 141' ' ' GLU . 13.6 m -132.01 -177.58 4.51 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.498 1.124 . . . . 73.329999999999998 110.357 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.691 ' H ' HG22 ' A' ' 140' ' ' THR . 3.8 mp0 -81.67 -44.44 17.15 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.511 1.132 . . . . 75.129999999999995 110.323 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -82.87 -16.8 46.19 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.536 1.147 . . . . 51.439999999999998 109.327 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.454 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 16.2 t80 -90.06 -19.74 24.02 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.491 1.119 . . . . 71.439999999999998 110.978 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.7 ' C ' HD13 ' A' ' 144' ' ' LEU . 2.0 tm? -61.33 -67.87 0.37 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.537 1.148 . . . . 62.109999999999999 109.298 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.45 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 10.9 mmt85 -62.87 -13.29 32.25 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.5 1.125 . . . . 72.209999999999994 110.253 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -68.84 -53.98 18.36 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.497 1.123 . . . . 71.140000000000001 109.252 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.471 ' HB ' ' CE1' ' A' ' 151' ' ' PHE . 2.7 p -88.66 -50.57 6.17 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.508 1.13 . . . . 65.109999999999999 110.348 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.62 ' CH2' ' CB ' ' A' ' 186' ' ' PRO . 3.4 t-105 -44.02 -32.39 1.15 Allowed 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.496 1.122 . . . . 73.439999999999998 108.004 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 149' ' ' CYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 42.2 t -81.48 -45.48 15.93 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.535 1.147 . . . . 71.450000000000003 108.32 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 150' ' ' ASN . . . . . 0.601 ' O ' ' CD2' ' A' ' 154' ' ' TYR . 50.5 m-20 -62.99 -14.17 44.41 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.559 1.162 . . . . 73.010000000000005 109.304 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.561 ' CZ ' ' HG ' ' A' ' 157' ' ' LEU . 3.6 m-30 -80.16 -57.21 3.73 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.461 1.1 . . . . 74.450000000000003 110.934 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -47.8 -32.39 5.99 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.466 1.104 . . . . 70.530000000000001 110.253 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.446 ' HB3' ' CD1' ' A' ' 154' ' ' TYR . 0.4 OUTLIER -83.97 -37.08 22.71 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.456 1.097 . . . . 71.340000000000003 110.994 179.973 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.601 ' CD2' ' O ' ' A' ' 150' ' ' ASN . 1.0 OUTLIER -119.16 70.78 0.84 Allowed 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.44 1.088 . . . . 75.019999999999996 111.022 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 11.7 t -43.85 -26.5 0.27 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.544 1.152 . . . . 74.140000000000001 110.4 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 156' ' ' SER . . . . . 0.415 ' N ' ' C ' ' A' ' 154' ' ' TYR . 3.0 t -45.07 -44.42 10.27 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.507 1.129 . . . . 70.430000000000007 109.99 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.773 ' CD2' HD11 ' A' ' 125' ' ' LEU . 2.2 tp -69.04 -38.62 79.26 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.55 1.156 . . . . 61.329999999999998 109.31 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 158' ' ' MET . . . . . 0.593 ' O ' HG22 ' A' ' 161' ' ' VAL . 0.0 OUTLIER -62.57 -16.6 57.03 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.455 1.097 . . . . 74.409999999999997 110.991 -179.978 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 159' ' ' ASN . . . . . 0.46 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 82.6 m-20 -93.54 -9.66 37.48 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.425 1.078 . . . . 41.32 109.357 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.948 ' OG ' HG21 ' A' ' 170' ' ' VAL . 1.2 p -82.49 -24.11 34.34 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.5 1.125 . . . . 71.430000000000007 109.965 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 161' ' ' VAL . . . . . 0.798 ' O ' HD11 ' A' ' 192' ' ' ILE . 3.6 m -69.38 -15.7 19.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.497 1.123 . . . . 73.239999999999995 109.249 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 162' ' ' ASN . . . . . 0.45 ' CB ' ' OE1' ' A' ' 164' ' ' GLN . 4.6 m120 -65.87 -9.8 32.45 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 75.519999999999996 109.326 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.476 ' HD3' HG23 ' A' ' 192' ' ' ILE . 5.3 mmm180 67.87 53.88 0.65 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.471 1.107 . . . . 74.450000000000003 110.313 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 164' ' ' GLN . . . . . 0.693 ' H ' ' NE2' ' A' ' 164' ' ' GLN . 1.8 mp0 -51.26 -176.55 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.503 1.127 . . . . 51.130000000000003 110.371 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 20.6 m80 -134.76 19.69 3.54 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.424 1.078 . . . . 74.109999999999999 109.603 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.411 ' HA ' HG21 ' A' ' 221' ' ' ILE . 0.0 OUTLIER -78.71 -155.94 0.09 Allowed 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.488 1.117 . . . . 64.400000000000006 109.274 -179.944 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 167' ' ' TYR . . . . . 0.53 ' CD2' ' OD1' ' A' ' 168' ' ' ASN . 55.3 p90 -88.86 37.41 0.84 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.527 1.142 . . . . 75.299999999999997 110.944 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.53 ' OD1' ' CD2' ' A' ' 167' ' ' TYR . 9.7 m120 -170.09 122.19 0.67 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.495 1.122 . . . . 73.310000000000002 109.333 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.522 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 2.9 m -114.84 173.84 6.27 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.508 1.13 . . . . 61.140000000000001 110.057 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.948 HG21 ' OG ' ' A' ' 160' ' ' SER . 51.1 t -128.53 119.94 51.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.516 1.135 . . . . 64.439999999999998 109.343 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.671 HD13 ' O ' ' A' ' 170' ' ' VAL . 35.2 mm -134.18 93.44 19.62 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.485 1.116 . . . . 63.25 109.271 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 172' ' ' PRO . . . . . 0.818 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.07 107.93 2.6 Favored 'Trans proline' 0 C--N 1.361 1.209 0 O-C-N 124.468 1.773 . . . . 64.099999999999994 110.967 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 173' ' ' MET . . . . . 0.885 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.0 ttt -80.66 160.09 25.13 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.534 1.146 . . . . 64.030000000000001 110.985 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 174' ' ' ARG . . . . . 0.417 ' N ' ' HG2' ' A' ' 173' ' ' MET . 69.4 mtt180 -116.68 128.44 26.01 Favored Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.513 1.133 . . . . 73.150000000000006 110.292 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 175' ' ' PRO . . . . . 0.646 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.4 Cg_endo -74.98 152.25 40.63 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.566 1.824 . . . . 74.239999999999995 111.013 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.822 ' N ' HD13 ' A' ' 176' ' ' LEU . 0.0 OUTLIER -93.93 -44.54 8.03 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.482 1.114 . . . . 74.409999999999997 109.34 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -72.78 -26.8 61.66 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.479 1.112 . . . . 74.219999999999999 109.361 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -107.12 103.45 48.06 Favored Pre-proline 0 C--N 1.325 -0.474 0 O-C-N 124.462 1.101 . . . . 74.230000000000004 109.311 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 121.33 6.52 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.468 1.772 . . . . 43.229999999999997 110.997 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.478 HD22 ' HA ' ' A' ' 180' ' ' LEU . 0.8 OUTLIER -131.22 98.68 18.39 Favored Pre-proline 0 C--N 1.325 -0.481 0 O-C-N 124.532 1.145 . . . . 52.43 109.35 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 181' ' ' PRO . . . . . 0.447 ' HG2' ' CG ' ' A' ' 183' ' ' GLU . 18.2 Cg_endo -75.01 163.41 35.36 Favored 'Trans proline' 0 C--N 1.359 1.129 0 O-C-N 124.46 1.769 . . . . 60.509999999999998 110.983 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.47 -33.95 66.43 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.528 1.142 . . . . 71.510000000000005 110.278 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 183' ' ' GLU . . . . . 0.447 ' CG ' ' HG2' ' A' ' 181' ' ' PRO . 2.5 pt-20 -50.0 -23.23 1.91 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.529 1.143 . . . . 73.5 110.306 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 184' ' ' ARG . . . . . 0.458 ' HD3' ' N ' ' A' ' 184' ' ' ARG . 1.9 mpt_? -105.22 -28.75 10.77 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.526 1.141 . . . . 74.239999999999995 110.309 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 185' ' ' THR . . . . . 0.573 HG23 ' CD2' ' A' ' 139' ' ' LEU . 17.7 m -71.2 143.84 88.92 Favored Pre-proline 0 C--N 1.325 -0.481 0 O-C-N 124.522 1.139 . . . . 60.210000000000001 110.44 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 186' ' ' PRO . . . . . 0.835 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.2 Cg_endo -75.03 155.88 42.83 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.446 1.761 . . . . 44.229999999999997 110.994 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 187' ' ' PHE . . . . . 0.512 ' O ' ' CG2' ' A' ' 191' ' ' THR . 36.3 p90 -69.79 -6.62 33.49 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.509 1.131 . . . . 45.32 111.038 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 188' ' ' ALA . . . . . 0.755 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -94.61 -53.09 4.02 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.592 1.182 . . . . 52.130000000000003 109.263 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.835 HD12 ' CG ' ' A' ' 186' ' ' PRO . 40.3 mt -68.49 -42.29 78.84 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.496 1.123 . . . . 70.109999999999999 109.278 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 190' ' ' GLN . . . . . 0.402 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 6.8 pt20 -64.38 -10.12 22.56 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.498 1.124 . . . . 73.340000000000003 110.321 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 191' ' ' THR . . . . . 0.512 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 25.5 p -112.64 12.49 19.78 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.435 1.084 . . . . 71.349999999999994 110.44 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.798 HD11 ' O ' ' A' ' 161' ' ' VAL . 3.1 mt -115.92 154.11 17.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.491 1.12 . . . . 71.120000000000005 109.309 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -65.39 76.28 0.06 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.508 1.13 . . . . 72.439999999999998 109.303 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 194' ' ' ALA . . . . . 0.818 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -70.78 161.91 30.08 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.533 1.145 . . . . 64.439999999999998 109.336 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 195' ' ' LEU . . . . . 0.677 HD12 ' CE ' ' A' ' 173' ' ' MET . 0.2 OUTLIER -96.57 128.91 43.95 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.561 1.163 . . . . 72.109999999999999 109.271 -179.981 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 196' ' ' GLU . . . . . 0.433 ' CB ' ' HB2' ' A' ' 199' ' ' SER . 0.7 OUTLIER -118.28 136.71 53.53 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.449 1.093 . . . . 74.010000000000005 110.313 179.994 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.819 ' OE2' HD21 ' A' ' 176' ' ' LEU . 0.7 OUTLIER -103.22 -37.34 7.73 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.434 1.084 . . . . 75.420000000000002 110.308 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 198' ' ' GLU . . . . . 0.644 ' HG3' HD12 ' A' ' 176' ' ' LEU . 3.4 mt-10 -80.19 -15.2 57.56 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 124.48 1.112 . . . . 73.349999999999994 110.313 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 199' ' ' SER . . . . . 0.433 ' HB2' ' CB ' ' A' ' 196' ' ' GLU . 7.5 t -68.21 159.57 30.9 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.527 1.142 . . . . 71.140000000000001 109.941 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -66.67 -48.37 69.55 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.477 1.11 . . . . 74.019999999999996 110.289 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -89.62 29.49 6.23 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.547 1.155 . . . . 65.129999999999995 110.994 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 202' ' ' PHE . . . . . 0.615 ' CD1' ' C ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -52.33 -47.36 93.01 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.487 0.757 . . . . 73.209999999999994 111.032 179.968 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 203' ' ' PRO . . . . . 0.658 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.2 Cg_endo -75.06 -27.48 9.88 Favored 'Trans proline' 0 C--N 1.36 1.143 0 O-C-N 124.432 1.754 . . . . 74.420000000000002 110.955 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -59.26 -53.9 52.99 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.49 1.118 . . . . 75.409999999999997 110.412 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 205' ' ' GLN . . . . . 0.407 ' O ' ' C ' ' A' ' 206' ' ' VAL . 13.3 mt-30 -56.02 -64.03 0.99 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.512 1.132 . . . . 70.5 110.274 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 206' ' ' VAL . . . . . 0.693 HG21 ' CD2' ' A' ' 100' ' ' LEU . 3.0 p -39.75 -40.43 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.442 1.089 . . . . 74.200000000000003 109.255 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.83 -63.96 0.96 Allowed 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.521 1.138 . . . . 74.140000000000001 110.227 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -54.68 -64.09 0.95 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.498 1.124 . . . . 72.239999999999995 110.305 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 209' ' ' ILE . . . . . 0.674 HD12 HD23 ' A' ' 195' ' ' LEU . 3.7 mt -42.44 -60.64 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.506 1.128 . . . . 71.340000000000003 109.336 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 210' ' ' PHE . . . . . 0.617 ' CD2' HG23 ' A' ' 206' ' ' VAL . 0.4 OUTLIER -101.05 70.09 1.33 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.524 1.14 . . . . 61.409999999999997 110.989 179.981 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.71 143.53 41.06 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.492 1.12 . . . . 74.239999999999995 110.331 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 215' ' ' TYR . 19.1 tt0 -49.03 -55.15 12.89 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.513 1.133 . . . . 74.239999999999995 110.322 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -46.38 -25.19 0.6 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.411 1.069 . . . . 71.409999999999997 109.966 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 8.6 t -94.81 -32.92 4.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.484 1.115 . . . . 70.219999999999999 109.341 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 215' ' ' TYR . . . . . 0.556 ' CE1' ' HG3' ' A' ' 80' ' ' LYS . 29.9 t80 -61.25 -19.65 61.94 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.552 1.158 . . . . 73.439999999999998 110.975 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 216' ' ' LYS . . . . . 0.423 ' N ' ' HD2' ' A' ' 216' ' ' LYS . 3.7 mmmt -62.5 -66.13 0.59 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.523 1.139 . . . . 62.130000000000003 109.33 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 217' ' ' THR . . . . . 0.84 HG22 HD11 ' A' ' 221' ' ' ILE . 1.9 m -48.93 -64.31 0.84 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.501 1.126 . . . . 70.239999999999995 110.379 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 218' ' ' GLN . . . . . 0.658 ' HA ' HD12 ' A' ' 221' ' ' ILE . 7.8 mp0 -43.02 -63.64 0.77 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.478 1.111 . . . . 70.540000000000006 110.279 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -50.41 -29.92 11.27 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.467 1.104 . . . . 61.210000000000001 110.29 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 220' ' ' THR . . . . . 0.406 ' HB ' ' O ' ' A' ' 217' ' ' THR . 0.9 OUTLIER -79.27 -29.77 42.71 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.531 1.144 . . . . 72.420000000000002 110.417 179.971 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 221' ' ' ILE . . . . . 0.84 HD11 HG22 ' A' ' 217' ' ' THR . 14.1 mt -76.83 -27.66 16.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.593 1.183 . . . . 71.209999999999994 109.301 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 222' ' ' TRP . . . . . 0.753 ' O ' HG22 ' A' ' 225' ' ' THR . 23.0 t90 -77.94 -55.3 5.42 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.564 1.165 . . . . 72.549999999999997 108.002 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -20.91 22.86 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.518 1.136 . . . . 71.400000000000006 109.34 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 81.5 mt-10 -86.58 -46.19 10.36 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.559 1.162 . . . . 70.239999999999995 110.352 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.753 HG22 ' O ' ' A' ' 222' ' ' TRP . 4.3 t -53.42 -19.78 3.91 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.501 1.126 . . . . 73.530000000000001 110.402 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 226' ' ' ARG . . . . . 0.409 ' CG ' ' O ' ' A' ' 222' ' ' TRP . 0.1 OUTLIER -78.13 -31.74 50.0 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.418 1.073 . . . . 64.099999999999994 110.322 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 227' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -66.61 -44.07 83.09 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.481 1.113 . . . . 44.530000000000001 109.273 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 228' ' ' MET . . . . . 0.462 ' O ' ' N ' ' A' ' 232' ' ' GLN . 26.6 mtt -56.48 -72.01 0.08 Allowed 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.552 1.158 . . . . 63.549999999999997 110.968 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 229' ' ' VAL . . . . . 0.455 ' O ' ' C ' ' A' ' 230' ' ' GLN . 5.1 m -40.81 -47.02 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.534 1.146 . . . . 75.310000000000002 109.308 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 230' ' ' GLN . . . . . 0.455 ' C ' ' O ' ' A' ' 229' ' ' VAL . 0.2 OUTLIER -33.97 -72.4 0.05 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.456 1.097 . . . . 72.140000000000001 110.27 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -134.04 51.57 2.12 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.476 1.11 . . . . 63.43 110.281 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 232' ' ' GLN . . . . . 0.462 ' N ' ' O ' ' A' ' 228' ' ' MET . 53.3 mt-30 -155.44 -41.44 0.08 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.474 1.109 . . . . 63.509999999999998 110.346 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 233' ' ' PHE . . . . . 0.437 ' C ' ' HA ' ' A' ' 229' ' ' VAL . 0.5 OUTLIER -136.15 53.1 1.95 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.539 1.149 . . . . 73.239999999999995 111.052 179.977 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 3.6 tt -50.48 157.39 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.485 1.115 . . . . 74.439999999999998 109.311 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.439 0 O-C-N 124.467 1.104 . . . . 52.119999999999997 109.318 179.992 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.954 0 N-CA-C 110.956 -0.858 . . . . 51.039999999999999 110.956 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.454 ' HG2' ' CB ' ' A' ' 74' ' ' SER . 18.2 Cg_endo -75.0 150.6 38.41 Favored 'Trans proline' 0 C--N 1.361 1.199 0 O-C-N 124.509 1.794 . . . . 73.150000000000006 111.04 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.644 HD13 ' O ' ' A' ' 72' ' ' LEU . 0.3 OUTLIER -67.96 -48.15 66.64 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.441 1.088 . . . . 72.209999999999994 109.305 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -117.45 70.56 0.3 Allowed Glycine 0 CA--C 1.53 1.022 0 O-C-N 124.461 1.1 . . . . 73.099999999999994 111.037 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.454 ' CB ' ' HG2' ' A' ' 71' ' ' PRO . 2.1 p -69.93 169.81 12.48 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.469 0.747 . . . . 75.409999999999997 109.959 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -56.6 121.14 9.03 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.444 1.09 . . . . 75.450000000000003 110.305 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -114.23 132.96 55.94 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.499 1.124 . . . . 71.439999999999998 110.317 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 2.8 p -134.59 151.83 32.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.419 1.074 . . . . 55.329999999999998 109.321 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -89.19 31.09 0.9 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.563 1.164 . . . . 73.200000000000003 111.032 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 24.6 tp -39.73 147.12 0.09 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.488 1.117 . . . . 52.210000000000001 109.28 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.44 ' CD ' ' O ' ' A' ' 107' ' ' LYS . 0.5 OUTLIER -89.82 -62.74 1.4 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.555 1.16 . . . . 75.109999999999999 109.321 179.945 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 1.076 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.9 OUTLIER -165.5 129.94 2.37 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.568 1.168 . . . . 51.539999999999999 110.992 179.953 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.676 ' CG1' HG22 ' A' ' 135' ' ' THR . 11.0 p -85.37 166.9 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.48 1.112 . . . . 75.049999999999997 109.298 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 1.076 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 1.7 mp -128.26 92.76 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.482 1.114 . . . . 65.430000000000007 109.311 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.899 HD11 ' HB3' ' A' ' 128' ' ' ALA . 3.3 mt -70.53 98.93 1.54 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.556 1.16 . . . . 72.340000000000003 109.216 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.631 ' CD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -120.32 174.4 6.54 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.448 1.093 . . . . 73.209999999999994 109.639 179.895 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.714 ' HB2' ' CD1' ' A' ' 143' ' ' PHE . . . -111.84 164.22 13.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.473 1.108 . . . . 62.43 109.263 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.442 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 14.4 tt0 -68.27 -8.78 42.36 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.488 1.118 . . . . 65.040000000000006 110.267 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -80.37 -38.45 30.39 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.516 1.135 . . . . 72.510000000000005 109.344 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.564 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -137.7 44.23 2.22 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.482 1.114 . . . . 44.109999999999999 109.349 -179.961 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.596 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -77.62 -30.09 52.15 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.465 1.103 . . . . 75.219999999999999 110.403 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.78 -25.53 61.2 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.555 1.159 . . . . 63.310000000000002 109.291 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.484 ' CG ' ' ND2' ' A' ' 177' ' ' ASN . 0.2 OUTLIER -76.62 -58.4 3.31 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.476 1.11 . . . . 73.040000000000006 110.277 -179.976 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.99 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -54.88 -19.56 6.87 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.479 1.112 . . . . 43.439999999999998 109.353 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.818 HD22 ' O ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -89.8 -50.07 6.26 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.501 1.125 . . . . 73.299999999999997 109.234 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.695 ' N ' HD13 ' A' ' 94' ' ' LEU . 38.4 tpt85 -46.8 -31.48 3.05 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.53 1.144 . . . . 75.129999999999995 110.326 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.588 HG13 ' N ' ' A' ' 97' ' ' GLN . 10.9 p -83.16 -55.85 6.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.525 1.141 . . . . 75.310000000000002 109.284 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.723 ' C ' HE21 ' A' ' 97' ' ' GLN . 0.0 OUTLIER -47.61 -24.08 0.81 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.497 1.123 . . . . 72.200000000000003 110.315 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.402 ' O ' ' HG3' ' A' ' 101' ' ' GLN . 0.1 OUTLIER -75.48 -38.56 59.47 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.464 1.102 . . . . 63.140000000000001 109.345 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.737 ' C ' HD23 ' A' ' 99' ' ' LEU . 0.0 OUTLIER -84.63 -19.3 33.16 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.418 1.074 . . . . 74.510000000000005 109.353 179.951 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.873 HD22 HG11 ' A' ' 206' ' ' VAL . 90.3 mt -79.76 -20.22 46.84 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.465 1.103 . . . . 52.119999999999997 109.243 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.535 ' O ' ' HD3' ' A' ' 107' ' ' LYS . 0.7 OUTLIER -88.98 -11.93 42.92 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.523 1.14 . . . . 73.150000000000006 110.324 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.467 ' O ' ' C ' ' A' ' 103' ' ' ASP . 30.6 t70 -116.2 -57.15 2.24 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.426 1.078 . . . . 74.140000000000001 109.304 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.537 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 51.5 t0 -34.78 -64.78 0.24 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.528 1.142 . . . . 71.329999999999998 109.321 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.534 ' CZ ' ' OD1' ' A' ' 103' ' ' ASP . 4.4 m-85 -104.08 -32.31 9.25 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.508 1.13 . . . . 70.5 110.959 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.482 ' O ' ' N ' ' A' ' 107' ' ' LYS . . . 109.51 27.08 4.85 Favored Glycine 0 CA--C 1.529 0.939 0 O-C-N 124.581 1.175 . . . . 61.350000000000001 110.974 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.521 HG22 ' CE1' ' A' ' 81' ' ' PHE . 28.4 mm -63.98 75.63 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.408 0.711 . . . . 74.109999999999999 109.358 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.535 ' HD3' ' O ' ' A' ' 101' ' ' GLN . 0.3 OUTLIER -129.07 157.14 76.84 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.493 1.121 . . . . 74.319999999999993 109.317 -179.927 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.532 ' HA ' ' HB3' ' A' ' 107' ' ' LYS . 18.4 Cg_endo -75.04 132.0 26.11 Favored 'Cis proline' 0 C--N 1.36 1.166 0 C-N-CA 120.953 -2.52 . . . . 72.150000000000006 110.983 0.02 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.442 ' N ' ' HA ' ' A' ' 107' ' ' LYS . . . -105.17 116.67 5.33 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.54 1.15 . . . . 75.010000000000005 111.009 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -129.69 148.26 33.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.503 0.766 . . . . 75.349999999999994 109.332 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.741 HD13 ' HB2' ' A' ' 94' ' ' LEU . 41.8 pt -98.73 -175.76 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.515 1.134 . . . . 62.030000000000001 109.328 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.709 ' HE1' ' HB2' ' A' ' 128' ' ' ALA . 0.6 OUTLIER -82.14 -18.55 42.49 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.526 1.141 . . . . 74.040000000000006 110.93 -179.986 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -94.49 -3.08 50.62 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.559 1.162 . . . . 52.439999999999998 109.352 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -104.65 -26.63 12.24 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.501 1.126 . . . . 55.25 110.317 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 4.8 ttm -48.28 141.14 9.09 Favored Pre-proline 0 C--N 1.326 -0.444 0 O-C-N 124.511 1.132 . . . . 72.129999999999995 110.984 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.94 -66.61 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.191 0 O-C-N 124.562 1.822 . . . . 72.430000000000007 111.071 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 37.2 t-80 -41.61 160.99 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.543 1.152 . . . . 71.510000000000005 109.574 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 82.99 63.41 1.74 Allowed Glycine 0 CA--C 1.531 1.059 0 O-C-N 124.546 1.154 . . . . 63.549999999999997 111.004 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 4.3 tmm_? -60.6 -39.97 90.11 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.536 0.786 . . . . 75.340000000000003 110.302 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -103.29 -66.78 0.92 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.525 1.141 . . . . 75.319999999999993 110.331 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' HIS . . . . . 0.502 ' CG ' ' N ' ' A' ' 122' ' ' LEU . 3.0 t-80 -171.0 164.38 7.53 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.428 1.08 . . . . 71.030000000000001 109.634 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.676 HD22 ' O ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -148.25 143.14 26.78 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.438 1.086 . . . . 53.020000000000003 109.347 179.984 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 16.4 pm0 -121.96 8.5 9.89 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.505 1.128 . . . . 74.510000000000005 110.26 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 34.4 m-20 -89.38 105.24 17.67 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.519 1.137 . . . . 60.200000000000003 109.287 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.584 HD21 ' OD1' ' A' ' 150' ' ' ASN . 1.6 mm? -58.52 -32.31 68.72 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 124.535 1.147 . . . . 75.340000000000003 109.318 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.478 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 7.6 t70 -54.96 -19.74 7.43 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.537 1.148 . . . . 75.450000000000003 109.271 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.666 ' OD2' HD23 ' A' ' 122' ' ' LEU . 51.2 m-20 -59.25 -70.32 0.16 Allowed 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.517 1.136 . . . . 73.209999999999994 109.308 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.899 ' HB3' HD11 ' A' ' 84' ' ' LEU . . . -74.66 -17.48 60.68 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.534 1.147 . . . . 50.539999999999999 109.304 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.783 HG21 HD11 ' A' ' 157' ' ' LEU . 86.9 t -93.07 30.8 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.456 1.098 . . . . 74.310000000000002 109.302 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.478 ' CB ' ' O ' ' A' ' 126' ' ' ASP . 23.5 t30 -147.47 133.37 19.1 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.445 1.091 . . . . 72.409999999999997 109.244 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 71.82 55.51 7.27 Favored Glycine 0 CA--C 1.53 1.005 0 O-C-N 124.474 1.109 . . . . 64.120000000000005 111.018 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.46 173.8 12.68 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.444 0.732 . . . . 45.149999999999999 109.992 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.79 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -101.73 -30.76 11.13 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.487 1.117 . . . . 72.439999999999998 109.287 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.79 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 2.5 m-90 -158.86 177.15 11.47 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.953 -1.129 . . . . 75.150000000000006 107.953 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.676 HG22 ' CG1' ' A' ' 82' ' ' VAL . 25.3 p -151.45 124.02 8.43 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.479 1.112 . . . . 54.420000000000002 110.435 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 1.01 ' O ' HD23 ' A' ' 137' ' ' LEU . 1.1 mp -84.09 140.66 15.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 O-C-N 124.533 1.146 . . . . 64.409999999999997 109.304 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 1.01 HD23 ' O ' ' A' ' 136' ' ' ILE . 9.0 mt -131.17 100.66 5.28 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.577 1.173 . . . . 71.019999999999996 109.26 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.99 HD21 ' HB2' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -62.67 107.21 0.91 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.533 1.145 . . . . 74.230000000000004 109.31 179.985 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.53 HD13 ' HA ' ' A' ' 139' ' ' LEU . 0.5 OUTLIER -68.91 108.63 3.56 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.495 1.122 . . . . 73.329999999999998 109.241 -179.977 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.756 HG23 ' OD1' ' A' ' 178' ' ' ASN . 2.8 m -123.87 162.06 24.06 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.431 1.082 . . . . 70.340000000000003 110.395 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -62.37 -37.81 87.13 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.534 1.146 . . . . 72.140000000000001 110.248 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -89.67 -52.9 4.77 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.519 1.137 . . . . 73.400000000000006 109.279 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.714 ' CD1' ' HB2' ' A' ' 86' ' ' ALA . 49.7 t80 -49.13 -24.5 1.68 Allowed 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.534 1.147 . . . . 74.430000000000007 111.02 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.646 ' C ' HD13 ' A' ' 144' ' ' LEU . 2.2 tm? -58.16 -68.37 0.26 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.514 1.134 . . . . 61.140000000000001 109.26 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.602 ' N ' HD13 ' A' ' 144' ' ' LEU . 0.6 OUTLIER -57.64 -16.67 11.24 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.46 1.1 . . . . 74.349999999999994 110.298 -179.984 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -75.17 -38.12 60.98 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.485 1.115 . . . . 74.120000000000005 109.324 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.541 ' O ' ' CG ' ' A' ' 151' ' ' PHE . 2.3 p -101.14 -7.61 23.0 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.437 1.086 . . . . 72.310000000000002 110.449 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.425 ' HA ' ' CE3' ' A' ' 148' ' ' TRP . 1.0 OUTLIER -94.68 -25.14 16.85 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.959 -1.126 . . . . 74.150000000000006 107.959 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 42.7 t -88.57 -45.46 9.87 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.502 1.126 . . . . 62.420000000000002 108.253 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' ASN . . . . . 0.584 ' OD1' HD21 ' A' ' 125' ' ' LEU . 2.7 t-20 -61.83 -54.2 45.46 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.441 1.088 . . . . 62.109999999999999 109.316 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.541 ' CG ' ' O ' ' A' ' 147' ' ' THR . 4.9 m-30 -53.41 -52.88 57.95 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.507 1.129 . . . . 64.5 110.95 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -39.39 -48.69 1.95 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.518 1.137 . . . . 62.219999999999999 110.334 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -81.33 -28.23 34.62 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.372 1.045 . . . . 70.030000000000001 111.03 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.431 ' N ' ' O ' ' A' ' 151' ' ' PHE . 4.5 m-85 -113.6 86.57 2.42 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 124.464 1.103 . . . . 73.340000000000003 111.035 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 155' ' ' THR . . . . . 0.413 ' O ' ' N ' ' A' ' 158' ' ' MET . 1.1 t -61.25 -14.14 23.85 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.481 1.113 . . . . 72.049999999999997 110.36 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 12.5 t -46.64 -34.56 5.15 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.464 1.103 . . . . 72.040000000000006 109.993 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.783 HD11 HG21 ' A' ' 129' ' ' VAL . 0.4 OUTLIER -88.44 -29.32 20.27 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.403 1.064 . . . . 72.329999999999998 109.267 -179.992 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 158' ' ' MET . . . . . 0.456 ' HA ' ' CE ' ' A' ' 158' ' ' MET . 23.1 mmt -62.07 -24.25 66.99 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.491 1.12 . . . . 75.319999999999993 110.984 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 159' ' ' ASN . . . . . 0.43 ' OD1' ' N ' ' A' ' 160' ' ' SER . 24.8 p30 -92.92 -19.37 21.71 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.466 1.104 . . . . 64.230000000000004 109.289 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.601 ' HB2' HG21 ' A' ' 170' ' ' VAL . 1.4 m -81.29 -34.31 32.07 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.522 1.139 . . . . 72.310000000000002 110.017 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 161' ' ' VAL . . . . . 0.585 ' O ' HD11 ' A' ' 192' ' ' ILE . 7.6 m -60.65 -17.98 16.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.584 1.177 . . . . 75.340000000000003 109.346 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 162' ' ' ASN . . . . . 0.429 ' CB ' ' HG3' ' A' ' 164' ' ' GLN . 49.3 m-20 -66.94 -10.37 48.39 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.53 1.144 . . . . 75.430000000000007 109.299 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.477 ' CD ' HG12 ' A' ' 192' ' ' ILE . 21.6 mtp180 65.06 18.67 11.58 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.442 1.089 . . . . 75.150000000000006 110.285 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 164' ' ' GLN . . . . . 0.429 ' HG3' ' CB ' ' A' ' 162' ' ' ASN . 85.2 mt-30 -45.94 171.82 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.511 1.132 . . . . 74.439999999999998 110.291 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 15.7 p80 -86.14 59.24 5.52 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.467 1.104 . . . . 72.299999999999997 109.579 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.551 ' HG3' ' CD1' ' A' ' 167' ' ' TYR . 0.8 OUTLIER -107.96 144.06 35.77 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.493 1.121 . . . . 71.439999999999998 109.284 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 167' ' ' TYR . . . . . 0.743 ' CE2' ' ND2' ' A' ' 168' ' ' ASN . 16.2 p90 -38.42 -47.59 1.27 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.462 1.101 . . . . 70.319999999999993 110.932 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.743 ' ND2' ' CE2' ' A' ' 167' ' ' TYR . 12.2 p30 -92.67 132.09 37.2 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.533 1.146 . . . . 74.120000000000005 109.235 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.485 ' HB3' ' CD1' ' A' ' 134' ' ' TRP . 13.9 t -124.04 145.13 49.43 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.45 1.093 . . . . 63.520000000000003 110.003 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.831 ' O ' HD12 ' A' ' 171' ' ' ILE . 4.8 t -106.21 123.72 61.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.518 1.136 . . . . 64.340000000000003 109.292 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.831 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.6 mp -131.37 109.61 14.95 Favored Pre-proline 0 C--N 1.325 -0.474 0 O-C-N 124.452 1.095 . . . . 63.539999999999999 109.309 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 172' ' ' PRO . . . . . 0.645 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.99 110.68 3.16 Favored 'Trans proline' 0 C--N 1.36 1.16 0 O-C-N 124.49 1.784 . . . . 63.329999999999998 111.035 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 173' ' ' MET . . . . . 0.683 ' CE ' HD12 ' A' ' 195' ' ' LEU . 4.0 ttt -94.83 156.66 16.27 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.455 1.097 . . . . 54.450000000000003 110.973 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 174' ' ' ARG . . . . . 0.441 ' N ' ' HG2' ' A' ' 173' ' ' MET . 17.0 mmt85 -111.9 118.85 45.72 Favored Pre-proline 0 C--N 1.325 -0.458 0 O-C-N 124.528 1.142 . . . . 71.540000000000006 110.256 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 175' ' ' PRO . . . . . 0.478 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.3 Cg_endo -74.95 152.03 40.5 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.502 1.791 . . . . 73.319999999999993 110.997 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.609 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.1 OUTLIER -85.26 -44.13 13.14 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.536 1.147 . . . . 71.150000000000006 109.353 179.946 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 177' ' ' ASN . . . . . 0.484 ' ND2' ' CG ' ' A' ' 92' ' ' GLU . 4.9 p30 -71.14 -28.05 64.0 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.524 1.14 . . . . 54.329999999999998 109.259 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 178' ' ' ASN . . . . . 0.756 ' OD1' HG23 ' A' ' 140' ' ' THR . 1.4 m-80 -110.79 98.58 38.51 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.48 1.113 . . . . 60.140000000000001 109.27 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.97 116.36 4.57 Favored 'Trans proline' 0 C--N 1.36 1.133 0 O-C-N 124.556 1.819 . . . . 74.209999999999994 111.012 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.544 HD13 ' HB2' ' A' ' 184' ' ' ARG . 0.5 OUTLIER -127.57 96.45 32.92 Favored Pre-proline 0 C--N 1.325 -0.48 0 O-C-N 124.5 1.125 . . . . 72.109999999999999 109.312 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.97 171.67 17.87 Favored 'Trans proline' 0 C--N 1.36 1.162 0 O-C-N 124.509 1.794 . . . . 73.109999999999999 111.031 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 -60.04 -23.69 63.94 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.48 1.113 . . . . 71.230000000000004 110.346 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -68.85 -15.49 63.51 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.443 1.089 . . . . 72.439999999999998 110.31 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 184' ' ' ARG . . . . . 0.544 ' HB2' HD13 ' A' ' 180' ' ' LEU . 35.0 mmt180 -111.1 -28.45 8.29 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.462 1.101 . . . . 72.209999999999994 110.36 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 185' ' ' THR . . . . . 0.497 HG23 ' HD2' ' A' ' 186' ' ' PRO . 54.1 m -72.86 143.72 84.68 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.407 1.067 . . . . 74.010000000000005 110.413 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 186' ' ' PRO . . . . . 0.563 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -75.01 148.39 35.18 Favored 'Trans proline' 0 C--N 1.36 1.17 0 O-C-N 124.503 1.791 . . . . 72.040000000000006 110.977 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 187' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -60.85 -12.4 10.83 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.453 1.096 . . . . 74.299999999999997 111.05 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 188' ' ' ALA . . . . . 0.701 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -88.56 -53.93 4.41 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.474 1.109 . . . . 53.450000000000003 109.391 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.563 HD12 ' CG ' ' A' ' 186' ' ' PRO . 37.1 mt -74.4 -14.91 60.92 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.51 1.131 . . . . 64.430000000000007 109.321 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -85.66 -11.4 53.91 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.56 1.163 . . . . 75.329999999999998 110.31 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 191' ' ' THR . . . . . . . . . . . . . 21.9 p -113.87 1.47 14.77 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.556 1.16 . . . . 64.109999999999999 110.385 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.701 HD12 ' O ' ' A' ' 188' ' ' ALA . 3.1 mt -99.37 163.74 2.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.465 1.103 . . . . 73.319999999999993 109.299 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 193' ' ' ASN . . . . . 0.49 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 13.5 t-20 -66.65 73.41 0.09 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.539 1.149 . . . . 61.25 109.306 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 194' ' ' ALA . . . . . 0.645 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -66.69 143.66 56.83 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.592 1.182 . . . . 63.409999999999997 109.293 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 195' ' ' LEU . . . . . 0.683 HD12 ' CE ' ' A' ' 173' ' ' MET . 0.2 OUTLIER -84.66 129.98 34.77 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.529 1.143 . . . . 71.420000000000002 109.266 179.995 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -104.88 117.4 33.95 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.531 1.145 . . . . 71.200000000000003 110.336 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.482 ' HG2' ' CD2' ' A' ' 176' ' ' LEU . 1.3 tt0 -101.82 -33.23 9.89 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.533 1.146 . . . . 72.340000000000003 110.285 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 198' ' ' GLU . . . . . 0.469 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -90.0 23.04 2.93 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.527 1.142 . . . . 63.539999999999999 110.303 -179.979 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -128.57 147.34 50.7 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.492 1.12 . . . . 73.219999999999999 110.009 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.81 -19.5 65.88 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.459 1.099 . . . . 63.039999999999999 110.264 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -89.13 21.27 28.71 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 124.448 1.093 . . . . 64.5 110.988 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 202' ' ' PHE . . . . . 0.826 ' O ' HG23 ' A' ' 206' ' ' VAL . 5.6 t80 -65.21 -39.32 34.75 Favored Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.509 0.77 . . . . 75.439999999999998 110.977 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 203' ' ' PRO . . . . . 0.686 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.05 -38.71 1.45 Allowed 'Trans proline' 0 C--N 1.359 1.116 0 O-C-N 124.505 1.792 . . . . 72.530000000000001 110.956 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -50.9 -59.9 3.65 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.483 1.114 . . . . 75.200000000000003 110.387 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -59.02 -47.55 84.8 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.484 1.115 . . . . 73.129999999999995 110.313 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 206' ' ' VAL . . . . . 0.873 HG11 HD22 ' A' ' 100' ' ' LEU . 82.6 t -57.27 -29.69 33.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.463 1.102 . . . . 71.409999999999997 109.257 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.08 -35.75 49.02 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.521 1.138 . . . . 74.420000000000002 110.365 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 64.8 mtt-85 -81.26 -68.23 0.71 Allowed 'General case' 0 C--N 1.327 -0.412 0 O-C-N 124.459 1.1 . . . . 50.200000000000003 110.299 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 209' ' ' ILE . . . . . 0.827 HG22 ' CE1' ' A' ' 210' ' ' PHE . 73.3 mt -41.47 -43.32 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.527 1.142 . . . . 64.439999999999998 109.313 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 210' ' ' PHE . . . . . 0.827 ' CE1' HG22 ' A' ' 209' ' ' ILE . 1.5 m-85 -112.02 66.89 0.64 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.538 1.148 . . . . 71.329999999999998 110.962 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -110.65 147.39 34.39 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.537 1.148 . . . . 75.219999999999999 110.286 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.449 ' O ' ' N ' ' A' ' 215' ' ' TYR . 27.9 tt0 -49.14 -55.52 12.07 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.537 1.148 . . . . 72.420000000000002 110.274 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -48.38 -23.93 1.08 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.437 1.086 . . . . 61.409999999999997 109.976 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.528 ' O ' ' NE2' ' A' ' 218' ' ' GLN . 13.4 t -95.9 -29.31 3.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.449 1.093 . . . . 63.119999999999997 109.28 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 215' ' ' TYR . . . . . 0.449 ' N ' ' O ' ' A' ' 212' ' ' GLU . 17.2 t80 -63.78 -33.89 76.67 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.619 1.199 . . . . 74.129999999999995 111.059 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 51.3 mmtt -57.33 -66.32 0.48 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.548 1.155 . . . . 72.430000000000007 109.253 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 217' ' ' THR . . . . . 1.084 HG22 HD11 ' A' ' 221' ' ' ILE . 17.3 m -45.3 -66.56 0.38 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.497 1.123 . . . . 63.009999999999998 110.378 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 218' ' ' GLN . . . . . 0.638 ' HA ' HD12 ' A' ' 221' ' ' ILE . 2.6 mp0 -42.01 -45.7 3.94 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.473 1.108 . . . . 74.329999999999998 110.32 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 219' ' ' GLN . . . . . 0.444 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 18.9 tp60 -62.85 -39.41 94.31 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.504 1.127 . . . . 75.420000000000002 110.315 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 220' ' ' THR . . . . . 0.46 ' O ' ' CG ' ' A' ' 224' ' ' GLU . 1.0 OUTLIER -77.66 -17.71 57.44 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.57 1.169 . . . . 71.129999999999995 110.418 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 221' ' ' ILE . . . . . 1.084 HD11 HG22 ' A' ' 217' ' ' THR . 35.2 mt -83.64 -40.28 15.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.477 1.111 . . . . 61.340000000000003 109.301 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 222' ' ' TRP . . . . . 1.011 ' O ' HG22 ' A' ' 225' ' ' THR . 27.7 t90 -64.11 -54.98 25.35 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.546 1.153 . . . . 75.120000000000005 108.042 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -20.23 52.64 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.485 1.116 . . . . 71.540000000000006 109.318 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 224' ' ' GLU . . . . . 0.46 ' CG ' ' O ' ' A' ' 220' ' ' THR . 79.6 mt-10 -91.97 -26.41 18.41 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.543 1.152 . . . . 74.310000000000002 110.302 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 225' ' ' THR . . . . . 1.011 HG22 ' O ' ' A' ' 222' ' ' TRP . 5.9 t -63.25 -21.22 66.1 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.542 1.151 . . . . 70.109999999999999 110.467 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -76.92 -17.06 59.17 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.428 1.08 . . . . 63.32 110.253 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 227' ' ' ASN . . . . . 0.403 ' O ' ' N ' ' A' ' 231' ' ' ARG . 2.3 m120 -86.81 -42.83 12.97 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.456 1.097 . . . . 74.420000000000002 109.295 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 10.7 mtt -58.16 -40.59 81.78 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.518 1.136 . . . . 64.319999999999993 110.998 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 229' ' ' VAL . . . . . 0.461 HG13 ' N ' ' A' ' 230' ' ' GLN . 11.4 p -67.25 -49.44 72.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.504 1.127 . . . . 74.120000000000005 109.293 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 230' ' ' GLN . . . . . 0.461 ' N ' HG13 ' A' ' 229' ' ' VAL . 2.7 tp60 -74.76 -4.6 38.51 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.473 1.108 . . . . 64.340000000000003 110.29 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 231' ' ' ARG . . . . . 0.403 ' N ' ' O ' ' A' ' 227' ' ' ASN . 16.8 tpp85 -90.99 -81.68 0.31 Allowed 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.472 1.108 . . . . 53.539999999999999 110.302 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -143.22 41.84 1.51 Allowed 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.498 1.124 . . . . 54.140000000000001 110.267 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -151.25 41.49 0.73 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.46 1.1 . . . . 75.310000000000002 111.022 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 5.1 mm -46.66 142.78 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.47 1.106 . . . . 74.230000000000004 109.295 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.482 0 O-C-N 124.431 1.082 . . . . 53.140000000000001 109.286 179.977 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.958 0 N-CA-C 111.009 -0.837 . . . . 54.420000000000002 111.009 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.03 141.28 26.36 Favored 'Trans proline' 0 C--N 1.361 1.221 0 O-C-N 124.457 1.767 . . . . 73.430000000000007 110.928 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.443 HD22 ' HA ' ' A' ' 72' ' ' LEU . 0.5 OUTLIER -48.7 -72.28 0.05 Allowed 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.535 1.147 . . . . 72.200000000000003 109.278 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -136.35 106.41 0.56 Allowed Glycine 0 CA--C 1.53 0.981 0 O-C-N 124.486 1.116 . . . . 63.340000000000003 111.011 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 87.3 p -134.53 165.62 24.77 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.513 0.772 . . . . 71.230000000000004 110.043 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -72.49 154.04 41.05 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.416 1.073 . . . . 74.209999999999994 110.313 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.18 141.41 39.96 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.514 1.134 . . . . 74.430000000000007 110.312 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.516 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 6.4 p -149.56 157.42 6.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.424 1.078 . . . . 71.329999999999998 109.312 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.413 ' O ' ' C ' ' A' ' 79' ' ' LEU . 26.8 m-85 -87.95 23.5 2.04 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.531 1.144 . . . . 74.25 111.034 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.667 HD11 HG22 ' A' ' 110' ' ' ILE . 12.5 tp -39.63 155.26 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.52 1.137 . . . . 70.510000000000005 109.278 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.756 ' NZ ' ' H ' ' A' ' 107' ' ' LYS . 27.4 ttpt -100.49 -60.61 1.49 Allowed 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.497 1.123 . . . . 64.109999999999999 109.312 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 1.228 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.2 OUTLIER -156.99 132.83 9.48 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.487 1.117 . . . . 65.319999999999993 111.038 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.886 ' CG1' HG22 ' A' ' 135' ' ' THR . 7.2 p -96.8 168.47 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.528 1.142 . . . . 55.229999999999997 109.368 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 1.228 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 4.2 mp -130.67 101.32 5.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.529 1.143 . . . . 64.140000000000001 109.326 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.115 HD11 ' HB1' ' A' ' 128' ' ' ALA . 3.7 mp -75.73 124.28 27.01 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.504 1.127 . . . . 75.25 109.317 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.824 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -146.27 174.4 11.37 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.455 1.097 . . . . 72.299999999999997 109.614 -179.99 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.44 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -115.82 164.3 14.59 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.508 1.13 . . . . 71.430000000000007 109.338 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -57.45 -17.28 12.41 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.532 1.145 . . . . 71.530000000000001 110.255 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -78.56 -45.56 21.51 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.536 1.148 . . . . 74.409999999999997 109.31 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.877 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.9 OUTLIER -121.63 44.14 2.64 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.452 1.095 . . . . 73.420000000000002 109.269 -179.973 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.596 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -77.63 -48.24 17.32 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.493 1.12 . . . . 73.420000000000002 110.371 -179.958 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -67.84 -19.45 65.05 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.471 1.107 . . . . 62.310000000000002 109.332 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.03 -56.93 5.67 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.458 1.099 . . . . 72.430000000000007 110.298 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 1.038 ' HB1' ' CG2' ' A' ' 83' ' ' ILE . . . -68.4 -22.77 64.61 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.527 1.142 . . . . 61.229999999999997 109.268 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.672 HD23 ' O ' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -82.68 -34.06 27.51 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.552 1.157 . . . . 71.439999999999998 109.378 179.927 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -67.3 -34.56 77.63 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.466 1.104 . . . . 73.239999999999995 110.274 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.578 HG13 ' N ' ' A' ' 97' ' ' GLN . 8.5 p -81.44 -55.29 8.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.554 1.159 . . . . 75.430000000000007 109.267 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.578 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -49.5 -20.95 0.82 Allowed 'General case' 0 C--N 1.326 -0.419 0 O-C-N 124.476 1.11 . . . . 74.140000000000001 110.35 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.493 ' O ' ' CG ' ' A' ' 101' ' ' GLN . 0.2 OUTLIER -78.94 -36.08 42.24 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.481 1.113 . . . . 70.340000000000003 109.287 -179.93 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.735 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -85.82 -20.0 29.82 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.52 1.137 . . . . 74.450000000000003 109.326 179.965 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.833 HD22 HG11 ' A' ' 206' ' ' VAL . 56.7 mt -78.98 -21.99 46.26 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.509 1.131 . . . . 70.219999999999999 109.323 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.621 ' HB2' ' CG ' ' A' ' 107' ' ' LYS . 0.2 OUTLIER -82.58 -15.15 53.3 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.497 1.123 . . . . 75.319999999999993 110.302 -179.99 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.494 ' O ' ' C ' ' A' ' 103' ' ' ASP . 13.3 t70 -116.09 -58.01 2.15 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.548 1.155 . . . . 60.219999999999999 109.284 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.551 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 28.1 t0 -32.31 -66.81 0.12 Allowed 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.478 1.111 . . . . 63.409999999999997 109.265 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.509 ' HE1' HD23 ' A' ' 100' ' ' LEU . 5.2 m-85 -102.12 -29.66 11.61 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.448 1.093 . . . . 65.010000000000005 110.98 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 107' ' ' LYS . . . 109.59 16.67 10.64 Favored Glycine 0 CA--C 1.531 1.054 0 O-C-N 124.526 1.141 . . . . 4.1200000000000001 110.982 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.667 ' HA ' ' HZ1' ' A' ' 80' ' ' LYS . 36.8 mm -54.45 85.78 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.488 0.757 . . . . 62.340000000000003 109.259 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.756 ' H ' ' NZ ' ' A' ' 80' ' ' LYS . 4.5 mtmp? -138.57 154.91 73.72 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.48 1.113 . . . . 71.099999999999994 109.292 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.5 Cg_endo -74.99 128.87 17.23 Favored 'Cis proline' 0 C--N 1.36 1.155 0 C-N-CA 121.041 -2.483 . . . . 73.030000000000001 111.034 -0.053 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.507 ' N ' ' HA ' ' A' ' 107' ' ' LYS . . . -105.93 122.91 7.29 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.597 1.186 . . . . 44.329999999999998 111.023 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.667 HG22 HD11 ' A' ' 79' ' ' LEU . 8.0 tt -144.74 157.38 14.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 O-C-N 124.469 0.746 . . . . 75.030000000000001 109.282 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.824 HD12 ' NE2' ' A' ' 85' ' ' HIS . 28.7 pt -93.66 -178.54 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.533 1.145 . . . . 72.109999999999999 109.373 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 1.228 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 0.9 OUTLIER -82.03 -22.76 36.28 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.458 1.099 . . . . 71.400000000000006 110.993 179.988 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -88.07 -3.36 58.9 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.499 1.124 . . . . 54.43 109.311 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.408 ' C ' HD11 ' A' ' 110' ' ' ILE . 19.8 mm-40 -107.45 -26.03 11.14 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.53 1.144 . . . . 73.140000000000001 110.335 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 3.8 ttm -45.64 138.54 5.22 Favored Pre-proline 0 C--N 1.325 -0.457 0 O-C-N 124.496 1.123 . . . . 64.239999999999995 111.046 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.85 118.75 5.4 Favored 'Trans proline' 0 C--N 1.359 1.116 0 O-C-N 124.515 1.797 . . . . 74.109999999999999 111.046 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 4.3 m80 -40.41 158.84 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.5 1.125 . . . . 73.230000000000004 109.61 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -166.96 -64.46 0.03 OUTLIER Glycine 0 CA--C 1.529 0.956 0 O-C-N 124.477 1.111 . . . . 74.140000000000001 110.997 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -79.75 178.34 8.24 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.446 0.733 . . . . 73.540000000000006 110.333 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.422 ' CD ' ' N ' ' A' ' 121' ' ' HIS . 0.9 OUTLIER -61.35 -78.42 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.485 1.116 . . . . 62.539999999999999 110.253 -179.926 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 121' ' ' HIS . . . . . 0.499 ' CG ' ' O ' ' A' ' 121' ' ' HIS . 0.8 OUTLIER -83.18 87.92 6.92 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.495 1.122 . . . . 72.150000000000006 109.551 -179.984 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.71 HD13 ' O ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -56.3 169.69 0.41 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.484 1.115 . . . . 74.140000000000001 109.316 179.939 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.698 ' N ' HD22 ' A' ' 122' ' ' LEU . 31.3 mt-30 57.17 54.71 6.57 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.505 1.128 . . . . 71.530000000000001 110.356 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.403 ' O ' ' C ' ' A' ' 125' ' ' LEU . 13.5 t-20 -108.57 127.57 54.06 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.525 1.141 . . . . 71.030000000000001 109.32 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.581 ' O ' HG23 ' A' ' 129' ' ' VAL . 1.0 OUTLIER -40.03 -57.93 1.54 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.539 1.149 . . . . 74.329999999999998 109.298 179.979 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -42.67 -61.47 1.23 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.515 1.135 . . . . 72.219999999999999 109.32 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.443 ' O ' ' N ' ' A' ' 130' ' ' ASN . 6.5 m-20 -45.89 -63.23 1.02 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.5 1.125 . . . . 55.340000000000003 109.246 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 1.228 ' HB2' ' CE1' ' A' ' 112' ' ' PHE . . . -50.86 -26.79 6.24 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.498 1.124 . . . . 62.219999999999999 109.299 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.706 HG12 ' O ' ' A' ' 129' ' ' VAL . 99.1 t -94.08 30.87 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.525 1.141 . . . . 65.010000000000005 109.253 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.443 ' N ' ' O ' ' A' ' 127' ' ' ASP . 11.2 t-20 -152.55 145.28 24.3 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.547 1.154 . . . . 51.229999999999997 109.306 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 64.99 38.51 95.56 Favored Glycine 0 CA--C 1.53 0.997 0 O-C-N 124.423 1.077 . . . . 64.5 111.05 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 50.7 m -151.36 178.79 8.92 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.549 0.793 . . . . 74.340000000000003 110.02 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 80' ' ' LYS . . . -112.45 -42.09 3.74 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.573 1.171 . . . . 60.25 109.291 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.57 ' CZ2' ' HA ' ' A' ' 210' ' ' PHE . 14.6 m-90 -141.14 160.76 39.4 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.543 1.152 . . . . 65.219999999999999 107.933 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.886 HG22 ' CG1' ' A' ' 82' ' ' VAL . 1.7 p -145.28 125.54 13.84 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.456 1.098 . . . . 74.239999999999995 110.317 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.565 HD13 ' HE2' ' A' ' 81' ' ' PHE . 0.8 OUTLIER -84.42 134.89 25.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.488 1.117 . . . . 61.130000000000003 109.28 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.478 HD22 ' O ' ' A' ' 136' ' ' ILE . 2.2 mm? -117.92 96.81 5.52 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.502 1.127 . . . . 72.109999999999999 109.334 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.877 HD23 ' HB2' ' A' ' 89' ' ' ASP . 0.2 OUTLIER -62.64 104.84 0.57 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.498 1.124 . . . . 74.129999999999995 109.274 179.999 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.417 HD21 HD13 ' A' ' 189' ' ' LEU . 18.9 mt -78.22 111.56 14.29 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.54 1.15 . . . . 72.299999999999997 109.33 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.484 ' O ' ' CB ' ' A' ' 144' ' ' LEU . 9.6 m -139.67 159.46 42.11 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.505 1.128 . . . . 73.040000000000006 110.444 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -56.08 -36.51 68.19 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.47 1.106 . . . . 64.129999999999995 110.264 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -88.4 -52.04 5.41 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.501 1.126 . . . . 71.549999999999997 109.294 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.6 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 10.9 t80 -57.46 -19.8 26.42 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.521 1.138 . . . . 75.140000000000001 110.983 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.619 HD12 ' NH1' ' A' ' 145' ' ' ARG . 3.0 tm? -84.93 -52.64 5.86 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.582 1.176 . . . . 71.209999999999994 109.333 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.619 ' NH1' HD12 ' A' ' 144' ' ' LEU . 0.0 OUTLIER -55.85 -27.09 49.96 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.436 1.085 . . . . 63.229999999999997 110.32 179.967 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -79.13 -63.0 1.52 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.494 1.121 . . . . 73.230000000000004 109.279 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.565 HG21 ' CE1' ' A' ' 143' ' ' PHE . 25.5 p -56.9 -61.59 2.34 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.531 1.144 . . . . 72.219999999999999 110.33 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.471 ' HB2' HD22 ' A' ' 144' ' ' LEU . 1.4 t-105 -44.52 -41.95 6.82 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.009 -1.108 . . . . 70.349999999999994 108.009 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 149' ' ' CYS . . . . . 0.423 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 7.1 t -63.48 -45.55 90.23 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.484 1.115 . . . . 73.450000000000003 108.278 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 150' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' A' ' 147' ' ' THR . 0.8 OUTLIER -57.32 -61.68 2.31 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.539 1.149 . . . . 62.439999999999998 109.274 -179.915 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.956 ' CE1' HD12 ' A' ' 157' ' ' LEU . 8.5 m-30 -39.65 -39.24 0.72 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.524 1.14 . . . . 74.5 110.935 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -56.75 -46.77 81.21 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.511 1.132 . . . . 54.539999999999999 110.278 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.491 ' O ' ' CG ' ' A' ' 153' ' ' PHE . 66.8 t80 -99.9 7.55 44.8 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.459 1.1 . . . . 52.210000000000001 111.015 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.449 ' N ' ' O ' ' A' ' 150' ' ' ASN . 0.3 OUTLIER -145.92 81.63 1.6 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.509 1.13 . . . . 73.329999999999998 111.023 179.953 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 3.9 t -72.1 -5.31 34.45 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.407 1.067 . . . . 51.32 110.409 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 156' ' ' SER . . . . . 0.438 ' HB3' ' CE1' ' A' ' 154' ' ' TYR . 1.1 t -67.42 -31.56 71.85 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.53 1.143 . . . . 64.439999999999998 110.022 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.956 HD12 ' CE1' ' A' ' 151' ' ' PHE . 3.4 tm? -79.31 -41.82 27.14 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.539 1.149 . . . . 74.299999999999997 109.333 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 158' ' ' MET . . . . . . . . . . . . . 13.8 tpp -51.63 -21.98 3.02 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.526 1.141 . . . . 75.230000000000004 111.05 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -67.18 -37.39 83.63 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.467 1.105 . . . . 74.030000000000001 109.293 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 160' ' ' SER . . . . . 0.784 ' HB2' HG21 ' A' ' 170' ' ' VAL . 0.8 OUTLIER -77.28 -27.56 53.14 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.523 1.139 . . . . 72.430000000000007 109.986 179.975 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 161' ' ' VAL . . . . . 0.552 HG13 HH21 ' A' ' 163' ' ' ARG . 3.5 t -62.44 -18.1 19.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.56 1.163 . . . . 62.530000000000001 109.364 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -74.42 -4.39 36.29 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 124.552 1.158 . . . . 62.329999999999998 109.296 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.734 ' HE ' HD13 ' A' ' 192' ' ' ILE . 5.2 mmt180 58.51 30.97 20.48 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.494 1.121 . . . . 72.219999999999999 110.208 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -52.45 -174.64 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.483 1.114 . . . . 73.340000000000003 110.264 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -110.53 73.13 0.81 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.536 1.147 . . . . 72.400000000000006 109.58 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.409 ' C ' ' N ' ' A' ' 168' ' ' ASN . 0.0 OUTLIER -111.8 163.75 13.83 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.496 1.123 . . . . 72.030000000000001 109.329 -179.993 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 167' ' ' TYR . . . . . 0.574 ' N ' HG21 ' A' ' 221' ' ' ILE . 1.1 p90 -42.62 -25.91 0.1 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.467 1.105 . . . . 74.409999999999997 111.033 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 168' ' ' ASN . . . . . 0.541 HD21 ' HE1' ' A' ' 167' ' ' TYR . 9.3 p30 -119.3 156.17 30.49 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.54 1.15 . . . . 53.32 109.318 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.493 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 1.2 m -131.54 143.5 50.42 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.577 1.173 . . . . 72.230000000000004 109.97 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 1.0 ' O ' HD12 ' A' ' 171' ' ' ILE . 5.1 t -102.91 131.63 50.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.467 1.104 . . . . 73.239999999999995 109.333 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 1.0 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.2 mp -140.03 111.09 7.25 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.561 1.163 . . . . 72.209999999999994 109.287 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 172' ' ' PRO . . . . . 0.759 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.08 106.74 2.33 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.45 1.763 . . . . 64.310000000000002 110.983 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 173' ' ' MET . . . . . 0.539 ' HB3' HG23 ' A' ' 136' ' ' ILE . 3.1 ttt -90.47 151.83 21.21 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.467 1.105 . . . . 64.319999999999993 111.048 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 174' ' ' ARG . . . . . 0.422 ' N ' ' HG2' ' A' ' 173' ' ' MET . 4.7 tpp85 -110.18 122.04 39.92 Favored Pre-proline 0 C--N 1.324 -0.512 0 O-C-N 124.509 1.131 . . . . 73.040000000000006 110.279 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 175' ' ' PRO . . . . . 0.744 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.3 Cg_endo -75.04 160.91 39.47 Favored 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.477 1.777 . . . . 73.340000000000003 110.992 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.975 HD21 ' CG ' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -100.62 -40.55 7.34 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.579 1.175 . . . . 72.430000000000007 109.316 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -73.0 -23.6 60.66 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.466 1.104 . . . . 70.439999999999998 109.275 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 178' ' ' ASN . . . . . 0.447 ' ND2' ' OD2' ' A' ' 89' ' ' ASP . 2.1 m-80 -110.41 106.7 58.13 Favored Pre-proline 0 C--N 1.325 -0.467 0 O-C-N 124.534 1.146 . . . . 74.319999999999993 109.273 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.97 115.12 4.19 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.497 1.788 . . . . 74.409999999999997 111.013 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.49 ' CD1' ' OG1' ' A' ' 185' ' ' THR . 1.1 tm? -126.94 96.97 33.45 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 124.454 1.096 . . . . 75.200000000000003 109.306 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 165.37 31.42 Favored 'Trans proline' 0 C--N 1.36 1.14 0 O-C-N 124.548 1.815 . . . . 61.409999999999997 110.969 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 3.7 ptt180 -55.8 -39.35 71.18 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.474 1.109 . . . . 72.340000000000003 110.308 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -55.72 -18.22 7.68 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.481 1.113 . . . . 75.150000000000006 110.277 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 184' ' ' ARG . . . . . 0.401 ' HB3' HD21 ' A' ' 180' ' ' LEU . 14.2 mmt180 -104.14 -18.06 14.66 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.488 1.118 . . . . 61.310000000000002 110.218 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 185' ' ' THR . . . . . 0.522 HG23 ' HD2' ' A' ' 186' ' ' PRO . 42.1 m -91.38 143.99 29.04 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.426 1.079 . . . . 75.510000000000005 110.381 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 186' ' ' PRO . . . . . 0.578 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -75.06 149.0 35.81 Favored 'Trans proline' 0 C--N 1.362 1.239 0 O-C-N 124.453 1.765 . . . . 61.549999999999997 110.993 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 187' ' ' PHE . . . . . 0.415 ' O ' HG23 ' A' ' 191' ' ' THR . 4.8 t80 -62.82 -11.51 18.48 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.492 1.12 . . . . 61.520000000000003 110.994 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 188' ' ' ALA . . . . . 0.434 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -88.57 -53.98 4.39 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.5 1.125 . . . . 72.109999999999999 109.36 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.578 HD12 ' CG ' ' A' ' 186' ' ' PRO . 40.4 mt -73.04 -18.17 61.36 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.538 1.149 . . . . 73.049999999999997 109.299 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 190' ' ' GLN . . . . . 0.473 ' CG ' ' O ' ' A' ' 190' ' ' GLN . 6.9 tt0 -86.0 -1.07 56.99 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.504 1.127 . . . . 62.119999999999997 110.289 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 191' ' ' THR . . . . . 0.415 HG23 ' O ' ' A' ' 187' ' ' PHE . 41.2 p -128.12 22.66 6.13 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.492 1.12 . . . . 72.439999999999998 110.411 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.734 HD13 ' HE ' ' A' ' 163' ' ' ARG . 4.2 mt -124.58 157.63 32.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.483 1.115 . . . . 63.32 109.296 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -61.79 82.8 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.513 1.133 . . . . 60.119999999999997 109.288 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 194' ' ' ALA . . . . . 0.759 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -82.5 152.05 26.22 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.59 1.181 . . . . 71.540000000000006 109.29 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 195' ' ' LEU . . . . . 0.51 HD23 ' CD1' ' A' ' 209' ' ' ILE . 0.2 OUTLIER -83.86 137.66 33.57 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.475 1.109 . . . . 65.010000000000005 109.3 179.979 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -121.47 123.2 41.48 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.514 1.134 . . . . 72.549999999999997 110.274 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.975 ' CG ' HD21 ' A' ' 176' ' ' LEU . 9.5 tp10 -97.27 -29.61 13.45 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.476 1.11 . . . . 71.409999999999997 110.33 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 198' ' ' GLU . . . . . 0.516 ' HG2' HD12 ' A' ' 176' ' ' LEU . 4.4 pt-20 -95.19 23.08 6.04 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.436 1.085 . . . . 73.219999999999999 110.305 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 2.0 t -122.91 134.37 54.36 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.581 1.176 . . . . 75.519999999999996 110.017 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 20.4 ttt180 -54.88 -18.56 5.06 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.497 1.123 . . . . 74.230000000000004 110.355 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -91.42 18.77 50.92 Favored Glycine 0 CA--C 1.529 0.964 0 O-C-N 124.504 1.128 . . . . 71.040000000000006 111.01 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 202' ' ' PHE . . . . . 0.803 ' O ' HG23 ' A' ' 206' ' ' VAL . 7.3 t80 -65.67 -39.43 32.13 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.429 0.723 . . . . 64.209999999999994 110.989 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 203' ' ' PRO . . . . . 0.685 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -74.98 -38.67 1.5 Allowed 'Trans proline' 0 C--N 1.361 1.209 0 O-C-N 124.509 1.794 . . . . 74.120000000000005 111.012 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -51.61 -62.66 1.49 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.511 1.132 . . . . 74.239999999999995 110.415 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 205' ' ' GLN . . . . . 0.454 ' O ' ' N ' ' A' ' 208' ' ' ARG . 7.2 mt-30 -55.63 -58.02 9.54 Favored 'General case' 0 C--N 1.323 -0.549 0 O-C-N 124.476 1.11 . . . . 54.5 110.298 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 206' ' ' VAL . . . . . 0.833 HG11 HD22 ' A' ' 100' ' ' LEU . 72.2 t -42.69 -31.2 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.44 1.088 . . . . 71.049999999999997 109.318 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -83.03 -41.32 18.8 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.491 1.119 . . . . 71.219999999999999 110.323 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 208' ' ' ARG . . . . . 0.454 ' N ' ' O ' ' A' ' 205' ' ' GLN . 51.1 mtt180 -71.43 -63.23 1.16 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.45 1.094 . . . . 73.109999999999999 110.269 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 209' ' ' ILE . . . . . 0.631 HG22 ' CD1' ' A' ' 210' ' ' PHE . 39.6 mt -48.33 -50.14 12.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.456 1.098 . . . . 75.049999999999997 109.287 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 210' ' ' PHE . . . . . 0.631 ' CD1' HG22 ' A' ' 209' ' ' ILE . 0.5 OUTLIER -102.77 65.06 0.89 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.515 1.134 . . . . 75.120000000000005 111.004 -179.977 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 211' ' ' GLN . . . . . 0.552 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.5 OUTLIER -110.9 144.8 39.39 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 124.519 1.137 . . . . 61.329999999999998 110.286 -179.982 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.448 ' O ' ' N ' ' A' ' 215' ' ' TYR . 21.6 tt0 -48.84 -54.98 12.98 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.542 1.151 . . . . 74.450000000000003 110.286 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 3.4 t -48.34 -25.12 1.44 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.522 1.139 . . . . 72.239999999999995 109.983 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.552 HG23 ' HG2' ' A' ' 211' ' ' GLN . 43.2 t -96.28 -27.07 4.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.52 1.137 . . . . 72.040000000000006 109.298 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 215' ' ' TYR . . . . . 0.448 ' N ' ' O ' ' A' ' 212' ' ' GLU . 13.5 t80 -67.42 -36.62 81.61 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.484 1.115 . . . . 72.5 110.94 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 14.9 mmtt -52.03 -50.71 60.9 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.498 1.124 . . . . 62.200000000000003 109.321 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 217' ' ' THR . . . . . 0.738 HG22 HD11 ' A' ' 221' ' ' ILE . 18.8 m -58.17 -65.24 0.68 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.484 1.115 . . . . 73.209999999999994 110.407 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 218' ' ' GLN . . . . . 0.513 ' HA ' HD12 ' A' ' 221' ' ' ILE . 1.7 mp0 -54.12 -22.17 10.4 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.5 1.125 . . . . 73.120000000000005 110.316 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 219' ' ' GLN . . . . . 0.42 ' N ' ' O ' ' A' ' 215' ' ' TYR . 8.3 tp-100 -84.35 -30.17 25.68 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.482 1.114 . . . . 72.239999999999995 110.236 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 220' ' ' THR . . . . . 0.491 ' O ' ' CG ' ' A' ' 224' ' ' GLU . 1.0 OUTLIER -86.64 -22.64 26.05 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.536 1.147 . . . . 73.450000000000003 110.379 -179.981 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 221' ' ' ILE . . . . . 0.738 HD11 HG22 ' A' ' 217' ' ' THR . 42.6 mt -74.22 -53.97 15.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 O-C-N 124.424 1.077 . . . . 74.340000000000003 109.303 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 222' ' ' TRP . . . . . 0.787 ' O ' HG22 ' A' ' 225' ' ' THR . 14.4 t90 -63.26 -52.03 63.73 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.937 -1.134 . . . . 73.329999999999998 107.937 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.98 -20.93 10.23 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.553 1.158 . . . . 74.340000000000003 109.335 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 224' ' ' GLU . . . . . 0.491 ' CG ' ' O ' ' A' ' 220' ' ' THR . 8.2 mm-40 -93.26 -29.14 15.83 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.49 1.119 . . . . 73.010000000000005 110.267 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.787 HG22 ' O ' ' A' ' 222' ' ' TRP . 2.4 t -63.06 -27.54 69.47 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.474 1.109 . . . . 72.239999999999995 110.425 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 1.2 mtm180 -73.2 -22.24 60.5 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.533 1.146 . . . . 71.519999999999996 110.342 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 227' ' ' ASN . . . . . 0.433 ' O ' ' CD ' ' A' ' 231' ' ' ARG . 0.9 OUTLIER -79.9 -12.95 59.7 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.444 1.09 . . . . 71.530000000000001 109.257 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 228' ' ' MET . . . . . 0.457 ' CE ' ' HA ' ' A' ' 225' ' ' THR . 43.5 mtm -85.83 -41.8 14.7 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.453 1.095 . . . . 73.239999999999995 110.963 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 229' ' ' VAL . . . . . 0.431 HG13 ' H ' ' A' ' 229' ' ' VAL . 1.3 m -61.28 -44.95 99.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.451 1.095 . . . . 70.200000000000003 109.293 -179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 230' ' ' GLN . . . . . 0.425 ' N ' ' CG2' ' A' ' 229' ' ' VAL . 0.0 OUTLIER -72.0 -46.39 57.41 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.501 1.125 . . . . 71.200000000000003 110.327 179.968 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 231' ' ' ARG . . . . . 0.433 ' CD ' ' O ' ' A' ' 227' ' ' ASN . 0.0 OUTLIER -42.4 -85.17 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.486 1.116 . . . . 74.420000000000002 110.362 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -152.14 59.85 0.84 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.502 1.126 . . . . 70.430000000000007 110.28 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 233' ' ' PHE . . . . . 0.498 ' O ' ' CG1' ' A' ' 234' ' ' ILE . 0.5 OUTLIER -155.85 171.62 19.74 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.544 1.152 . . . . 72.209999999999994 110.952 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 234' ' ' ILE . . . . . 0.498 ' CG1' ' O ' ' A' ' 233' ' ' PHE . 9.4 mt -157.21 151.97 7.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.506 1.129 . . . . 44.229999999999997 109.328 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.521 0 O-C-N 124.458 1.098 . . . . 60.229999999999997 109.35 179.968 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.3 p . . . . . 0 N--CA 1.453 -0.305 0 N-CA-C 109.239 -0.652 . . . . 72.409999999999997 109.239 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.41 ' O ' ' CD2' ' A' ' 78' ' ' PHE . 52.1 p90 -89.23 34.63 0.8 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.547 1.154 . . . . 72.239999999999995 110.981 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.849 HD23 ' N ' ' A' ' 80' ' ' LYS . 4.4 tt -39.99 150.9 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.54 1.15 . . . . 74.329999999999998 109.322 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.849 ' N ' HD23 ' A' ' 79' ' ' LEU . 5.0 mtpt -72.2 -60.68 2.11 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.544 1.153 . . . . 74.310000000000002 109.257 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.66 ' CE1' HD11 ' A' ' 83' ' ' ILE . 0.1 OUTLIER -167.22 152.15 7.23 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.491 1.12 . . . . 73.230000000000004 111.011 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.711 HG11 ' HA ' ' A' ' 128' ' ' ALA . 4.5 p -100.86 163.39 3.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.487 1.117 . . . . 64.140000000000001 109.307 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.791 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.3 mp -125.63 98.6 5.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.515 1.134 . . . . 71.019999999999996 109.316 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 84' ' ' LEU . 4.8 mt -73.11 115.59 12.61 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.52 1.137 . . . . 74.230000000000004 109.304 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.724 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -138.87 174.48 10.48 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.535 1.147 . . . . 70.140000000000001 109.596 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.649 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -109.52 164.04 12.88 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.461 1.101 . . . . 60.450000000000003 109.248 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 87' ' ' GLU . 15.9 tt0 -67.53 -9.57 43.7 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.555 1.159 . . . . 74.109999999999999 110.343 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -84.02 -44.96 13.61 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.431 1.082 . . . . 65.299999999999997 109.254 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -120.85 43.67 2.71 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.473 1.108 . . . . 71.349999999999994 109.299 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.609 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -77.08 -22.6 52.58 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.478 1.111 . . . . 70.200000000000003 110.383 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -82.06 -28.08 32.61 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.568 1.168 . . . . 73.129999999999995 109.357 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -71.14 -56.32 6.34 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.494 1.121 . . . . 72.239999999999995 110.303 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.981 ' HB2' HD22 ' A' ' 138' ' ' LEU . . . -56.04 -33.83 65.33 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.499 1.124 . . . . 73.340000000000003 109.306 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.919 ' HB2' HD13 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -74.05 -45.63 48.32 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.491 1.12 . . . . 72.409999999999997 109.364 179.945 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.747 ' N ' HD13 ' A' ' 94' ' ' LEU . 10.3 tpt180 -48.29 -29.76 4.17 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.52 1.137 . . . . 74.099999999999994 110.308 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.814 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.2 t -81.87 -65.41 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.477 1.111 . . . . 60.399999999999999 109.339 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.476 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -40.11 -27.23 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.547 1.154 . . . . 64.25 110.379 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.452 ' N ' ' O ' ' A' ' 96' ' ' VAL . 1.3 t-20 -71.35 -53.06 15.45 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.483 1.114 . . . . 75.230000000000004 109.362 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.836 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -70.72 -21.73 62.51 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.539 1.149 . . . . 74.140000000000001 109.279 179.947 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.836 ' N ' HD23 ' A' ' 99' ' ' LEU . 22.8 mt -63.72 -51.32 65.51 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.483 1.114 . . . . 74.510000000000005 109.261 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -81.24 51.74 1.67 Allowed 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.494 1.122 . . . . 64.0 110.254 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -171.06 -66.28 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.492 1.12 . . . . 73.129999999999995 109.314 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -47.93 -47.88 32.16 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.417 1.073 . . . . 71.319999999999993 109.249 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 1.032 ' CE2' HG11 ' A' ' 206' ' ' VAL . 1.1 m-85 -115.94 -30.17 6.13 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.445 1.09 . . . . 62.539999999999999 110.982 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.67 45.18 2.75 Favored Glycine 0 CA--C 1.53 1.024 0 O-C-N 124.442 1.089 . . . . 72.25 111.029 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 9.8 mm -85.47 78.69 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.578 0.81 . . . . 70.340000000000003 109.311 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.531 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -124.16 156.02 67.03 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.519 1.137 . . . . 75.409999999999997 109.259 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.531 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.98 156.64 99.9 Favored 'Cis proline' 0 C--N 1.36 1.167 0 C-N-CA 120.945 -2.523 . . . . 74.209999999999994 111.023 -0.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -133.27 124.21 3.65 Favored Glycine 0 CA--C 1.531 1.047 0 O-C-N 124.452 1.095 . . . . 74.010000000000005 110.992 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.706 HG22 HD11 ' A' ' 79' ' ' LEU . 1.7 tt -142.32 149.57 19.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.492 0.76 . . . . 74.340000000000003 109.314 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . 0.919 HD13 ' HB2' ' A' ' 94' ' ' LEU . 33.6 pt -99.61 163.49 2.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.472 1.107 . . . . 63.530000000000001 109.299 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -63.31 -19.09 64.29 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.508 1.13 . . . . 64.109999999999999 110.981 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -89.53 -8.13 53.44 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.519 1.137 . . . . 74.200000000000003 109.284 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -107.04 -20.09 13.42 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.571 1.169 . . . . 72.129999999999995 110.256 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.417 ' HE1' ' CG2' ' A' ' 82' ' ' VAL . 20.9 ttm -60.21 110.83 3.18 Favored Pre-proline 0 C--N 1.325 -0.5 0 O-C-N 124.441 1.088 . . . . 74.239999999999995 110.973 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 C--N 1.36 1.167 0 O-C-N 124.471 1.774 . . . . 42.399999999999999 111.03 179.988 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.695 HD13 ' HG ' ' A' ' 157' ' ' LEU . 4.2 pp . . . . . 0 N--CA 1.454 -0.273 0 N-CA-C 109.268 -0.641 . . . . 61.43 109.268 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.403 ' O ' ' N ' ' A' ' 129' ' ' VAL . 6.1 p-10 -74.5 -41.2 61.1 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.521 1.138 . . . . 72.549999999999997 109.267 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -47.05 -48.41 22.36 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.439 1.087 . . . . 71.200000000000003 109.265 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.711 ' HA ' HG11 ' A' ' 82' ' ' VAL . . . -59.56 -34.48 72.74 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.484 1.115 . . . . 74.010000000000005 109.332 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.732 ' O ' HG12 ' A' ' 129' ' ' VAL . 68.8 t -92.84 30.8 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 O-C-N 124.507 1.129 . . . . 72.430000000000007 109.279 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -133.0 139.27 47.16 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.473 1.108 . . . . 73.540000000000006 109.286 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . 0.501 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 37.87 76.7 0.07 OUTLIER Glycine 0 CA--C 1.53 1.03 0 O-C-N 124.537 1.148 . . . . 52.030000000000001 110.982 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . 0.4 ' O ' ' O ' ' A' ' 167' ' ' TYR . 0.6 OUTLIER -163.64 -175.46 4.17 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.499 0.764 . . . . 64.099999999999994 109.98 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.744 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -110.46 -41.36 4.37 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.566 1.166 . . . . 55.009999999999998 109.292 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.744 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 0.4 OUTLIER -154.54 165.86 35.12 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 107.969 -1.123 . . . . 72.340000000000003 107.969 -179.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . 0.622 HG22 HG12 ' A' ' 82' ' ' VAL . 3.2 p -133.35 129.21 37.16 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.542 1.151 . . . . 74.319999999999993 110.399 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.791 ' HB ' HG23 ' A' ' 83' ' ' ILE . 11.4 mm -84.56 121.87 37.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.506 1.129 . . . . 75.549999999999997 109.288 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.538 HD23 ' C ' ' A' ' 136' ' ' ILE . 6.7 mt -108.29 87.81 2.58 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.479 1.112 . . . . 75.329999999999998 109.311 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.981 HD22 ' HB2' ' A' ' 93' ' ' ALA . 3.5 tp -62.27 88.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.5 1.125 . . . . 44.409999999999997 109.268 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.529 HD13 HG23 ' A' ' 185' ' ' THR . 19.3 mt -61.48 113.7 2.82 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.441 1.088 . . . . 63.200000000000003 109.343 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . 0.595 HG23 ' ND2' ' A' ' 178' ' ' ASN . 5.7 m -140.32 154.4 46.77 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.525 1.14 . . . . 44.299999999999997 110.412 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 11.2 mp0 -47.34 -39.95 16.11 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.478 1.111 . . . . 51.119999999999997 110.332 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . 0.412 ' ND2' ' N ' ' A' ' 143' ' ' PHE . 2.4 p-10 -89.89 -53.6 4.42 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.53 1.144 . . . . 74.209999999999994 109.294 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.649 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 37.3 t80 -48.95 -21.49 0.67 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.486 1.116 . . . . 74.109999999999999 111.038 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.511 ' O ' ' CB ' ' A' ' 148' ' ' TRP . 3.0 tm? -78.49 -67.64 0.72 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.547 1.154 . . . . 74.230000000000004 109.303 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.461 ' CD ' ' N ' ' A' ' 145' ' ' ARG . 0.1 OUTLIER -55.52 -17.48 5.44 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.457 1.098 . . . . 73.519999999999996 110.362 179.934 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -70.19 -73.15 0.17 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.5 1.125 . . . . 72.400000000000006 109.297 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.477 HG23 ' CZ ' ' A' ' 151' ' ' PHE . 0.9 OUTLIER -72.61 -48.11 42.38 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.503 1.127 . . . . 61.219999999999999 110.443 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.541 ' CE3' ' CD2' ' A' ' 151' ' ' PHE . 15.5 t-105 -44.39 -40.26 5.28 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.49 1.118 . . . . 71.409999999999997 108.001 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' CYS . . . . . 0.451 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 15.9 t -66.28 -45.74 79.41 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.483 1.114 . . . . 73.140000000000001 108.274 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' ASN . . . . . 0.468 ' N ' ' O ' ' A' ' 147' ' ' THR . 0.6 OUTLIER -54.07 -53.92 46.54 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.47 1.106 . . . . 65.340000000000003 109.291 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 1.083 ' CE1' HD12 ' A' ' 157' ' ' LEU . 9.8 m-30 -38.2 -60.26 0.79 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.502 1.126 . . . . 71.209999999999994 111.029 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -45.75 -38.54 7.13 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.474 1.109 . . . . 72.510000000000005 110.291 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.45 ' N ' ' O ' ' A' ' 150' ' ' ASN . 51.8 t80 -82.26 -23.91 35.05 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.435 1.084 . . . . 71.299999999999997 110.989 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.555 ' CD2' ' HB2' ' A' ' 156' ' ' SER . 1.2 t80 -144.57 107.45 4.48 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.472 1.107 . . . . 74.209999999999994 110.949 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.1 t -73.18 -6.26 44.68 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.444 1.09 . . . . 64.109999999999999 110.431 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . 0.555 ' HB2' ' CD2' ' A' ' 154' ' ' TYR . 22.0 m -51.29 -52.55 44.15 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.434 1.083 . . . . 41.299999999999997 110.01 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 1.083 HD12 ' CE1' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -66.96 -40.26 87.45 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.49 1.119 . . . . 74.239999999999995 109.244 -179.96 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' MET . . . . . 0.632 ' CE ' HG21 ' A' ' 161' ' ' VAL . 2.1 mmt -53.24 -19.55 3.27 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.418 1.074 . . . . 61.130000000000003 110.994 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' ASN . . . . . 0.47 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 87.5 m-20 -75.18 -42.23 56.32 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.474 1.108 . . . . 74.230000000000004 109.326 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' SER . . . . . 0.775 ' O ' HG21 ' A' ' 170' ' ' VAL . 0.3 OUTLIER -64.54 -13.47 52.76 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.51 1.131 . . . . 73.510000000000005 110.023 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . 0.638 ' CG1' ' HB1' ' A' ' 188' ' ' ALA . 89.0 t -74.85 -15.96 16.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.508 1.13 . . . . 74.340000000000003 109.311 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.14 2.83 19.5 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.506 1.129 . . . . 73.340000000000003 109.286 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.452 ' HD3' ' CG2' ' A' ' 192' ' ' ILE . 14.8 mmm-85 60.37 64.97 1.13 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.42 1.075 . . . . 73.310000000000002 110.29 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . 0.505 ' NE2' ' N ' ' A' ' 164' ' ' GLN . 0.9 OUTLIER -65.68 129.15 38.75 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.478 1.112 . . . . 73.239999999999995 110.271 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' HIS . . . . . 0.417 ' O ' ' O ' ' A' ' 166' ' ' LYS . 13.3 m-70 -74.03 -3.91 32.17 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.507 1.129 . . . . 74.209999999999994 109.624 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.417 ' O ' ' O ' ' A' ' 165' ' ' HIS . 5.6 mptt -49.64 178.79 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.501 1.125 . . . . 63.350000000000001 109.334 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 167' ' ' TYR . . . . . 0.593 ' CE2' ' OD1' ' A' ' 168' ' ' ASN . 29.6 p90 -48.22 -47.66 35.52 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.452 1.095 . . . . 72.329999999999998 111.014 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . 0.593 ' OD1' ' CE2' ' A' ' 167' ' ' TYR . 3.2 p-10 -89.5 146.23 24.76 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.468 1.105 . . . . 70.409999999999997 109.345 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 8.3 t -128.11 169.02 14.56 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.505 1.128 . . . . 72.530000000000001 109.991 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.793 ' C ' HD12 ' A' ' 171' ' ' ILE . 12.7 t -123.0 111.59 30.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 O-C-N 124.463 1.102 . . . . 40.350000000000001 109.336 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.793 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -126.32 97.24 34.72 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.538 1.149 . . . . 73.439999999999998 109.269 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . 0.804 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.3 Cg_endo -75.0 106.92 2.37 Favored 'Trans proline' 0 C--N 1.36 1.141 0 O-C-N 124.507 1.793 . . . . 65.420000000000002 110.986 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . 0.814 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.9 ttt -78.54 156.36 29.26 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.485 1.116 . . . . 73.319999999999993 110.997 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . 0.479 ' NH2' ' NH2' ' A' ' 182' ' ' ARG . 59.5 mtt85 -110.13 124.32 33.75 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.545 1.153 . . . . 70.519999999999996 110.327 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 175' ' ' PRO . . . . . 0.719 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -74.95 156.11 43.21 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.505 1.792 . . . . 64.310000000000002 111.008 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . 0.892 HD21 ' CD ' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -104.17 -47.0 4.28 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.478 1.111 . . . . 75.319999999999993 109.248 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -72.77 -21.46 61.0 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.496 1.123 . . . . 72.230000000000004 109.314 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 178' ' ' ASN . . . . . 0.595 ' ND2' HG23 ' A' ' 140' ' ' THR . 5.5 t-20 -107.0 109.11 62.93 Favored Pre-proline 0 C--N 1.324 -0.528 0 O-C-N 124.576 1.173 . . . . 74.549999999999997 109.265 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.06 115.34 4.25 Favored 'Trans proline' 0 C--N 1.359 1.11 0 O-C-N 124.518 1.799 . . . . 63.409999999999997 111.007 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.505 ' HA ' HD22 ' A' ' 180' ' ' LEU . 0.6 OUTLIER -138.02 96.9 10.08 Favored Pre-proline 0 C--N 1.326 -0.453 0 O-C-N 124.491 1.119 . . . . 74.239999999999995 109.237 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.97 166.97 28.09 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.461 1.769 . . . . 74.230000000000004 110.969 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . 0.479 ' NH2' ' NH2' ' A' ' 174' ' ' ARG . 0.1 OUTLIER -56.98 -31.41 65.01 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.579 1.174 . . . . 74.010000000000005 110.34 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -57.15 -17.0 9.09 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.473 1.108 . . . . 70.530000000000001 110.317 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 184' ' ' ARG . . . . . 0.467 ' HB2' HD13 ' A' ' 180' ' ' LEU . 23.3 mmt85 -109.24 -14.18 14.52 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.49 1.119 . . . . 73.439999999999998 110.299 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 185' ' ' THR . . . . . 0.529 HG23 HD13 ' A' ' 139' ' ' LEU . 86.3 m -89.94 143.19 29.64 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.487 1.117 . . . . 71.239999999999995 110.395 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 186' ' ' PRO . . . . . 0.689 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.5 Cg_endo -74.95 144.54 30.57 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.52 1.8 . . . . 74.450000000000003 110.989 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 187' ' ' PHE . . . . . 0.629 ' O ' HG23 ' A' ' 191' ' ' THR . 22.5 p90 -60.84 -13.0 12.69 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.411 1.069 . . . . 62.109999999999999 110.981 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . 0.721 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -86.25 -54.6 4.35 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.553 1.158 . . . . 34.219999999999999 109.26 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.689 HD12 ' CG ' ' A' ' 186' ' ' PRO . 20.2 mt -74.14 -15.46 61.03 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.448 1.092 . . . . 63.210000000000001 109.299 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -84.75 -23.56 29.2 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.468 1.105 . . . . 72.120000000000005 110.248 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 191' ' ' THR . . . . . 0.629 HG23 ' O ' ' A' ' 187' ' ' PHE . 39.8 p -101.9 21.19 15.06 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 124.571 1.169 . . . . 64.319999999999993 110.403 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.721 HD12 ' O ' ' A' ' 188' ' ' ALA . 19.9 mt -124.64 154.69 32.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.492 1.12 . . . . 73.409999999999997 109.248 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -63.76 98.04 0.18 Allowed 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.517 1.136 . . . . 73.530000000000001 109.375 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . 0.804 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -92.39 151.77 20.08 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.585 1.178 . . . . 54.409999999999997 109.323 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 195' ' ' LEU . . . . . 0.734 HD23 ' CD1' ' A' ' 209' ' ' ILE . 0.3 OUTLIER -86.8 147.56 25.77 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.495 1.122 . . . . 71.530000000000001 109.316 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . 0.485 ' N ' HD13 ' A' ' 195' ' ' LEU . 25.0 mt-10 -143.77 141.02 30.22 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.478 1.111 . . . . 71.439999999999998 110.321 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.892 ' CD ' HD21 ' A' ' 176' ' ' LEU . 2.1 pt-20 -113.19 -17.47 12.35 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.494 1.121 . . . . 71.409999999999997 110.296 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . 0.561 ' HB3' HD12 ' A' ' 176' ' ' LEU . 0.0 OUTLIER -92.32 2.58 56.55 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 124.472 1.107 . . . . 62.43 110.363 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 36.3 t -99.16 165.32 11.77 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.499 1.124 . . . . 74.209999999999994 109.959 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 14.8 mtm180 -75.85 -27.48 57.85 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.525 1.141 . . . . 74.439999999999998 110.35 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -95.86 20.28 50.6 Favored Glycine 0 CA--C 1.528 0.892 0 O-C-N 124.537 1.148 . . . . 74.349999999999994 111.029 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 202' ' ' PHE . . . . . 0.781 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.1 OUTLIER -58.21 -43.22 98.1 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.45 0.736 . . . . 72.150000000000006 110.932 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 203' ' ' PRO . . . . . 0.627 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.5 Cg_endo -74.98 -30.32 7.32 Favored 'Trans proline' 0 C--N 1.359 1.108 0 O-C-N 124.529 1.805 . . . . 73.450000000000003 110.984 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.04 -65.56 0.67 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.53 1.144 . . . . 71.340000000000003 110.352 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -52.05 -39.4 59.58 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.481 1.113 . . . . 74.140000000000001 110.28 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 206' ' ' VAL . . . . . 1.032 HG11 ' CE2' ' A' ' 104' ' ' PHE . 47.3 t -60.84 -28.3 42.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.557 1.161 . . . . 52.329999999999998 109.308 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -83.06 -50.32 8.63 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.474 1.109 . . . . 70.310000000000002 110.241 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . 0.428 ' N ' ' HD2' ' A' ' 208' ' ' ARG . 9.5 mpt_? -61.18 -64.07 1.08 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.466 1.104 . . . . 70.439999999999998 110.261 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 209' ' ' ILE . . . . . 0.797 HG22 ' CD1' ' A' ' 210' ' ' PHE . 44.9 mt -47.07 -56.44 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 124.501 1.126 . . . . 72.340000000000003 109.263 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 210' ' ' PHE . . . . . 0.797 ' CD1' HG22 ' A' ' 209' ' ' ILE . 2.4 m-85 -101.2 67.58 1.18 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.598 1.186 . . . . 74.329999999999998 110.962 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 211' ' ' GLN . . . . . 0.419 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -110.7 145.33 38.19 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.485 1.115 . . . . 72.219999999999999 110.311 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' A' ' 215' ' ' TYR . 34.0 tt0 -49.45 -55.07 14.45 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.511 1.132 . . . . 75.420000000000002 110.326 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.94 -23.83 0.88 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.463 1.102 . . . . 65.319999999999993 109.918 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.419 HG23 ' HG2' ' A' ' 211' ' ' GLN . 20.0 t -95.66 -30.56 4.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 O-C-N 124.527 1.142 . . . . 74.439999999999998 109.322 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 215' ' ' TYR . . . . . 0.455 ' N ' ' O ' ' A' ' 212' ' ' GLU . 6.6 t80 -62.12 -25.11 67.55 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.467 1.104 . . . . 75.329999999999998 110.965 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . 0.413 ' O ' ' N ' ' A' ' 219' ' ' GLN . 3.9 mmtp -73.73 -61.65 1.77 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.504 1.128 . . . . 52.109999999999999 109.303 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 217' ' ' THR . . . . . 0.754 HG22 HD11 ' A' ' 221' ' ' ILE . 71.4 m -46.93 -48.54 21.39 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.487 1.117 . . . . 72.510000000000005 110.383 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -64.54 -25.08 67.83 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.469 1.106 . . . . 75.319999999999993 110.284 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 219' ' ' GLN . . . . . 0.446 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 31.6 tp60 -83.64 -28.85 28.14 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.494 1.121 . . . . 74.129999999999995 110.256 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 220' ' ' THR . . . . . 0.459 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 3.0 m -85.11 -28.35 25.64 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.568 1.167 . . . . 75.340000000000003 110.426 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 221' ' ' ILE . . . . . 0.754 HD11 HG22 ' A' ' 217' ' ' THR . 46.2 mt -76.54 -32.76 21.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.473 1.108 . . . . 71.340000000000003 109.28 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 222' ' ' TRP . . . . . 0.501 ' CD1' ' HA2' ' A' ' 131' ' ' GLY . 18.2 t90 -74.29 -58.33 3.37 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.523 1.139 . . . . 61.420000000000002 107.989 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.459 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -51.26 -22.63 2.84 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.551 1.157 . . . . 70.140000000000001 109.325 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 . . . . . 0 C--N 1.325 -0.47 0 O-C-N 124.528 1.142 . . . . 71.299999999999997 110.3 179.986 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.412 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.4 p . . . . . 0 N--CA 1.453 -0.282 0 N-CA-C 109.285 -0.635 . . . . 65.109999999999999 109.285 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.532 ' O ' ' CD2' ' A' ' 78' ' ' PHE . 10.1 p90 -89.61 28.27 1.34 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.55 1.157 . . . . 70.400000000000006 110.977 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.415 ' C ' ' O ' ' A' ' 78' ' ' PHE . 4.3 tp -39.52 140.59 0.46 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.537 1.148 . . . . 74.049999999999997 109.268 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.488 ' CD ' ' O ' ' A' ' 107' ' ' LYS . 3.2 mtpt -75.99 -64.25 1.13 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.495 1.122 . . . . 72.109999999999999 109.26 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.815 ' CE1' HD11 ' A' ' 83' ' ' ILE . 0.1 OUTLIER -161.54 149.33 15.03 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.457 1.098 . . . . 70.319999999999993 111.001 -179.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 1.026 ' CG1' HG22 ' A' ' 135' ' ' THR . 7.7 p -97.81 169.62 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 O-C-N 124.441 1.088 . . . . 70.340000000000003 109.292 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.826 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.0 mp -132.63 92.2 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.49 1.119 . . . . 74.420000000000002 109.267 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.809 HD11 ' CB ' ' A' ' 128' ' ' ALA . 8.2 mt -70.17 117.81 12.2 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.49 1.119 . . . . 64.299999999999997 109.28 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.769 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -140.35 174.6 10.35 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.513 1.133 . . . . 64.439999999999998 109.583 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.772 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -102.78 164.36 11.68 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.52 1.138 . . . . 53.130000000000003 109.235 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.453 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 21.9 tt0 -69.78 -6.78 34.48 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.586 1.179 . . . . 74.109999999999999 110.262 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -89.9 -46.07 8.8 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.435 1.085 . . . . 71.150000000000006 109.252 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -114.57 44.12 1.79 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.409 1.068 . . . . 62.219999999999999 109.28 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.595 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -78.85 -22.99 45.26 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.512 1.132 . . . . 73.040000000000006 110.432 179.948 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -82.51 -30.2 29.97 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.459 1.099 . . . . 71.239999999999995 109.356 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.411 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -70.22 -57.54 4.78 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.478 1.111 . . . . 75.209999999999994 110.226 -179.958 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 1.035 ' HB2' ' CD2' ' A' ' 138' ' ' LEU . . . -55.19 -35.24 64.62 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.508 1.13 . . . . 43.0 109.298 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.853 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -72.4 -44.32 62.65 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.526 1.141 . . . . 33.32 109.335 179.953 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.687 ' N ' HD13 ' A' ' 94' ' ' LEU . 15.2 tpp180 -48.3 -29.49 3.93 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.479 1.112 . . . . 72.019999999999996 110.303 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.595 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.1 t -81.02 -64.62 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.497 1.123 . . . . 73.409999999999997 109.282 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.481 ' HA ' HD12 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -41.04 -26.21 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.512 1.132 . . . . 72.519999999999996 110.309 -179.968 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.458 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.1 t-20 -72.4 -58.09 3.67 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.449 1.093 . . . . 63.450000000000003 109.333 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.849 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -64.92 -22.28 66.97 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.503 1.127 . . . . 73.209999999999994 109.265 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.849 ' N ' HD23 ' A' ' 99' ' ' LEU . 22.2 mt -62.99 -57.3 11.18 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.481 1.113 . . . . 72.349999999999994 109.301 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.46 58.44 1.01 Allowed 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.47 1.106 . . . . 62.25 110.318 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -178.66 -62.99 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.496 1.123 . . . . 74.099999999999994 109.36 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.416 ' HB3' ' CD2' ' A' ' 104' ' ' PHE . 19.9 t0 -51.86 -49.77 62.26 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 62.130000000000003 109.303 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.506 ' CE2' HG11 ' A' ' 206' ' ' VAL . 0.9 OUTLIER -114.47 -26.54 7.9 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.565 1.165 . . . . 74.019999999999996 111.018 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.436 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 93.54 45.63 3.41 Favored Glycine 0 CA--C 1.529 0.957 0 O-C-N 124.476 1.11 . . . . 63.329999999999998 111.017 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 12.1 mm -84.42 69.34 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.442 0.731 . . . . 51.399999999999999 109.252 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.538 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -115.58 156.35 46.21 Favored Pre-proline 0 C--N 1.325 -0.499 0 O-C-N 124.483 1.114 . . . . 73.530000000000001 109.296 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.538 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.5 Cg_endo -74.92 157.96 99.27 Favored 'Cis proline' 0 C--N 1.36 1.181 0 C-N-CA 121.077 -2.468 . . . . 74.450000000000003 110.957 0.073 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -122.86 133.01 8.9 Favored Glycine 0 CA--C 1.532 1.096 0 O-C-N 124.535 1.147 . . . . 41.219999999999999 110.986 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -154.64 135.02 4.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.534 0.785 . . . . 62.310000000000002 109.354 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . 0.793 HD13 ' HB2' ' A' ' 94' ' ' LEU . 38.2 pt -91.07 176.46 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.449 1.093 . . . . 73.209999999999994 109.292 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.709 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 2.2 t80 -78.71 -19.2 52.96 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.503 1.127 . . . . 74.510000000000005 110.995 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -90.08 -3.59 57.85 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.521 1.138 . . . . 55.0 109.279 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -110.49 -26.41 9.52 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.515 1.134 . . . . 64.120000000000005 110.239 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 6.1 ttm -38.55 111.1 0.6 Allowed Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.525 1.141 . . . . 73.530000000000001 110.991 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 C--N 1.36 1.153 0 O-C-N 124.533 1.807 . . . . 73.209999999999994 111.004 179.988 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.842 HD22 HD12 ' A' ' 157' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.332 0 N-CA-C 109.299 -0.63 . . . . 64.219999999999999 109.299 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.482 ' N ' HD12 ' A' ' 125' ' ' LEU . 7.8 t0 -45.31 -59.23 2.77 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.509 1.13 . . . . 61.200000000000003 109.321 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -44.65 -39.25 4.9 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.536 1.147 . . . . 54.549999999999997 109.285 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.809 ' CB ' HD11 ' A' ' 84' ' ' LEU . . . -50.38 -50.49 51.31 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.504 1.128 . . . . 52.109999999999999 109.297 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.507 ' O ' ' CB ' ' A' ' 168' ' ' ASN . 34.6 m -92.48 31.16 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.438 1.086 . . . . 64.030000000000001 109.218 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -114.08 149.18 35.9 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.492 1.12 . . . . 72.310000000000002 109.254 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 39.66 70.03 0.38 Allowed Glycine 0 CA--C 1.531 1.063 0 O-C-N 124.54 1.15 . . . . 63.020000000000003 110.983 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -163.6 179.77 6.98 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.545 0.791 . . . . 65.430000000000007 110.063 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.764 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -102.49 -43.06 5.75 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.526 1.141 . . . . 73.519999999999996 109.279 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.764 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 0.7 OUTLIER -154.99 169.89 23.03 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.534 1.146 . . . . 73.319999999999993 108.05 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . 1.026 HG22 ' CG1' ' A' ' 82' ' ' VAL . 1.2 p -137.99 158.32 44.57 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 65.049999999999997 110.374 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.826 ' HB ' HG23 ' A' ' 83' ' ' ILE . 10.5 mm -110.98 142.26 23.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.53 1.144 . . . . 52.030000000000001 109.257 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.802 HD13 ' O ' ' A' ' 136' ' ' ILE . 0.5 OUTLIER -134.69 96.46 3.56 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.462 1.101 . . . . 73.019999999999996 109.31 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 1.035 ' CD2' ' HB2' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.43 96.72 0.08 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.547 1.154 . . . . 73.239999999999995 109.278 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.725 HD11 HD13 ' A' ' 189' ' ' LEU . 0.2 OUTLIER -61.23 102.81 0.24 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.468 1.105 . . . . 52.32 109.291 -179.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . 0.443 ' O ' ' N ' ' A' ' 144' ' ' LEU . 2.6 m -130.47 155.59 46.19 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.446 1.091 . . . . 63.210000000000001 110.397 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -64.42 -36.39 84.0 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.546 1.154 . . . . 63.549999999999997 110.313 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -84.1 -25.93 29.35 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.469 1.106 . . . . 72.200000000000003 109.366 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.772 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 52.9 t80 -85.67 -19.93 30.17 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.479 1.112 . . . . 60.229999999999997 111.06 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.707 HD13 ' C ' ' A' ' 144' ' ' LEU . 2.0 tm? -66.23 -67.23 0.46 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.495 1.122 . . . . 64.239999999999995 109.299 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.45 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 22.4 mmt180 -55.17 -19.69 8.49 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.481 1.113 . . . . 73.129999999999995 110.355 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -71.96 -67.2 0.55 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.475 1.11 . . . . 74.030000000000001 109.318 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.478 HG21 ' CE1' ' A' ' 143' ' ' PHE . 3.1 p -66.84 -54.62 20.54 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.542 1.151 . . . . 75.120000000000005 110.4 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.519 ' CZ3' ' HE3' ' A' ' 158' ' ' MET . 3.3 t-105 -43.08 -36.54 1.67 Allowed 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.518 1.136 . . . . 75.109999999999999 108.029 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' CYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 43.7 t -78.64 -45.33 21.77 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.61 1.194 . . . . 74.120000000000005 108.354 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' ASN . . . . . 0.453 ' N ' ' O ' ' A' ' 147' ' ' THR . 6.3 t-20 -56.51 -21.83 28.7 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.432 1.082 . . . . 72.5 109.319 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.771 ' HE1' HD13 ' A' ' 157' ' ' LEU . 10.7 m-30 -77.06 -51.78 10.46 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.558 1.161 . . . . 75.140000000000001 111.027 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 38.6 tt0 -42.46 -40.9 2.74 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.475 1.109 . . . . 71.109999999999999 110.3 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -88.81 -23.63 22.8 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.465 1.103 . . . . 74.450000000000003 110.924 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.564 ' CE2' ' HB2' ' A' ' 156' ' ' SER . 6.8 t80 -135.17 87.91 2.37 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.481 1.113 . . . . 71.400000000000006 111.116 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.84 -4.65 29.19 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.525 1.141 . . . . 75.420000000000002 110.416 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . 0.564 ' HB2' ' CE2' ' A' ' 154' ' ' TYR . 0.7 OUTLIER -54.68 -34.39 62.23 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.521 1.138 . . . . 65.340000000000003 109.994 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.842 HD12 HD22 ' A' ' 125' ' ' LEU . 0.9 OUTLIER -83.06 -31.43 27.37 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.49 1.119 . . . . 74.040000000000006 109.242 -179.967 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' MET . . . . . 0.9 ' O ' HG22 ' A' ' 161' ' ' VAL . 3.5 mmt -58.94 -37.42 76.68 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.493 1.121 . . . . 72.200000000000003 110.956 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -84.11 -9.62 58.44 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.453 1.095 . . . . 72.439999999999998 109.359 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' SER . . . . . 0.921 ' HB3' HG21 ' A' ' 170' ' ' VAL . 0.3 OUTLIER -82.8 -31.37 28.21 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.43 1.082 . . . . 73.409999999999997 110.037 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . 0.9 HG22 ' O ' ' A' ' 158' ' ' MET . 29.8 m -62.18 -18.04 19.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 124.45 1.094 . . . . 61.399999999999999 109.248 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 42.0 m-20 -78.8 0.59 26.37 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.558 1.161 . . . . 62.350000000000001 109.234 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.724 ' NE ' HG23 ' A' ' 192' ' ' ILE . 0.0 OUTLIER 50.55 49.96 19.8 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.478 1.111 . . . . 43.310000000000002 110.281 179.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -50.63 -177.98 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.497 1.123 . . . . 65.519999999999996 110.312 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 22.1 p80 -93.26 39.58 1.05 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.548 1.155 . . . . 64.109999999999999 109.572 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.562 ' C ' HG21 ' A' ' 221' ' ' ILE . 2.7 tptt -94.71 179.33 5.29 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.536 1.147 . . . . 74.0 109.317 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 167' ' ' TYR . . . . . . . . . . . . . 24.4 p90 -84.95 44.27 1.06 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.489 1.118 . . . . 72.019999999999996 110.979 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . 0.507 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 19.5 p30 -170.51 142.31 2.06 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 62.340000000000003 109.352 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.481 ' O ' ' N ' ' A' ' 135' ' ' THR . 1.4 t -128.14 128.4 44.77 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.555 1.159 . . . . 54.43 109.982 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.921 HG21 ' HB3' ' A' ' 160' ' ' SER . 8.9 t -95.59 107.18 19.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.507 1.129 . . . . 71.310000000000002 109.319 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.662 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -121.48 106.31 37.92 Favored Pre-proline 0 C--N 1.324 -0.512 0 O-C-N 124.511 1.132 . . . . 71.540000000000006 109.338 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . 0.884 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -74.98 116.24 4.53 Favored 'Trans proline' 0 C--N 1.359 1.118 0 O-C-N 124.52 1.8 . . . . 60.140000000000001 111.016 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . 0.667 ' CE ' HD12 ' A' ' 195' ' ' LEU . 3.6 ttt -92.46 152.46 19.67 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.492 1.12 . . . . 74.109999999999999 110.997 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . 0.44 ' N ' ' HG2' ' A' ' 173' ' ' MET . 3.6 tpp180 -104.78 116.81 60.27 Favored Pre-proline 0 C--N 1.325 -0.47 0 O-C-N 124.52 1.138 . . . . 61.350000000000001 110.301 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 175' ' ' PRO . . . . . 0.469 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.1 Cg_endo -75.05 153.85 41.84 Favored 'Trans proline' 0 C--N 1.36 1.183 0 O-C-N 124.47 1.774 . . . . 72.200000000000003 110.999 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . 0.901 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -87.31 -43.79 11.9 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.463 1.102 . . . . 43.539999999999999 109.307 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -71.81 -27.21 62.77 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.51 1.131 . . . . 74.239999999999995 109.284 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 178' ' ' ASN . . . . . 0.469 ' CB ' ' HG2' ' A' ' 175' ' ' PRO . 7.1 m-80 -110.85 97.86 35.63 Favored Pre-proline 0 C--N 1.326 -0.445 0 O-C-N 124.435 1.085 . . . . 61.130000000000003 109.307 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.95 121.38 6.56 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.562 1.822 . . . . 74.400000000000006 111.081 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.519 HD13 ' HB2' ' A' ' 184' ' ' ARG . 0.4 OUTLIER -128.9 96.49 29.15 Favored Pre-proline 0 C--N 1.324 -0.527 0 O-C-N 124.575 1.172 . . . . 64.420000000000002 109.327 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.04 171.54 18.12 Favored 'Trans proline' 0 C--N 1.359 1.124 0 O-C-N 124.554 1.818 . . . . 73.049999999999997 110.971 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 7.6 ptp85 -59.66 -23.41 63.03 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.531 1.145 . . . . 71.439999999999998 110.278 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . 0.414 ' HG2' ' N ' ' A' ' 184' ' ' ARG . 2.7 pt-20 -70.05 -29.23 66.2 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.459 1.099 . . . . 60.350000000000001 110.337 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 184' ' ' ARG . . . . . 0.519 ' HB2' HD13 ' A' ' 180' ' ' LEU . 27.7 mmt180 -95.41 -18.74 20.47 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.542 1.151 . . . . 74.019999999999996 110.31 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 185' ' ' THR . . . . . 0.499 HG22 ' HD2' ' A' ' 186' ' ' PRO . 19.9 m -80.9 143.95 54.5 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.516 1.135 . . . . 75.329999999999998 110.381 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 186' ' ' PRO . . . . . 0.737 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.1 Cg_endo -75.08 155.61 42.55 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.475 1.776 . . . . 72.209999999999994 110.927 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 187' ' ' PHE . . . . . 0.503 ' O ' ' CG2' ' A' ' 191' ' ' THR . 9.2 p90 -69.4 -7.1 34.62 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.513 1.133 . . . . 72.299999999999997 111.04 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . 0.627 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -93.97 -53.14 4.11 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.523 1.139 . . . . 74.030000000000001 109.3 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.863 HD22 ' HG3' ' A' ' 172' ' ' PRO . 53.2 mt -68.3 -42.4 79.52 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.424 1.078 . . . . 74.209999999999994 109.281 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 190' ' ' GLN . . . . . 0.411 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.3 pt20 -63.82 -10.96 23.12 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.512 1.132 . . . . 74.219999999999999 110.327 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 191' ' ' THR . . . . . 0.503 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 36.2 p -113.6 18.31 17.66 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.429 1.08 . . . . 75.030000000000001 110.393 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.738 HD13 ' O ' ' A' ' 161' ' ' VAL . 4.9 mt -136.37 142.46 38.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.462 1.101 . . . . 73.0 109.265 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -48.23 124.31 7.64 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.515 1.135 . . . . 70.540000000000006 109.319 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . 0.884 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -121.09 155.05 35.28 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.463 1.102 . . . . 70.230000000000004 109.311 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 195' ' ' LEU . . . . . 0.707 HD23 HD12 ' A' ' 209' ' ' ILE . 0.3 OUTLIER -82.27 134.22 35.27 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.538 1.149 . . . . 74.209999999999994 109.278 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . 0.412 ' O ' ' HA ' ' A' ' 202' ' ' PHE . 31.0 mt-10 -112.72 131.47 55.65 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.455 1.097 . . . . 72.409999999999997 110.259 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.901 ' HG3' HD21 ' A' ' 176' ' ' LEU . 3.8 tp10 -113.42 -25.37 8.83 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.491 1.119 . . . . 61.439999999999998 110.369 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -96.98 3.95 51.77 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.515 1.135 . . . . 54.219999999999999 110.299 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 19.5 t -97.26 174.27 6.8 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.545 1.153 . . . . 64.019999999999996 109.966 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -83.47 -32.89 25.77 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.54 1.15 . . . . 75.120000000000005 110.253 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -87.71 19.34 33.67 Favored Glycine 0 CA--C 1.529 0.941 0 O-C-N 124.568 1.167 . . . . 71.420000000000002 111.034 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 202' ' ' PHE . . . . . 0.819 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.1 OUTLIER -56.8 -43.42 99.36 Favored Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.454 0.738 . . . . 72.420000000000002 110.98 -179.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 203' ' ' PRO . . . . . 0.615 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.0 Cg_endo -75.02 -28.91 8.73 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.486 1.782 . . . . 63.210000000000001 110.964 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 204' ' ' THR . . . . . 0.402 HG22 ' N ' ' A' ' 205' ' ' GLN . 0.9 OUTLIER -64.69 -65.1 0.72 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.449 1.093 . . . . 60.340000000000003 110.405 179.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 205' ' ' GLN . . . . . 0.402 ' N ' HG22 ' A' ' 204' ' ' THR . 5.8 mt-30 -50.38 -44.31 54.78 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.458 1.099 . . . . 61.409999999999997 110.318 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 206' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 202' ' ' PHE . 72.5 t -56.2 -29.44 27.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.453 1.096 . . . . 70.519999999999996 109.363 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -82.8 -51.54 7.57 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.517 1.136 . . . . 52.020000000000003 110.297 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . 0.42 ' N ' ' HD2' ' A' ' 208' ' ' ARG . 11.6 mpt_? -58.21 -62.52 1.77 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.543 1.152 . . . . 73.230000000000004 110.377 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 209' ' ' ILE . . . . . 0.707 HD12 HD23 ' A' ' 195' ' ' LEU . 84.6 mt -49.85 -51.29 16.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.516 1.135 . . . . 72.420000000000002 109.306 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 210' ' ' PHE . . . . . 0.685 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.2 m-85 -101.49 61.71 0.92 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.494 1.121 . . . . 73.230000000000004 111.016 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 211' ' ' GLN . . . . . 0.544 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -110.94 145.85 37.62 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.507 1.13 . . . . 73.019999999999996 110.334 180.0 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . 0.452 ' O ' ' N ' ' A' ' 215' ' ' TYR . 32.4 tt0 -49.43 -55.02 14.55 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.506 1.129 . . . . 73.420000000000002 110.306 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.04 -23.59 1.24 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.495 1.122 . . . . 74.450000000000003 110.083 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.544 HG23 ' HG2' ' A' ' 211' ' ' GLN . 38.9 t -96.22 -27.49 4.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.538 1.149 . . . . 70.519999999999996 109.321 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 215' ' ' TYR . . . . . 0.452 ' N ' ' O ' ' A' ' 212' ' ' GLU . 3.4 t80 -63.87 -28.72 70.04 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.495 1.122 . . . . 74.209999999999994 111.01 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . 0.439 ' O ' ' N ' ' A' ' 220' ' ' THR . 64.2 mmtt -60.0 -65.28 0.71 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.547 1.154 . . . . 73.510000000000005 109.352 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 217' ' ' THR . . . . . 0.797 HG22 HD11 ' A' ' 221' ' ' ILE . 34.7 m -40.58 -62.94 0.7 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.546 1.154 . . . . 73.430000000000007 110.398 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 218' ' ' GLN . . . . . 0.533 ' HA ' HD12 ' A' ' 221' ' ' ILE . 93.4 mm-40 -50.15 -63.31 1.15 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.52 1.137 . . . . 70.239999999999995 110.342 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 219' ' ' GLN . . . . . 0.41 ' NE2' ' HB3' ' A' ' 223' ' ' LYS . 34.1 tp60 -52.99 -20.2 3.24 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.561 1.163 . . . . 74.120000000000005 110.274 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 220' ' ' THR . . . . . 0.439 ' N ' ' O ' ' A' ' 216' ' ' LYS . 0.9 OUTLIER -87.49 -29.69 21.18 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.476 1.11 . . . . 74.439999999999998 110.435 -179.939 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 221' ' ' ILE . . . . . 0.797 HD11 HG22 ' A' ' 217' ' ' THR . 10.0 mt -78.86 -35.24 17.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.485 1.116 . . . . 71.109999999999999 109.305 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 222' ' ' TRP . . . . . 0.412 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 25.1 t90 -69.91 -55.0 10.86 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.492 1.12 . . . . 74.049999999999997 108.047 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.41 ' HB3' ' NE2' ' A' ' 219' ' ' GLN . 0.0 OUTLIER -58.67 -22.03 55.9 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.467 1.104 . . . . 75.239999999999995 109.356 179.927 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 220' ' ' THR . 67.9 mt-10 . . . . . 0 C--N 1.325 -0.485 0 O-C-N 124.539 1.149 . . . . 55.020000000000003 110.354 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.512 HG22 ' N ' ' A' ' 78' ' ' PHE . 3.3 p . . . . . 0 N--CA 1.453 -0.29 0 N-CA-C 109.334 -0.617 . . . . 65.129999999999995 109.334 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.512 ' N ' HG22 ' A' ' 77' ' ' VAL . 2.3 t80 -88.87 24.29 2.1 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.535 1.147 . . . . 74.200000000000003 111.046 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.794 HD11 HG22 ' A' ' 110' ' ' ILE . 3.6 tp -40.35 159.33 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.464 1.102 . . . . 75.329999999999998 109.302 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.657 ' HD3' HG22 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -106.24 -49.42 3.36 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.47 1.106 . . . . 73.239999999999995 109.292 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.597 ' CD1' ' O ' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -167.07 132.26 2.07 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.513 1.133 . . . . 74.540000000000006 110.968 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.52 ' CG2' ' CE ' ' A' ' 115' ' ' MET . 3.1 p -90.14 158.17 2.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.487 1.117 . . . . 42.520000000000003 109.293 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.767 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.0 mp -113.56 94.58 3.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 O-C-N 124.46 1.1 . . . . 52.32 109.276 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.06 HD11 ' HB3' ' A' ' 128' ' ' ALA . 5.0 mt -70.25 118.03 12.56 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.523 1.14 . . . . 72.400000000000006 109.362 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.6 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -136.62 173.74 11.38 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.532 1.145 . . . . 53.329999999999998 109.566 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -111.19 163.66 13.68 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.458 1.099 . . . . 72.109999999999999 109.291 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.415 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 10.3 tt0 -65.46 -10.7 36.45 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.562 1.164 . . . . 72.010000000000005 110.36 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -85.38 -44.89 12.39 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.501 1.126 . . . . 62.420000000000002 109.311 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.447 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.6 OUTLIER -119.31 43.3 2.64 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.525 1.14 . . . . 73.349999999999994 109.364 179.945 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.457 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -71.84 -42.92 66.36 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.51 1.131 . . . . 71.340000000000003 110.358 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -64.49 -40.23 95.28 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.46 1.1 . . . . 62.229999999999997 109.277 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.408 ' CD ' ' C ' ' A' ' 92' ' ' GLU . 0.5 OUTLIER -53.28 -69.72 0.11 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.527 1.142 . . . . 75.239999999999995 110.298 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.699 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -43.03 -32.14 0.63 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.565 1.166 . . . . 51.530000000000001 109.329 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.659 ' HG ' HD13 ' A' ' 111' ' ' ILE . 0.8 OUTLIER -67.5 -57.25 6.84 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.468 1.105 . . . . 52.530000000000001 109.27 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.11 -35.25 0.54 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.594 1.183 . . . . 73.019999999999996 110.355 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.653 HG21 ' HE1' ' A' ' 173' ' ' MET . 0.9 OUTLIER -79.31 -65.82 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 O-C-N 124.466 1.104 . . . . 64.510000000000005 109.307 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.814 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -42.21 -24.78 0.06 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.515 1.135 . . . . 74.040000000000006 110.329 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.448 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -74.32 -59.06 2.9 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.561 1.163 . . . . 74.019999999999996 109.306 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.873 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -62.47 -22.58 66.34 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.421 1.076 . . . . 63.509999999999998 109.271 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.873 ' N ' HD23 ' A' ' 99' ' ' LEU . 39.0 mt -73.65 -39.21 64.64 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.533 1.146 . . . . 55.299999999999997 109.311 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . 0.464 ' HB2' ' CD ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -87.84 46.77 1.42 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.579 1.174 . . . . 63.5 110.318 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -175.8 -60.39 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.543 1.152 . . . . 51.100000000000001 109.253 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.509 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 49.0 t0 -40.45 -63.17 0.67 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.541 1.15 . . . . 73.150000000000006 109.324 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.939 ' CE2' HG11 ' A' ' 206' ' ' VAL . 4.9 m-85 -103.02 -14.62 16.38 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.465 1.103 . . . . 73.430000000000007 111.017 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.82 39.23 7.14 Favored Glycine 0 CA--C 1.53 1.009 0 O-C-N 124.514 1.134 . . . . 61.020000000000003 110.952 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.657 HG22 ' HD3' ' A' ' 80' ' ' LYS . 11.0 mm -75.57 72.21 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 O-C-N 124.516 0.774 . . . . 63.130000000000003 109.349 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.55 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -118.38 151.79 49.99 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.476 1.11 . . . . 74.040000000000006 109.363 179.996 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.55 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.0 147.46 89.33 Favored 'Cis proline' 0 C--N 1.36 1.169 0 C-N-CA 121.01 -2.496 . . . . 73.420000000000002 110.977 0.023 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -124.34 135.04 9.4 Favored Glycine 0 CA--C 1.531 1.068 0 O-C-N 124.431 1.082 . . . . 72.109999999999999 110.942 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.794 HG22 HD11 ' A' ' 79' ' ' LEU . 9.9 tt -156.94 153.94 6.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.499 0.764 . . . . 75.340000000000003 109.332 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . 0.814 HG23 ' HG2' ' A' ' 97' ' ' GLN . 8.7 pt -95.98 -177.06 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.549 1.156 . . . . 65.430000000000007 109.319 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.606 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 5.4 t80 -80.92 -19.08 45.06 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.54 1.15 . . . . 62.43 110.959 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.441 ' HB2' ' HE1' ' A' ' 85' ' ' HIS . . . -91.6 -12.87 33.05 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.496 1.122 . . . . 42.140000000000001 109.294 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.419 ' C ' HD11 ' A' ' 110' ' ' ILE . 37.6 mm-40 -97.62 -24.53 15.49 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.475 1.109 . . . . 72.219999999999999 110.324 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.52 ' CE ' ' CG2' ' A' ' 82' ' ' VAL . 7.4 ttm -46.03 143.93 3.2 Favored Pre-proline 0 C--N 1.324 -0.511 0 O-C-N 124.421 1.076 . . . . 62.119999999999997 111.007 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.473 ' HD2' ' CG ' ' A' ' 115' ' ' MET . 18.0 Cg_endo . . . . . 0 C--N 1.36 1.157 0 O-C-N 124.527 1.804 . . . . 70.030000000000001 110.95 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.54 HD12 ' N ' ' A' ' 126' ' ' ASP . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.331 0 N-CA-C 109.323 -0.621 . . . . 60.420000000000002 109.323 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.54 ' N ' HD12 ' A' ' 125' ' ' LEU . 3.9 p-10 -67.86 -15.36 63.58 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.462 1.101 . . . . 71.439999999999998 109.284 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.407 ' O ' ' ND2' ' A' ' 130' ' ' ASN . 66.7 m-20 -62.3 -27.6 69.15 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.536 1.148 . . . . 74.150000000000006 109.402 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 1.06 ' HB3' HD11 ' A' ' 84' ' ' LEU . . . -93.14 -13.12 28.85 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.495 1.122 . . . . 75.239999999999995 109.352 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.728 ' O ' HG12 ' A' ' 129' ' ' VAL . 71.1 t -92.86 30.44 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 124.593 1.183 . . . . 74.049999999999997 109.247 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . 0.407 ' ND2' ' O ' ' A' ' 127' ' ' ASP . 28.3 p30 -135.81 151.18 49.81 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.553 1.158 . . . . 74.530000000000001 109.306 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 42.87 64.53 1.64 Allowed Glycine 0 CA--C 1.53 0.972 0 O-C-N 124.582 1.176 . . . . 64.129999999999995 111.005 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -163.61 -174.29 3.64 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.48 0.753 . . . . 54.329999999999998 109.96 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.608 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -113.71 -35.91 5.04 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.539 1.149 . . . . 71.439999999999998 109.302 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.687 ' HB3' HD13 ' A' ' 171' ' ' ILE . 0.6 OUTLIER -159.07 163.58 36.15 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.556 1.16 . . . . 73.5 108.039 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 28.4 p -131.42 135.47 47.19 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.532 1.145 . . . . 64.25 110.383 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.767 ' HB ' HG23 ' A' ' 83' ' ' ILE . 36.4 mm -84.31 136.99 21.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.485 1.116 . . . . 64.030000000000001 109.314 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.717 HD23 ' O ' ' A' ' 136' ' ' ILE . 21.2 mt -129.7 99.08 5.01 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.582 1.176 . . . . 51.219999999999999 109.338 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.699 HD21 ' HB2' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.26 88.19 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.573 1.171 . . . . 64.409999999999997 109.295 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 18.6 mt -56.93 99.19 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.495 1.122 . . . . 71.439999999999998 109.322 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . 0.612 HG23 ' OD1' ' A' ' 178' ' ' ASN . 10.1 m -124.03 177.31 5.86 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.531 1.144 . . . . 72.439999999999998 110.458 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . 0.567 ' H ' HG22 ' A' ' 140' ' ' THR . 18.9 mt-10 -80.32 -33.7 37.31 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.435 1.085 . . . . 74.25 110.23 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -89.58 -20.84 23.26 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.492 1.12 . . . . 60.340000000000003 109.334 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.478 ' CZ ' HG21 ' A' ' 147' ' ' THR . 19.6 t80 -89.8 -46.34 8.65 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.554 1.159 . . . . 71.400000000000006 111.078 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.761 HD13 ' C ' ' A' ' 144' ' ' LEU . 1.5 tm? -46.88 -61.08 2.02 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.469 1.106 . . . . 71.450000000000003 109.242 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 9.9 mmt85 -60.59 -20.69 61.28 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.488 1.117 . . . . 72.409999999999997 110.27 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -71.89 -66.43 0.64 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.568 1.167 . . . . 71.219999999999999 109.26 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.478 HG21 ' CZ ' ' A' ' 143' ' ' PHE . 16.5 p -69.37 -54.52 14.03 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.457 1.098 . . . . 72.439999999999998 110.38 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.471 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 24.1 t-105 -42.17 -38.05 1.62 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.962 -1.125 . . . . 72.439999999999998 107.962 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' CYS . . . . . 0.446 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 53.3 t -79.02 -45.33 20.42 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.524 1.14 . . . . 71.120000000000005 108.295 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' ASN . . . . . 0.439 ' N ' ' O ' ' A' ' 147' ' ' THR . 3.0 t30 -57.91 -17.78 18.88 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.484 1.115 . . . . 65.150000000000006 109.306 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.561 ' HD2' ' HE3' ' A' ' 158' ' ' MET . 9.7 m-30 -83.06 -46.35 12.93 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 75.409999999999997 111.004 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -49.21 -33.51 12.67 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.48 1.113 . . . . 65.239999999999995 110.287 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -97.29 -19.83 18.28 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.45 1.094 . . . . 75.120000000000005 111.023 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.48 ' CE1' ' HB2' ' A' ' 156' ' ' SER . 0.4 OUTLIER -128.59 94.94 3.99 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.535 1.147 . . . . 74.400000000000006 111.006 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.401 ' O ' ' N ' ' A' ' 158' ' ' MET . 3.5 t -64.53 -21.23 66.63 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.526 1.141 . . . . 75.150000000000006 110.355 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . 0.48 ' HB2' ' CE1' ' A' ' 154' ' ' TYR . 18.8 t -40.13 -48.16 2.46 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.503 1.127 . . . . 63.310000000000002 109.997 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.445 HD21 HD13 ' A' ' 125' ' ' LEU . 0.5 OUTLIER -70.29 -42.95 71.38 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.519 1.137 . . . . 72.430000000000007 109.323 179.97 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' MET . . . . . 0.607 ' HE1' HG21 ' A' ' 161' ' ' VAL . 24.9 mmt -55.2 -20.71 11.32 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.55 1.156 . . . . 72.409999999999997 110.982 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 20.1 m-80 -86.3 -30.78 22.0 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.623 1.202 . . . . 73.510000000000005 109.275 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' SER . . . . . 0.583 ' HB2' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -82.22 -17.48 45.93 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.518 1.136 . . . . 75.430000000000007 110.026 179.973 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . 0.607 HG21 ' HE1' ' A' ' 158' ' ' MET . 6.6 t -61.85 -30.6 48.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.48 1.113 . . . . 31.399999999999999 109.297 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' ASN . . . . . 0.482 ' O ' ' C ' ' A' ' 163' ' ' ARG . 15.5 t-20 -82.41 4.53 23.73 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.59 1.181 . . . . 75.120000000000005 109.263 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.482 ' C ' ' O ' ' A' ' 162' ' ' ASN . 0.0 OUTLIER 32.42 49.77 0.16 Allowed 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.498 1.124 . . . . 75.140000000000001 110.289 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -52.37 -173.74 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.508 1.13 . . . . 72.019999999999996 110.292 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -84.18 60.74 6.11 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.504 1.127 . . . . 72.140000000000001 109.528 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.49 ' HG3' ' CD1' ' A' ' 167' ' ' TYR . 0.1 OUTLIER -121.51 157.66 30.17 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.544 1.152 . . . . 74.310000000000002 109.28 179.976 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 167' ' ' TYR . . . . . 0.565 ' CD2' ' N ' ' A' ' 168' ' ' ASN . 52.1 p90 -54.65 -47.17 73.87 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.54 1.15 . . . . 74.329999999999998 110.999 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . 0.565 ' N ' ' CD2' ' A' ' 167' ' ' TYR . 12.7 p30 -87.07 126.18 34.6 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.439 1.087 . . . . 71.420000000000002 109.279 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.416 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 3.1 t -121.86 176.91 5.51 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.494 1.121 . . . . 55.119999999999997 110.011 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.727 ' O ' HD12 ' A' ' 171' ' ' ILE . 3.2 t -134.16 117.26 24.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.464 1.103 . . . . 73.409999999999997 109.291 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.727 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.6 mp -128.13 97.45 29.04 Favored Pre-proline 0 C--N 1.325 -0.481 0 O-C-N 124.518 1.136 . . . . 74.510000000000005 109.252 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . 0.905 ' HG3' HD22 ' A' ' 189' ' ' LEU . 18.6 Cg_endo -74.95 107.1 2.4 Favored 'Trans proline' 0 C--N 1.359 1.126 0 O-C-N 124.51 1.795 . . . . 71.439999999999998 111.003 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . 0.653 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.8 ttt -82.52 157.66 23.46 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.427 1.079 . . . . 72.049999999999997 110.982 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . 0.436 ' N ' ' HG2' ' A' ' 173' ' ' MET . 29.4 mmm-85 -108.98 113.67 59.08 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.498 1.124 . . . . 74.109999999999999 110.314 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 175' ' ' PRO . . . . . 0.448 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.3 Cg_endo -74.99 146.39 32.61 Favored 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.451 1.764 . . . . 55.219999999999999 111.013 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . 0.572 HD13 ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -82.32 -40.77 20.97 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.534 1.146 . . . . 73.540000000000006 109.251 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -72.18 -28.63 63.34 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 124.535 1.147 . . . . 65.319999999999993 109.293 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 178' ' ' ASN . . . . . 0.612 ' OD1' HG23 ' A' ' 140' ' ' THR . 4.7 m-80 -110.77 99.2 41.06 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.53 1.144 . . . . 73.409999999999997 109.255 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 135.49 19.15 Favored 'Trans proline' 0 C--N 1.359 1.111 0 O-C-N 124.449 1.763 . . . . 43.399999999999999 111.019 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.604 HD12 ' OG1' ' A' ' 185' ' ' THR . 0.4 OUTLIER -141.2 96.99 7.0 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.463 1.102 . . . . 71.209999999999994 109.364 179.973 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.01 171.35 18.51 Favored 'Trans proline' 0 C--N 1.359 1.121 0 O-C-N 124.529 1.804 . . . . 62.399999999999999 110.978 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . 0.5 ' CG ' ' OE1' ' A' ' 190' ' ' GLN . 50.0 mtm-85 -62.74 -23.57 67.25 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.55 1.156 . . . . 74.099999999999994 110.305 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -72.02 -5.17 33.13 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.499 1.125 . . . . 60.509999999999998 110.279 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 184' ' ' ARG . . . . . 0.484 ' O ' HD11 ' A' ' 180' ' ' LEU . 15.6 mmt85 -128.94 4.95 5.38 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.478 1.111 . . . . 65.329999999999998 110.274 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 185' ' ' THR . . . . . 0.604 ' OG1' HD12 ' A' ' 180' ' ' LEU . 51.5 m -110.97 143.8 29.05 Favored Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.49 1.119 . . . . 74.0 110.36 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 186' ' ' PRO . . . . . 0.7 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -75.05 146.91 33.03 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.556 1.819 . . . . 72.439999999999998 111.018 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 187' ' ' PHE . . . . . 0.457 ' O ' HG23 ' A' ' 191' ' ' THR . 38.6 p90 -63.05 -11.49 19.79 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.447 1.092 . . . . 73.439999999999998 111.031 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -87.78 -54.03 4.46 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.51 1.131 . . . . 71.019999999999996 109.313 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.905 HD22 ' HG3' ' A' ' 172' ' ' PRO . 23.0 mt -73.31 -19.0 61.14 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.504 1.127 . . . . 64.030000000000001 109.311 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 190' ' ' GLN . . . . . 0.5 ' OE1' ' CG ' ' A' ' 182' ' ' ARG . 6.7 tt0 -84.84 -2.2 57.45 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.485 1.115 . . . . 64.109999999999999 110.297 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 191' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 187' ' ' PHE . 41.2 p -126.38 1.83 7.0 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.509 1.13 . . . . 53.340000000000003 110.399 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.497 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 12.9 mt -94.25 163.94 2.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.547 1.154 . . . . 74.239999999999995 109.309 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 193' ' ' ASN . . . . . 0.491 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 58.8 t30 -78.07 57.53 1.81 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.52 1.138 . . . . 64.049999999999997 109.319 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . 0.857 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -61.11 177.16 0.36 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.485 1.116 . . . . 65.329999999999998 109.324 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 195' ' ' LEU . . . . . 0.935 HD23 HD12 ' A' ' 209' ' ' ILE . 0.2 OUTLIER -108.29 152.89 24.01 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.523 1.139 . . . . 64.519999999999996 109.26 -179.932 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . 0.55 ' H ' HD13 ' A' ' 195' ' ' LEU . 99.1 mt-10 -144.47 137.09 26.69 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.535 1.147 . . . . 53.210000000000001 110.341 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.475 ' HG3' ' CD1' ' A' ' 176' ' ' LEU . 0.8 OUTLIER -111.06 -12.0 14.23 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.431 1.082 . . . . 74.299999999999997 110.29 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . 0.457 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 1.4 pt-20 -95.22 13.24 26.14 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.482 1.114 . . . . 64.310000000000002 110.318 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 1.7 t -118.18 164.96 14.39 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.541 1.151 . . . . 73.25 110.005 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -78.59 -26.5 45.49 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.51 1.131 . . . . 74.120000000000005 110.298 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -87.08 13.08 60.42 Favored Glycine 0 CA--C 1.53 1.009 0 O-C-N 124.45 1.094 . . . . 74.310000000000002 111.026 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 202' ' ' PHE . . . . . 0.774 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.0 OUTLIER -52.61 -45.74 96.04 Favored Pre-proline 0 C--N 1.325 -0.458 0 O-C-N 124.423 0.72 . . . . 72.25 110.986 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 203' ' ' PRO . . . . . 0.592 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.2 Cg_endo -74.97 -34.8 3.58 Favored 'Trans proline' 0 C--N 1.359 1.116 0 O-C-N 124.562 1.822 . . . . 54.539999999999999 111.014 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -57.45 -56.0 27.47 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.448 1.092 . . . . 61.009999999999998 110.358 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -63.61 -36.65 84.51 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.467 1.104 . . . . 74.510000000000005 110.33 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 206' ' ' VAL . . . . . 0.939 HG11 ' CE2' ' A' ' 104' ' ' PHE . 37.7 t -63.86 -37.09 78.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 O-C-N 124.491 1.119 . . . . 74.400000000000006 109.329 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 207' ' ' GLU . . . . . 0.435 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 4.3 mt-10 -69.68 -49.49 53.01 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.545 1.153 . . . . 72.329999999999998 110.305 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 80.0 mtt-85 -67.21 -66.25 0.58 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.476 1.11 . . . . 70.239999999999995 110.271 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 209' ' ' ILE . . . . . 0.935 HD12 HD23 ' A' ' 195' ' ' LEU . 45.4 mt -43.46 -57.78 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.53 1.144 . . . . 70.109999999999999 109.309 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 210' ' ' PHE . . . . . 0.83 ' CD1' HG22 ' A' ' 209' ' ' ILE . 3.2 m-85 -102.53 69.45 1.1 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.54 1.15 . . . . 62.219999999999999 110.967 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 211' ' ' GLN . . . . . 0.468 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -110.83 143.26 41.69 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.457 1.098 . . . . 61.140000000000001 110.3 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . 0.454 ' O ' ' N ' ' A' ' 215' ' ' TYR . 29.2 tt0 -50.09 -53.74 25.21 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.541 1.15 . . . . 71.219999999999999 110.246 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -48.56 -23.53 1.02 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.482 1.114 . . . . 71.439999999999998 109.983 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.468 HG23 ' HG2' ' A' ' 211' ' ' GLN . 20.4 t -95.14 -29.56 4.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 O-C-N 124.499 1.124 . . . . 71.019999999999996 109.26 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 215' ' ' TYR . . . . . 0.461 ' OH ' ' CD2' ' A' ' 78' ' ' PHE . 9.4 t80 -61.92 -19.01 62.25 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.476 1.11 . . . . 72.150000000000006 111.039 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . 0.42 ' N ' ' HD2' ' A' ' 216' ' ' LYS . 16.5 mmmt -76.13 -44.52 38.06 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.539 1.149 . . . . 75.120000000000005 109.245 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 217' ' ' THR . . . . . 0.871 HG22 HD11 ' A' ' 221' ' ' ILE . 74.7 m -59.63 -66.43 0.51 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.5 1.125 . . . . 44.009999999999998 110.445 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 218' ' ' GLN . . . . . 0.425 ' NE2' ' N ' ' A' ' 218' ' ' GLN . 0.0 OUTLIER -51.34 -28.31 12.01 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.486 1.117 . . . . 73.200000000000003 110.32 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 219' ' ' GLN . . . . . 0.426 ' NE2' ' HD2' ' A' ' 223' ' ' LYS . 33.3 tp60 -67.96 -55.57 12.25 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.54 1.15 . . . . 74.5 110.263 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.6 m -62.31 -36.4 82.05 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.534 1.146 . . . . 63.310000000000002 110.392 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 221' ' ' ILE . . . . . 0.871 HD11 HG22 ' A' ' 217' ' ' THR . 20.3 mt -66.87 -18.91 24.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.519 1.137 . . . . 74.230000000000004 109.302 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 222' ' ' TRP . . . . . 0.502 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 11.8 t90 -69.89 -64.68 0.84 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.517 1.135 . . . . 71.219999999999999 107.958 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.492 ' CB ' ' HZ2' ' A' ' 223' ' ' LYS . 0.0 OUTLIER -54.14 -31.21 51.81 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.509 1.13 . . . . 73.209999999999994 109.247 -179.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.325 -0.473 0 O-C-N 124.498 1.124 . . . . 75.409999999999997 110.301 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.444 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 2.4 p . . . . . 0 N--CA 1.453 -0.289 0 N-CA-C 109.295 -0.631 . . . . 61.340000000000003 109.295 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.553 ' CE2' ' HD3' ' A' ' 108' ' ' PRO . 48.2 p90 -96.22 40.33 1.13 Allowed 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.556 1.16 . . . . 74.010000000000005 111.003 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.475 HD11 HG22 ' A' ' 110' ' ' ILE . 3.0 tp -39.97 133.82 1.59 Allowed 'General case' 0 C--N 1.323 -0.553 0 O-C-N 124.52 1.138 . . . . 65.329999999999998 109.258 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.964 ' NZ ' HG23 ' A' ' 106' ' ' ILE . 9.2 mmmm -57.04 -66.35 0.47 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.483 1.114 . . . . 55.240000000000002 109.317 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.605 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 2.2 p90 -166.32 179.81 5.43 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.585 1.178 . . . . 72.129999999999995 111.001 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 1.047 HG11 ' HB1' ' A' ' 128' ' ' ALA . 0.8 OUTLIER -111.73 149.91 14.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.433 1.083 . . . . 71.420000000000002 109.318 179.999 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.892 ' CG2' ' HB1' ' A' ' 93' ' ' ALA . 4.9 mp -121.2 89.51 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.533 1.145 . . . . 72.420000000000002 109.252 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.893 HD21 ' CB ' ' A' ' 128' ' ' ALA . 6.2 mt -70.24 121.79 18.27 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.568 1.168 . . . . 71.409999999999997 109.35 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.823 ' CD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -144.14 174.64 10.7 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.541 1.151 . . . . 75.209999999999994 109.552 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.478 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -111.99 164.35 13.23 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.474 1.109 . . . . 70.150000000000006 109.279 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -63.04 -12.27 25.19 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.502 1.126 . . . . 73.519999999999996 110.244 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -82.33 -46.12 14.02 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.481 1.113 . . . . 64.439999999999998 109.273 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -120.71 44.33 2.52 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.452 1.095 . . . . 71.430000000000007 109.293 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.607 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -76.85 -25.66 53.41 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.457 1.098 . . . . 74.510000000000005 110.347 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -85.79 -21.75 28.01 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.453 1.096 . . . . 72.349999999999994 109.314 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -73.18 -45.67 55.11 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.56 1.163 . . . . 72.439999999999998 110.338 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.892 ' HB1' ' CG2' ' A' ' 83' ' ' ILE . . . -70.14 -31.43 68.93 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.464 1.103 . . . . 71.409999999999997 109.352 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.941 ' HB2' HD13 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -73.1 -52.82 12.84 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.51 1.131 . . . . 74.5 109.311 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.663 ' N ' HD13 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -43.23 -37.25 2.07 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.46 1.1 . . . . 73.209999999999994 110.328 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.805 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.3 t -73.42 -64.76 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.512 1.133 . . . . 64.439999999999998 109.315 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.486 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -40.6 -26.86 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.53 1.144 . . . . 64.430000000000007 110.319 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.454 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.0 OUTLIER -73.21 -60.18 2.36 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.521 1.138 . . . . 62.229999999999997 109.287 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.841 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -62.61 -22.11 66.16 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.504 1.127 . . . . 73.120000000000005 109.282 179.995 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.841 ' N ' HD23 ' A' ' 99' ' ' LEU . 28.5 mt -67.75 -43.23 80.35 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.415 1.072 . . . . 61.219999999999999 109.272 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -86.41 46.73 1.38 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.567 1.167 . . . . 64.409999999999997 110.272 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -166.68 -63.74 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.574 1.171 . . . . 61.240000000000002 109.247 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.551 ' OD1' ' CE2' ' A' ' 104' ' ' PHE . 22.4 t70 -46.55 -46.46 19.38 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.55 1.156 . . . . 63.310000000000002 109.297 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.911 ' CE1' HG11 ' A' ' 206' ' ' VAL . 0.4 OUTLIER -116.26 -31.87 5.5 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.514 1.134 . . . . 74.019999999999996 110.96 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.444 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 100.73 44.63 2.07 Favored Glycine 0 CA--C 1.531 1.049 0 O-C-N 124.519 1.137 . . . . 74.129999999999995 110.986 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.964 HG23 ' NZ ' ' A' ' 80' ' ' LYS . 6.1 mm -84.95 70.11 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.556 0.798 . . . . 73.510000000000005 109.308 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.541 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -120.92 155.48 57.52 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.468 1.105 . . . . 74.420000000000002 109.272 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.553 ' HD3' ' CE2' ' A' ' 78' ' ' PHE . 18.1 Cg_endo -74.97 160.76 96.07 Favored 'Cis proline' 0 C--N 1.36 1.176 0 C-N-CA 120.927 -2.53 . . . . 74.140000000000001 111.022 -0.052 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -136.56 137.11 8.81 Favored Glycine 0 CA--C 1.53 0.985 0 O-C-N 124.498 1.124 . . . . 65.409999999999997 111.028 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.544 HD11 ' O ' ' A' ' 114' ' ' GLU . 2.5 tt -148.2 152.09 12.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.529 0.782 . . . . 65.200000000000003 109.263 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . 0.941 HD13 ' HB2' ' A' ' 94' ' ' LEU . 40.9 pt -101.22 167.33 2.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.426 1.079 . . . . 50.409999999999997 109.31 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.802 ' CD1' HD23 ' A' ' 84' ' ' LEU . 2.7 t80 -66.88 -19.24 65.7 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.481 1.113 . . . . 55.539999999999999 111.0 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -90.69 -6.64 54.23 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.552 1.157 . . . . 73.109999999999999 109.324 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.544 ' O ' HD11 ' A' ' 110' ' ' ILE . 12.2 mm-40 -110.64 -5.91 14.95 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.495 1.122 . . . . 72.299999999999997 110.3 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 10.8 ttm -61.4 110.94 3.54 Favored Pre-proline 0 C--N 1.325 -0.457 0 O-C-N 124.456 1.097 . . . . 74.430000000000007 110.958 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 C--N 1.359 1.128 0 O-C-N 124.497 1.788 . . . . 51.039999999999999 111.0 179.958 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.591 ' CD1' HD23 ' A' ' 157' ' ' LEU . 4.2 pp . . . . . 0 N--CA 1.453 -0.313 0 N-CA-C 109.303 -0.628 . . . . 73.340000000000003 109.303 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.44 ' O ' ' N ' ' A' ' 129' ' ' VAL . 11.9 p-10 -63.85 -42.34 97.61 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.494 1.121 . . . . 70.030000000000001 109.313 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -48.98 -32.92 9.98 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.509 1.131 . . . . 74.040000000000006 109.307 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 1.047 ' HB1' HG11 ' A' ' 82' ' ' VAL . . . -68.44 -36.2 78.7 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.522 1.138 . . . . 72.319999999999993 109.311 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.673 HG12 ' O ' ' A' ' 129' ' ' VAL . 53.9 t -89.12 14.2 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.478 1.111 . . . . 63.100000000000001 109.29 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -129.27 120.84 26.39 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.544 1.153 . . . . 71.150000000000006 109.265 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 88.2 -20.12 31.41 Favored Glycine 0 CA--C 1.53 0.973 0 O-C-N 124.506 1.129 . . . . 35.100000000000001 110.994 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 39.2 m -87.95 151.67 22.63 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.522 0.777 . . . . 62.43 110.027 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.785 ' HB3' ' O ' ' A' ' 80' ' ' LYS . . . -94.44 -9.69 34.76 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.454 1.096 . . . . 71.219999999999999 109.308 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.597 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 9.7 m-90 -161.91 173.7 14.14 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.524 1.14 . . . . 73.420000000000002 107.981 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . 0.946 HG22 HG12 ' A' ' 82' ' ' VAL . 11.8 p -153.29 131.26 11.76 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 124.528 1.143 . . . . 61.409999999999997 110.436 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.763 ' C ' HD23 ' A' ' 137' ' ' LEU . 21.5 mm -93.21 134.62 30.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 124.552 1.158 . . . . 64.010000000000005 109.292 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.884 ' O ' HD22 ' A' ' 139' ' ' LEU . 5.2 mt -113.64 85.49 2.21 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.499 1.124 . . . . 72.040000000000006 109.263 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.777 HD22 ' HB2' ' A' ' 93' ' ' ALA . 1.8 tp -62.65 90.14 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.575 1.172 . . . . 64.310000000000002 109.33 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.884 HD22 ' O ' ' A' ' 137' ' ' LEU . 0.7 OUTLIER -70.44 116.69 11.06 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.541 1.15 . . . . 34.299999999999997 109.272 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . 0.421 ' HB ' ' CB ' ' A' ' 143' ' ' PHE . 6.8 m -139.22 157.87 45.17 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.43 1.082 . . . . 60.100000000000001 110.352 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -50.24 -40.96 49.23 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.477 1.111 . . . . 62.200000000000003 110.271 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -89.27 -52.18 5.19 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.509 1.13 . . . . 73.150000000000006 109.337 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 1.007 ' CE1' HG21 ' A' ' 147' ' ' THR . 29.0 t80 -52.18 -20.16 2.42 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.483 1.114 . . . . 72.120000000000005 111.018 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.695 ' C ' HD13 ' A' ' 144' ' ' LEU . 1.9 tm? -72.14 -67.54 0.53 Allowed 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.518 1.136 . . . . 75.239999999999995 109.282 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.445 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 25.4 mmm180 -52.75 -23.1 6.11 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.59 1.181 . . . . 70.349999999999994 110.302 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -75.69 -73.11 0.28 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.521 1.138 . . . . 64.540000000000006 109.265 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 1.007 HG21 ' CE1' ' A' ' 143' ' ' PHE . 47.2 p -57.42 -56.18 25.24 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.428 1.08 . . . . 64.140000000000001 110.403 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.494 ' CH2' ' HB3' ' A' ' 186' ' ' PRO . 4.6 t-105 -43.9 -42.2 5.67 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.558 1.161 . . . . 73.409999999999997 108.01 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' CYS . . . . . 0.445 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 12.6 t -67.88 -45.4 74.58 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.486 1.116 . . . . 44.240000000000002 108.279 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' ASN . . . . . 0.454 ' N ' ' O ' ' A' ' 147' ' ' THR . 34.2 m-20 -52.23 -61.96 1.94 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.5 1.125 . . . . 70.430000000000007 109.309 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.869 ' CE1' HD12 ' A' ' 157' ' ' LEU . 9.8 m-30 -38.46 -45.88 1.09 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.437 1.086 . . . . 63.340000000000003 110.971 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.27 -48.84 45.66 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.544 1.153 . . . . 65.420000000000002 110.31 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -88.06 -11.72 46.34 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.538 1.148 . . . . 73.530000000000001 111.041 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.4 ' N ' ' O ' ' A' ' 150' ' ' ASN . 3.2 m-30 -116.67 77.36 1.1 Allowed 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.437 1.086 . . . . 74.439999999999998 110.995 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.444 ' O ' ' ND2' ' A' ' 159' ' ' ASN . 1.1 t -61.82 -13.41 23.71 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.538 1.149 . . . . 64.329999999999998 110.448 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 13.1 m -71.53 -32.26 67.96 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.461 1.1 . . . . 74.340000000000003 110.017 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.869 HD12 ' CE1' ' A' ' 151' ' ' PHE . 0.4 OUTLIER -74.1 -47.21 37.86 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.566 1.166 . . . . 53.009999999999998 109.322 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' MET . . . . . 0.623 ' CE ' HG21 ' A' ' 161' ' ' VAL . 1.9 tpt -48.76 -23.01 0.91 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.485 1.115 . . . . 71.420000000000002 111.083 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' ASN . . . . . 0.528 ' N ' HD22 ' A' ' 159' ' ' ASN . 1.5 m-80 -77.84 -42.79 32.41 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.528 1.143 . . . . 71.25 109.271 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' SER . . . . . 0.542 ' CB ' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -63.16 -22.79 67.1 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.484 1.115 . . . . 74.030000000000001 110.011 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . 0.623 HG21 ' CE ' ' A' ' 158' ' ' MET . 41.9 t -57.41 -17.87 7.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.489 1.118 . . . . 70.109999999999999 109.315 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -90.96 21.5 4.16 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.621 1.201 . . . . 73.430000000000007 109.288 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.483 ' CD ' ' O ' ' A' ' 170' ' ' VAL . 0.0 OUTLIER 46.6 37.12 4.16 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.5 1.125 . . . . 73.329999999999998 110.327 -179.94 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' A' ' 163' ' ' ARG . 5.0 mt-30 -38.3 131.31 1.19 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.483 1.114 . . . . 73.230000000000004 110.295 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 12.6 m170 -90.1 57.4 3.76 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.518 1.136 . . . . 75.510000000000005 109.587 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.608 ' HA ' HG21 ' A' ' 221' ' ' ILE . 0.0 OUTLIER -118.25 89.7 3.18 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.534 1.146 . . . . 64.329999999999998 109.24 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 167' ' ' TYR . . . . . 0.603 ' CD1' ' O ' ' A' ' 166' ' ' LYS . 12.7 p90 36.61 32.98 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.571 1.17 . . . . 75.200000000000003 111.047 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . 0.439 ' ND2' ' O ' ' A' ' 129' ' ' VAL . 27.0 p30 178.48 156.97 0.45 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.548 1.155 . . . . 75.019999999999996 109.277 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.576 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 0.4 OUTLIER -140.05 176.99 8.29 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.494 1.121 . . . . 42.030000000000001 109.969 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.902 ' O ' HD12 ' A' ' 171' ' ' ILE . 65.3 t -131.34 120.57 46.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.563 1.164 . . . . 71.439999999999998 109.272 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.902 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.3 mp -136.37 105.42 9.31 Favored Pre-proline 0 C--N 1.325 -0.468 0 O-C-N 124.497 1.123 . . . . 70.420000000000002 109.359 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . 0.674 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.5 Cg_endo -74.95 112.96 3.68 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.507 1.793 . . . . 44.439999999999998 111.041 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . 0.805 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.7 ttt -89.16 160.67 16.87 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.576 1.173 . . . . 64.219999999999999 110.96 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . 0.423 ' N ' ' HG2' ' A' ' 173' ' ' MET . 0.0 OUTLIER -123.48 119.05 27.35 Favored Pre-proline 0 C--N 1.325 -0.48 0 O-C-N 124.531 1.144 . . . . 73.049999999999997 110.296 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 175' ' ' PRO . . . . . 0.636 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -75.05 155.05 42.68 Favored 'Trans proline' 0 C--N 1.36 1.142 0 O-C-N 124.5 1.79 . . . . 71.109999999999999 110.983 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . 1.018 HD21 ' CG ' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -98.18 -36.87 9.91 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.584 1.177 . . . . 75.120000000000005 109.319 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . 0.547 HD22 ' N ' ' A' ' 177' ' ' ASN . 1.1 m-80 -72.68 -23.02 60.83 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.504 1.127 . . . . 53.200000000000003 109.278 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -110.35 113.09 56.61 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.409 1.068 . . . . 71.099999999999994 109.292 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.05 115.02 4.16 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.536 1.808 . . . . 62.020000000000003 110.958 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.539 HD13 ' HB2' ' A' ' 184' ' ' ARG . 0.8 OUTLIER -132.86 96.62 17.88 Favored Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.537 1.148 . . . . 61.399999999999999 109.342 179.939 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 181' ' ' PRO . . . . . 0.424 ' HG2' ' CG ' ' A' ' 183' ' ' GLU . 18.3 Cg_endo -74.98 164.21 33.83 Favored 'Trans proline' 0 C--N 1.361 1.203 0 O-C-N 124.455 1.766 . . . . 52.219999999999999 111.025 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . 0.424 ' HG3' ' N ' ' A' ' 183' ' ' GLU . 0.7 OUTLIER -51.88 -35.16 44.16 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.446 1.091 . . . . 73.099999999999994 110.329 -179.985 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . 0.424 ' CG ' ' HG2' ' A' ' 181' ' ' PRO . 4.7 pt-20 -56.8 -32.01 65.25 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.54 1.15 . . . . 55.140000000000001 110.324 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 184' ' ' ARG . . . . . 0.539 ' HB2' HD13 ' A' ' 180' ' ' LEU . 5.7 mmp_? -87.96 -28.6 21.37 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.476 1.11 . . . . 75.519999999999996 110.236 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 185' ' ' THR . . . . . 0.494 HG22 ' HD2' ' A' ' 186' ' ' PRO . 21.2 m -77.27 144.03 70.3 Favored Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.477 1.111 . . . . 73.129999999999995 110.454 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 186' ' ' PRO . . . . . 0.701 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -74.93 152.33 41.0 Favored 'Trans proline' 0 C--N 1.36 1.167 0 O-C-N 124.508 1.793 . . . . 64.200000000000003 111.02 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 187' ' ' PHE . . . . . 0.483 ' O ' ' CG2' ' A' ' 191' ' ' THR . 13.2 p90 -68.22 -6.79 25.48 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.517 1.135 . . . . 72.409999999999997 111.0 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.75 -53.84 3.86 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.528 1.143 . . . . 63.420000000000002 109.267 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.701 HD12 ' CG ' ' A' ' 186' ' ' PRO . 49.3 mt -68.5 -42.21 78.91 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.455 1.097 . . . . 74.010000000000005 109.306 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 190' ' ' GLN . . . . . 0.402 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.1 pt20 -63.31 -11.5 22.52 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.5 1.125 . . . . 72.239999999999995 110.293 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 191' ' ' THR . . . . . 0.483 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 32.5 p -112.67 2.4 16.1 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.49 1.118 . . . . 74.120000000000005 110.353 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.49 ' CG2' ' N ' ' A' ' 193' ' ' ASN . 30.9 mt -105.31 163.36 4.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.461 1.101 . . . . 72.340000000000003 109.36 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 193' ' ' ASN . . . . . 0.49 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 22.7 p30 -66.8 74.78 0.11 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.507 1.129 . . . . 74.010000000000005 109.301 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . 0.674 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -70.04 156.36 39.27 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.557 1.16 . . . . 52.530000000000001 109.342 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 195' ' ' LEU . . . . . 0.725 HD23 ' CD1' ' A' ' 209' ' ' ILE . 0.3 OUTLIER -95.83 127.58 41.98 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.474 1.109 . . . . 72.310000000000002 109.256 -179.967 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . 0.402 ' HB3' ' CB ' ' A' ' 199' ' ' SER . 45.3 mt-10 -108.42 130.42 55.24 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.543 1.152 . . . . 73.019999999999996 110.292 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 1.018 ' CG ' HD21 ' A' ' 176' ' ' LEU . 25.2 tp10 -100.53 -23.14 14.77 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.509 1.131 . . . . 72.519999999999996 110.305 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . 0.508 ' HB3' HD12 ' A' ' 176' ' ' LEU . 0.4 OUTLIER -104.95 15.33 27.91 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.527 1.142 . . . . 64.239999999999995 110.292 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . 0.402 ' CB ' ' HB3' ' A' ' 196' ' ' GLU . 40.2 t -104.54 139.78 38.94 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.437 1.086 . . . . 73.219999999999999 110.023 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 21.5 ttp180 -59.47 -15.34 16.86 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.538 1.149 . . . . 75.319999999999993 110.315 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -102.89 17.61 52.15 Favored Glycine 0 CA--C 1.531 1.047 0 O-C-N 124.543 1.152 . . . . 44.219999999999999 110.928 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 202' ' ' PHE . . . . . 0.8 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.1 OUTLIER -54.16 -44.49 98.58 Favored Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.535 0.785 . . . . 65.209999999999994 111.019 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 203' ' ' PRO . . . . . 0.601 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.2 Cg_endo -74.99 -34.98 3.42 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.542 1.811 . . . . 75.209999999999994 110.994 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.98 -51.03 70.86 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.538 1.149 . . . . 53.140000000000001 110.411 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 205' ' ' GLN . . . . . 0.401 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 6.2 mt-30 -69.53 -33.04 72.23 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.495 1.122 . . . . 71.510000000000005 110.3 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 206' ' ' VAL . . . . . 0.911 HG11 ' CE1' ' A' ' 104' ' ' PHE . 50.5 t -70.28 -29.68 40.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.564 1.165 . . . . 61.119999999999997 109.287 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 207' ' ' GLU . . . . . 0.504 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 3.9 mt-10 -77.92 -36.67 49.16 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.544 1.152 . . . . 74.109999999999999 110.335 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -78.79 -62.93 1.54 Allowed 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.459 1.099 . . . . 72.239999999999995 110.279 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 209' ' ' ILE . . . . . 0.825 HG22 ' CD1' ' A' ' 210' ' ' PHE . 81.3 mt -47.83 -61.13 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.443 1.09 . . . . 73.439999999999998 109.325 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 210' ' ' PHE . . . . . 0.825 ' CD1' HG22 ' A' ' 209' ' ' ILE . 3.9 m-85 -97.42 67.36 2.09 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.519 1.137 . . . . 75.340000000000003 111.012 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 211' ' ' GLN . . . . . 0.504 ' CB ' ' O ' ' A' ' 207' ' ' GLU . 0.0 OUTLIER -110.98 141.09 44.92 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.502 1.126 . . . . 71.129999999999995 110.372 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . 0.454 ' O ' ' N ' ' A' ' 215' ' ' TYR . 25.6 tt0 -51.97 -51.52 56.63 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.528 1.142 . . . . 71.530000000000001 110.255 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.42 -23.16 0.85 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.443 1.09 . . . . 64.120000000000005 109.943 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.432 HG23 ' HG2' ' A' ' 211' ' ' GLN . 17.4 t -95.47 -30.19 4.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 O-C-N 124.603 1.189 . . . . 73.030000000000001 109.301 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 215' ' ' TYR . . . . . 0.454 ' N ' ' O ' ' A' ' 212' ' ' GLU . 13.7 t80 -64.64 -20.37 66.25 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.586 1.178 . . . . 74.319999999999993 111.025 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 4.8 mmpt? -69.37 -54.88 12.27 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.468 1.105 . . . . 72.299999999999997 109.305 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 217' ' ' THR . . . . . 0.796 HG22 HD11 ' A' ' 221' ' ' ILE . 2.2 m -49.13 -67.52 0.26 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.506 1.129 . . . . 74.239999999999995 110.409 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 218' ' ' GLN . . . . . 0.947 ' HA ' HD12 ' A' ' 221' ' ' ILE . 0.0 OUTLIER -50.32 -43.64 53.86 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.493 1.12 . . . . 75.340000000000003 110.252 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 219' ' ' GLN . . . . . 0.402 ' CB ' ' O ' ' A' ' 215' ' ' TYR . 38.2 tp60 -52.3 -37.87 56.92 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.505 1.128 . . . . 73.409999999999997 110.284 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 22.7 m -79.6 -35.17 40.0 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.429 1.081 . . . . 73.040000000000006 110.381 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 221' ' ' ILE . . . . . 0.947 HD12 ' HA ' ' A' ' 218' ' ' GLN . 10.9 mt -66.03 -27.24 40.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 O-C-N 124.443 1.09 . . . . 71.209999999999994 109.32 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 222' ' ' TRP . . . . . 0.444 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 24.1 t90 -89.11 -49.18 6.9 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.498 1.124 . . . . 54.43 107.991 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.462 ' CD ' ' C ' ' A' ' 223' ' ' LYS . 0.0 OUTLIER -60.47 -16.77 39.91 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.532 1.145 . . . . 73.0 109.283 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 . . . . . 0 C--N 1.324 -0.504 0 O-C-N 124.554 1.159 . . . . 61.130000000000003 110.309 -179.996 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.427 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 5.3 p . . . . . 0 N--CA 1.454 -0.249 0 N-CA-C 109.303 -0.628 . . . . 74.420000000000002 109.303 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.49 ' CE2' ' OH ' ' A' ' 215' ' ' TYR . 5.6 t80 -88.68 24.82 1.89 Allowed 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.481 1.113 . . . . 74.299999999999997 111.004 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.407 ' C ' ' O ' ' A' ' 78' ' ' PHE . 3.2 tp -39.5 143.14 0.23 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.486 1.116 . . . . 74.409999999999997 109.269 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.6 ' O ' ' HB3' ' A' ' 133' ' ' ALA . 8.2 ttmt -79.03 -62.3 1.74 Allowed 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.522 1.139 . . . . 62.43 109.249 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.944 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.3 OUTLIER -165.47 140.09 4.87 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.563 1.164 . . . . 75.140000000000001 110.979 179.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.94 ' CG1' HG22 ' A' ' 135' ' ' THR . 7.5 p -90.69 167.49 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 O-C-N 124.428 1.08 . . . . 65.219999999999999 109.313 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.944 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 3.8 mp -132.64 92.0 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.47 1.106 . . . . 72.030000000000001 109.33 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.735 HD21 ' HB3' ' A' ' 128' ' ' ALA . 5.9 mp -70.16 113.22 7.13 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.454 1.096 . . . . 71.409999999999997 109.304 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.619 ' CB ' HD22 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -128.44 174.39 9.39 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.465 1.103 . . . . 73.219999999999999 109.661 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -113.24 162.47 15.98 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.538 1.149 . . . . 55.25 109.309 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -64.31 -11.33 31.02 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.541 1.151 . . . . 61.009999999999998 110.374 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -81.68 -45.95 15.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.482 1.114 . . . . 74.439999999999998 109.284 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.416 ' CG ' HD23 ' A' ' 138' ' ' LEU . 0.8 OUTLIER -124.58 44.21 2.82 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.441 1.088 . . . . 64.019999999999996 109.265 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.607 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -75.54 -33.89 60.71 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.456 1.098 . . . . 72.340000000000003 110.383 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -79.01 -17.21 55.75 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.537 1.148 . . . . 73.099999999999994 109.354 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -79.39 -54.04 6.32 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.548 1.155 . . . . 72.400000000000006 110.302 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.872 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -65.16 -19.75 66.12 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.473 1.108 . . . . 73.409999999999997 109.251 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.936 ' HB2' HD13 ' A' ' 111' ' ' ILE . 0.1 OUTLIER -87.96 -51.89 5.57 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.573 1.17 . . . . 64.409999999999997 109.264 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.568 ' N ' HD13 ' A' ' 94' ' ' LEU . 10.7 tpt180 -45.27 -33.32 2.33 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.514 1.133 . . . . 72.519999999999996 110.334 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.582 HG13 ' N ' ' A' ' 97' ' ' GLN . 10.7 p -82.77 -55.89 6.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.516 1.135 . . . . 72.219999999999999 109.295 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.582 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -48.24 -22.12 0.61 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.466 1.104 . . . . 73.230000000000004 110.339 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -77.21 -38.61 51.03 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.466 1.104 . . . . 73.5 109.334 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.783 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -83.08 -21.99 33.57 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.473 1.108 . . . . 72.519999999999996 109.263 -179.98 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.783 ' N ' HD23 ' A' ' 99' ' ' LEU . 71.9 mt -63.44 -51.51 65.37 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.529 1.143 . . . . 55.450000000000003 109.276 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -77.5 54.79 1.21 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.487 1.117 . . . . 64.129999999999995 110.306 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -176.3 -67.05 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.482 1.114 . . . . 70.040000000000006 109.321 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -43.57 -54.09 5.17 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.462 1.101 . . . . 51.310000000000002 109.276 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.418 ' CZ ' ' HB3' ' A' ' 203' ' ' PRO . 6.4 m-85 -107.96 -31.2 8.08 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.507 1.13 . . . . 71.430000000000007 110.992 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 104.78 41.98 1.9 Allowed Glycine 0 CA--C 1.531 1.048 0 O-C-N 124.482 1.114 . . . . 71.239999999999995 110.996 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.1 mm -82.97 79.69 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.555 0.797 . . . . 74.040000000000006 109.295 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.538 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -131.76 156.39 80.18 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.522 1.139 . . . . 73.310000000000002 109.321 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.538 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.0 160.1 97.05 Favored 'Cis proline' 0 C--N 1.36 1.168 0 C-N-CA 120.981 -2.508 . . . . 71.209999999999994 110.994 -0.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -122.7 141.48 14.03 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.466 1.104 . . . . 60.229999999999997 111.046 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -158.72 130.16 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.5 0.765 . . . . 53.340000000000003 109.275 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . 0.936 HD13 ' HB2' ' A' ' 94' ' ' LEU . 1.9 pt -96.67 156.88 3.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.571 1.169 . . . . 73.450000000000003 109.291 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.685 ' HE1' ' HB2' ' A' ' 128' ' ' ALA . 1.5 t80 -54.65 -19.17 5.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.491 1.12 . . . . 43.43 110.998 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.856 ' HB3' HD12 ' A' ' 111' ' ' ILE . . . -76.26 -51.58 11.74 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.541 1.15 . . . . 52.420000000000002 109.356 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -71.02 -25.93 62.89 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.425 1.078 . . . . 73.140000000000001 110.319 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.43 ' HE1' ' CG2' ' A' ' 82' ' ' VAL . 34.8 tpp -38.12 111.03 0.57 Allowed Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.508 1.13 . . . . 73.140000000000001 110.974 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 C--N 1.36 1.157 0 O-C-N 124.483 1.781 . . . . 64.519999999999996 111.048 179.933 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.643 HD11 ' HE1' ' A' ' 151' ' ' PHE . 1.1 pt? . . . . . 0 N--CA 1.453 -0.276 0 N-CA-C 109.242 -0.651 . . . . 63.240000000000002 109.242 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.9 -40.06 72.49 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.55 1.157 . . . . 73.209999999999994 109.265 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -43.9 -54.53 5.24 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.548 1.155 . . . . 75.400000000000006 109.302 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.735 ' HB3' HD21 ' A' ' 84' ' ' LEU . . . -60.5 -36.03 77.37 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.53 1.144 . . . . 63.219999999999999 109.293 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.822 HG21 HD21 ' A' ' 157' ' ' LEU . 3.4 t -73.31 -5.5 6.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.526 1.141 . . . . 73.310000000000002 109.276 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -109.59 119.81 40.55 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.473 1.108 . . . . 72.420000000000002 109.268 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 78.77 63.49 2.09 Favored Glycine 0 CA--C 1.529 0.951 0 O-C-N 124.436 1.085 . . . . 63.25 111.033 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 50.9 p -163.52 155.94 17.94 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.45 0.735 . . . . 42.229999999999997 110.073 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.6 ' HB3' ' O ' ' A' ' 80' ' ' LYS . . . -94.92 -22.31 18.07 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.497 1.123 . . . . 73.150000000000006 109.336 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.583 ' CZ2' ' HA ' ' A' ' 210' ' ' PHE . 16.1 m-90 -161.07 154.87 22.27 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.492 1.12 . . . . 71.530000000000001 108.041 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . 0.94 HG22 ' CG1' ' A' ' 82' ' ' VAL . 1.8 p -140.55 122.3 15.36 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.551 1.157 . . . . 72.219999999999999 110.391 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.754 ' O ' HD23 ' A' ' 137' ' ' LEU . 0.9 OUTLIER -84.08 142.09 13.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.542 1.151 . . . . 74.239999999999995 109.23 -179.936 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.754 HD23 ' O ' ' A' ' 136' ' ' ILE . 47.7 mt -130.06 98.88 4.88 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.535 1.147 . . . . 72.129999999999995 109.378 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.872 HD21 ' HB2' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.46 102.23 0.3 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.571 1.169 . . . . 50.329999999999998 109.307 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.955 HD11 HD13 ' A' ' 189' ' ' LEU . 0.2 OUTLIER -68.56 99.13 0.94 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.474 1.109 . . . . 75.510000000000005 109.269 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . 0.447 ' O ' ' N ' ' A' ' 144' ' ' LEU . 2.4 m -125.34 141.55 52.01 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.582 1.176 . . . . 74.140000000000001 110.394 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . 0.441 ' HB3' ' CD2' ' A' ' 180' ' ' LEU . 0.1 OUTLIER -47.41 -46.18 26.11 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.512 1.132 . . . . 73.329999999999998 110.307 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . 0.453 ' OD1' ' N ' ' A' ' 143' ' ' PHE . 11.2 p30 -73.04 -47.57 43.6 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.562 1.164 . . . . 71.430000000000007 109.331 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.976 ' CE2' HG21 ' A' ' 147' ' ' THR . 76.9 t80 -60.24 -19.37 54.26 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.44 1.087 . . . . 72.109999999999999 110.997 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.723 HD13 ' C ' ' A' ' 144' ' ' LEU . 2.0 tm? -66.83 -67.54 0.44 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.515 1.134 . . . . 73.349999999999994 109.319 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.447 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 30.3 mmt180 -50.95 -21.51 1.78 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.534 1.146 . . . . 75.420000000000002 110.276 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 92.7 m-20 -78.36 -72.33 0.38 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.442 1.089 . . . . 71.400000000000006 109.283 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.976 HG21 ' CE2' ' A' ' 143' ' ' PHE . 20.6 p -58.64 -56.0 27.76 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.489 1.118 . . . . 72.420000000000002 110.394 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.407 ' CE3' ' HA ' ' A' ' 148' ' ' TRP . 2.1 t-105 -43.48 -56.65 3.51 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.98 -1.119 . . . . 75.010000000000005 107.98 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' CYS . . . . . 0.447 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 42.6 t -58.86 -37.88 77.51 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.446 1.091 . . . . 74.129999999999995 108.261 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' ASN . . . . . 0.457 ' HA ' ' CE2' ' A' ' 153' ' ' PHE . 14.5 t-20 -63.5 -27.6 69.38 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.47 1.106 . . . . 72.450000000000003 109.3 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.853 ' CZ ' HD12 ' A' ' 157' ' ' LEU . 10.1 m-30 -87.15 -13.3 44.46 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.452 1.095 . . . . 72.409999999999997 110.978 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -75.46 -35.76 60.83 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.541 1.151 . . . . 61.200000000000003 110.293 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.594 ' C ' ' CD1' ' A' ' 153' ' ' PHE . 0.8 OUTLIER -94.08 -21.4 19.15 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.489 1.118 . . . . 74.099999999999994 111.017 -179.989 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.557 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 1.0 OUTLIER -115.24 109.74 18.41 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.519 1.137 . . . . 63.229999999999997 111.043 -179.974 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.44 ' O ' ' ND2' ' A' ' 159' ' ' ASN . 1.2 t -85.81 -5.98 59.17 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.573 1.17 . . . . 72.450000000000003 110.369 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 1.6 t -72.52 -31.89 65.69 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.543 1.152 . . . . 45.130000000000003 110.051 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.853 HD12 ' CZ ' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -85.46 -25.87 26.65 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.471 1.107 . . . . 72.239999999999995 109.291 179.984 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' MET . . . . . 0.701 ' HA ' ' HE2' ' A' ' 158' ' ' MET . 7.0 mmt -67.64 -25.61 65.82 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.445 1.091 . . . . 74.450000000000003 110.978 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' ASN . . . . . 0.647 HD22 ' N ' ' A' ' 159' ' ' ASN . 0.9 OUTLIER -78.08 -15.81 58.57 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.475 1.11 . . . . 73.430000000000007 109.354 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' SER . . . . . 0.94 ' OG ' HG21 ' A' ' 170' ' ' VAL . 0.5 OUTLIER -80.0 -43.08 22.61 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.521 1.138 . . . . 65.319999999999993 109.976 179.978 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . 0.686 HG22 ' O ' ' A' ' 158' ' ' MET . 35.5 m -61.02 -17.02 15.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 O-C-N 124.447 1.092 . . . . 75.549999999999997 109.258 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -76.04 -0.8 23.04 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.509 1.13 . . . . 64.519999999999996 109.323 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.488 ' NH2' ' H ' ' A' ' 170' ' ' VAL . 2.6 mmp_? 51.35 58.64 5.3 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.472 1.108 . . . . 71.230000000000004 110.32 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -78.62 -163.54 0.47 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.51 1.131 . . . . 73.299999999999997 110.353 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -112.17 54.48 0.7 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.476 1.11 . . . . 73.430000000000007 109.552 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.572 ' HG3' ' CD2' ' A' ' 167' ' ' TYR . 3.5 tptt -97.72 164.46 12.39 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.476 1.11 . . . . 63.539999999999999 109.309 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 167' ' ' TYR . . . . . 0.581 ' CD1' ' N ' ' A' ' 168' ' ' ASN . 40.0 p90 -58.09 -48.22 80.83 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.46 1.1 . . . . 74.200000000000003 110.983 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . 0.581 ' N ' ' CD1' ' A' ' 167' ' ' TYR . 7.8 p30 -79.86 134.88 36.34 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.519 1.137 . . . . 62.310000000000002 109.264 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.574 ' HB3' ' CD1' ' A' ' 134' ' ' TRP . 47.0 t -113.06 132.3 55.47 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.463 1.102 . . . . 73.530000000000001 109.992 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 1.015 ' O ' HD12 ' A' ' 171' ' ' ILE . 9.6 t -99.48 133.98 40.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.494 1.121 . . . . 63.439999999999998 109.272 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 1.015 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.2 mp -140.52 108.05 6.61 Favored Pre-proline 0 C--N 1.326 -0.44 0 O-C-N 124.389 1.056 . . . . 72.340000000000003 109.361 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . 0.715 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -74.99 106.57 2.3 Favored 'Trans proline' 0 C--N 1.359 1.097 0 O-C-N 124.537 1.809 . . . . 74.209999999999994 111.012 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . 0.43 ' HG2' ' N ' ' A' ' 174' ' ' ARG . 6.7 ttt -89.21 156.41 18.79 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.579 1.175 . . . . 60.109999999999999 110.983 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . 0.43 ' N ' ' HG2' ' A' ' 173' ' ' MET . 8.7 mmm-85 -114.94 121.62 35.02 Favored Pre-proline 0 C--N 1.324 -0.506 0 O-C-N 124.47 1.106 . . . . 73.239999999999995 110.284 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 175' ' ' PRO . . . . . 0.746 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -75.01 159.94 40.71 Favored 'Trans proline' 0 C--N 1.359 1.114 0 O-C-N 124.516 1.798 . . . . 61.439999999999998 110.975 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . 0.958 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -104.21 -40.17 6.24 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.523 1.139 . . . . 73.120000000000005 109.278 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . 0.414 HD22 ' N ' ' A' ' 177' ' ' ASN . 1.3 m-80 -72.89 -23.76 60.76 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.543 1.152 . . . . 75.099999999999994 109.311 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -110.19 105.91 57.59 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.503 1.127 . . . . 75.109999999999999 109.34 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.92 115.67 4.36 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.466 1.772 . . . . 74.019999999999996 111.049 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.639 HD21 ' CB ' ' A' ' 184' ' ' ARG . 2.1 tm? -139.12 101.67 7.61 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.432 1.083 . . . . 72.209999999999994 109.342 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.99 171.79 17.64 Favored 'Trans proline' 0 C--N 1.362 1.245 0 O-C-N 124.441 1.759 . . . . 73.230000000000004 110.993 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 3.5 ptp85 -59.53 -32.17 70.08 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.505 1.128 . . . . 64.219999999999999 110.299 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -48.47 -31.82 6.92 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.523 1.14 . . . . 51.549999999999997 110.279 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 184' ' ' ARG . . . . . 0.639 ' CB ' HD21 ' A' ' 180' ' ' LEU . 39.6 mmt180 -96.11 -22.38 17.36 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.507 1.129 . . . . 61.229999999999997 110.292 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 185' ' ' THR . . . . . 0.578 HG23 HD23 ' A' ' 139' ' ' LEU . 12.1 m -77.44 144.35 70.09 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.492 1.12 . . . . 51.219999999999999 110.424 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 186' ' ' PRO . . . . . 0.796 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.2 Cg_endo -74.97 164.6 33.07 Favored 'Trans proline' 0 C--N 1.36 1.155 0 O-C-N 124.404 1.739 . . . . 60.240000000000002 110.989 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 187' ' ' PHE . . . . . 0.466 ' O ' ' CG2' ' A' ' 191' ' ' THR . 32.2 p90 -77.35 -6.92 55.07 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.596 1.185 . . . . 75.329999999999998 111.028 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . 0.566 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -95.33 -51.29 4.65 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.434 1.084 . . . . 71.400000000000006 109.279 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.955 HD13 HD11 ' A' ' 139' ' ' LEU . 49.4 mt -68.39 -42.66 78.77 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.502 1.126 . . . . 63.329999999999998 109.257 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 190' ' ' GLN . . . . . 0.439 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 2.0 pt20 -65.2 -9.68 25.4 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.505 1.128 . . . . 74.129999999999995 110.262 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 191' ' ' THR . . . . . 0.466 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 80.8 p -120.84 24.55 10.17 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.491 1.119 . . . . 73.319999999999993 110.403 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.566 HD12 ' O ' ' A' ' 188' ' ' ALA . 7.8 mt -123.41 163.32 22.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.499 1.125 . . . . 73.329999999999998 109.315 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 193' ' ' ASN . . . . . 0.496 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 2.4 m-20 -66.71 74.22 0.1 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.558 1.161 . . . . 70.439999999999998 109.284 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . 0.715 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -71.04 162.3 29.66 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.452 1.095 . . . . 73.549999999999997 109.3 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 195' ' ' LEU . . . . . 0.754 HD23 HD12 ' A' ' 209' ' ' ILE . 0.3 OUTLIER -106.72 149.32 27.41 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.478 1.111 . . . . 72.450000000000003 109.288 -179.967 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . 0.415 ' N ' HD13 ' A' ' 195' ' ' LEU . 6.8 mm-40 -142.94 142.07 31.59 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.477 1.111 . . . . 53.43 110.335 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.958 ' HG3' HD21 ' A' ' 176' ' ' LEU . 3.4 pm0 -113.62 -28.67 7.4 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.464 1.103 . . . . 72.230000000000004 110.233 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . 0.493 ' HG2' HD12 ' A' ' 176' ' ' LEU . 1.5 pp20? -77.39 0.7 21.47 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.488 1.118 . . . . 60.340000000000003 110.334 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 6.9 t -104.28 161.33 14.14 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.49 1.119 . . . . 71.219999999999999 110.042 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 22.0 ttt-85 -77.55 -26.14 50.7 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.458 1.099 . . . . 72.0 110.274 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -88.73 21.99 23.67 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.554 1.159 . . . . 42.030000000000001 110.98 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 202' ' ' PHE . . . . . 0.848 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.3 OUTLIER -61.18 -41.96 83.35 Favored Pre-proline 0 C--N 1.326 -0.438 0 O-C-N 124.458 0.74 . . . . 73.340000000000003 110.981 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 203' ' ' PRO . . . . . 0.646 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.6 Cg_endo -74.94 -37.43 2.08 Favored 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.494 1.786 . . . . 44.340000000000003 111.049 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.36 -50.98 61.3 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.558 1.161 . . . . 71.329999999999998 110.406 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 205' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 3.0 mt-30 -71.05 -40.15 71.83 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.559 1.162 . . . . 74.549999999999997 110.326 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 206' ' ' VAL . . . . . 0.848 HG23 ' O ' ' A' ' 202' ' ' PHE . 57.1 t -62.82 -26.64 41.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 O-C-N 124.586 1.179 . . . . 75.150000000000006 109.261 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -81.01 -49.93 10.32 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.482 1.114 . . . . 64.319999999999993 110.345 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 83.7 mtt-85 -67.46 -62.75 1.27 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.57 1.169 . . . . 71.530000000000001 110.293 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 209' ' ' ILE . . . . . 0.754 HD12 HD23 ' A' ' 195' ' ' LEU . 96.5 mt -45.61 -50.0 3.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.554 1.159 . . . . 71.140000000000001 109.325 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 210' ' ' PHE . . . . . 0.751 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.5 m-85 -105.83 67.39 0.75 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.524 1.14 . . . . 64.310000000000002 111.01 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 211' ' ' GLN . . . . . 0.548 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.3 OUTLIER -111.04 142.95 42.51 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.485 1.116 . . . . 72.230000000000004 110.324 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . 0.449 ' CG ' ' HE3' ' A' ' 216' ' ' LYS . 7.1 tt0 -49.06 -54.42 16.01 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.498 1.124 . . . . 65.120000000000005 110.324 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.01 -25.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.499 1.125 . . . . 51.299999999999997 109.993 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.548 HG23 ' HG2' ' A' ' 211' ' ' GLN . 42.5 t -96.1 -28.45 3.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.487 1.117 . . . . 72.299999999999997 109.279 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 215' ' ' TYR . . . . . 0.49 ' OH ' ' CE2' ' A' ' 78' ' ' PHE . 32.0 t80 -64.69 -30.77 71.79 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.522 1.139 . . . . 74.120000000000005 111.051 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . 0.449 ' HE3' ' CG ' ' A' ' 212' ' ' GLU . 12.7 mttp -63.11 -66.32 0.56 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.565 1.166 . . . . 73.420000000000002 109.323 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 217' ' ' THR . . . . . 0.713 HG22 HD11 ' A' ' 221' ' ' ILE . 86.9 m -41.01 -55.26 2.59 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.502 1.126 . . . . 74.450000000000003 110.362 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 218' ' ' GLN . . . . . 0.453 ' O ' ' N ' ' A' ' 221' ' ' ILE . 18.6 mm-40 -57.15 -67.2 0.34 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.496 1.122 . . . . 75.319999999999993 110.321 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 37.8 tp60 -44.05 -27.36 0.37 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.539 1.15 . . . . 73.219999999999999 110.385 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 4.4 m -81.2 -41.01 22.96 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.503 1.127 . . . . 74.120000000000005 110.392 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 221' ' ' ILE . . . . . 0.713 HD11 HG22 ' A' ' 217' ' ' THR . 14.5 mt -66.56 -31.26 52.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.439 1.087 . . . . 75.420000000000002 109.215 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 222' ' ' TRP . . . . . 0.427 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 28.9 t90 -69.57 -61.46 1.78 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.549 1.156 . . . . 74.5 107.968 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.05 -20.48 6.51 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.564 1.165 . . . . 70.120000000000005 109.275 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 . . . . . 0 C--N 1.325 -0.499 0 O-C-N 124.518 1.136 . . . . 73.510000000000005 110.344 179.94 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.54 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.7 p . . . . . 0 N--CA 1.453 -0.281 0 N-CA-C 109.288 -0.634 . . . . 73.510000000000005 109.288 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.451 ' N ' HG22 ' A' ' 77' ' ' VAL . 8.3 m-85 -88.84 25.21 1.83 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.494 1.121 . . . . 61.520000000000003 111.007 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.677 HD11 HG22 ' A' ' 110' ' ' ILE . 6.1 tp -40.07 158.51 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.553 1.158 . . . . 62.140000000000001 109.317 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.903 ' HZ3' ' HA ' ' A' ' 106' ' ' ILE . 11.4 ptmt -111.76 -47.68 3.13 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.458 1.099 . . . . 71.209999999999994 109.338 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 1.127 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.1 OUTLIER -166.48 151.3 7.84 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.567 1.167 . . . . 75.430000000000007 110.936 -179.972 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.535 HG22 ' N ' ' A' ' 83' ' ' ILE . 3.9 p -104.86 167.78 2.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.451 1.095 . . . . 45.549999999999997 109.347 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 1.127 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 2.3 mp -126.49 105.03 13.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 O-C-N 124.525 1.14 . . . . 63.310000000000002 109.412 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.525 HD23 ' HA ' ' A' ' 84' ' ' LEU . 5.3 mt -70.22 133.27 46.88 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.464 1.102 . . . . 50.219999999999999 109.259 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.68 ' CB ' HD22 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -156.61 174.45 15.43 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.519 1.137 . . . . 72.450000000000003 109.568 179.972 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.577 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -119.2 164.92 14.88 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.514 1.133 . . . . 41.539999999999999 109.307 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -54.46 -35.12 62.69 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 124.478 1.111 . . . . 73.310000000000002 110.267 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -69.28 -46.33 67.46 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.554 1.159 . . . . 65.409999999999997 109.281 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.726 ' HB3' HD23 ' A' ' 138' ' ' LEU . 2.1 m-20 -108.02 44.43 1.1 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.464 1.103 . . . . 72.349999999999994 109.33 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.587 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -80.42 -51.59 8.65 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.47 1.106 . . . . 70.030000000000001 110.39 -179.962 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.04 -32.88 74.59 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.479 1.112 . . . . 73.219999999999999 109.289 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.404 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 4.5 tp10 -58.61 -67.8 0.32 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.498 1.124 . . . . 71.409999999999997 110.288 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.652 ' HB1' ' CG2' ' A' ' 83' ' ' ILE . . . -47.71 -29.66 3.23 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.495 1.122 . . . . 72.310000000000002 109.302 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.496 ' HG ' HD13 ' A' ' 111' ' ' ILE . 1.2 tt -69.9 -49.62 50.4 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.506 1.128 . . . . 71.420000000000002 109.332 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -47.19 -33.15 5.03 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.474 1.109 . . . . 73.030000000000001 110.326 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.814 HG21 ' HE1' ' A' ' 173' ' ' MET . 1.8 t -79.31 -64.69 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.531 1.145 . . . . 73.549999999999997 109.224 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.607 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -45.08 -22.48 0.1 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.489 1.118 . . . . 74.120000000000005 110.353 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.435 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.0 OUTLIER -78.02 -59.91 2.59 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.541 1.151 . . . . 75.209999999999994 109.291 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.836 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -61.73 -21.55 64.61 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.509 1.131 . . . . 71.230000000000004 109.375 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.836 ' N ' HD23 ' A' ' 99' ' ' LEU . 22.6 mt -66.42 -52.61 44.73 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.521 1.138 . . . . 73.400000000000006 109.292 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . 0.408 ' O ' ' HG3' ' A' ' 101' ' ' GLN . 10.4 pt20 -81.0 49.86 1.3 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.485 1.116 . . . . 72.420000000000002 110.276 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -169.63 -65.79 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.498 1.124 . . . . 64.230000000000004 109.337 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -48.42 -48.13 37.38 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.455 1.097 . . . . 75.040000000000006 109.29 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -115.94 -29.8 6.24 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.596 1.185 . . . . 74.450000000000003 111.018 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.43 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 95.21 45.83 2.95 Favored Glycine 0 CA--C 1.53 1.012 0 O-C-N 124.517 1.136 . . . . 64.239999999999995 110.95 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.903 ' HA ' ' HZ3' ' A' ' 80' ' ' LYS . 10.0 mm -81.29 68.12 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.452 0.736 . . . . 75.340000000000003 109.326 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.524 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -118.42 155.46 51.96 Favored Pre-proline 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 64.019999999999996 109.327 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.524 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.96 154.43 99.69 Favored 'Cis proline' 0 C--N 1.359 1.117 0 C-N-CA 120.925 -2.531 . . . . 54.0 111.049 -0.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -135.2 142.99 14.49 Favored Glycine 0 CA--C 1.531 1.038 0 O-C-N 124.468 1.105 . . . . 43.539999999999999 110.957 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.677 HG22 HD11 ' A' ' 79' ' ' LEU . 3.3 tt -153.2 151.92 10.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.506 0.768 . . . . 75.409999999999997 109.269 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . 0.607 HG23 ' HG2' ' A' ' 97' ' ' GLN . 21.3 pt -95.73 -178.14 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.445 1.091 . . . . 74.409999999999997 109.293 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.45 ' HB3' ' CE1' ' A' ' 85' ' ' HIS . 8.0 t80 -82.07 -19.21 40.7 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.488 1.118 . . . . 64.140000000000001 111.059 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.45 -4.37 51.41 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.425 1.078 . . . . 63.039999999999999 109.251 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.43 ' O ' HD11 ' A' ' 110' ' ' ILE . 48.6 mm-40 -109.09 -12.22 14.85 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.502 1.126 . . . . 71.049999999999997 110.292 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.444 ' CG ' ' HD2' ' A' ' 116' ' ' PRO . 6.2 ttm -55.74 143.89 58.08 Favored Pre-proline 0 C--N 1.326 -0.439 0 O-C-N 124.465 1.103 . . . . 73.439999999999998 111.06 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.444 ' HD2' ' CG ' ' A' ' 115' ' ' MET . 18.2 Cg_endo . . . . . 0 C--N 1.36 1.159 0 O-C-N 124.498 1.788 . . . . 72.030000000000001 110.964 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.634 HD12 ' N ' ' A' ' 126' ' ' ASP . 2.4 pp . . . . . 0 N--CA 1.452 -0.335 0 N-CA-C 109.249 -0.648 . . . . 72.109999999999999 109.249 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.634 ' N ' HD12 ' A' ' 125' ' ' LEU . 7.4 t0 -62.81 -14.12 41.72 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 124.568 1.168 . . . . 74.099999999999994 109.295 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -55.54 -26.29 42.42 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.518 1.136 . . . . 73.209999999999994 109.366 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -93.91 -22.5 18.57 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.459 1.099 . . . . 72.230000000000004 109.324 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.568 ' O ' HG12 ' A' ' 129' ' ' VAL . 25.4 t -82.8 5.17 2.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.5 1.125 . . . . 63.520000000000003 109.259 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 -143.55 118.54 10.02 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.579 1.175 . . . . 74.219999999999999 109.293 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 102.1 42.19 2.29 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.478 1.111 . . . . 30.350000000000001 111.032 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . 0.462 ' CB ' ' HA ' ' A' ' 81' ' ' PHE . 0.2 OUTLIER -163.26 -177.03 5.11 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.513 0.772 . . . . 52.119999999999997 110.014 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.832 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -107.24 -25.86 11.31 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.536 1.148 . . . . 73.120000000000005 109.343 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.832 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 4.2 m-90 -159.66 172.9 16.91 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.487 1.117 . . . . 74.540000000000006 108.035 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . 0.491 ' O ' ' CD1' ' A' ' 137' ' ' LEU . 38.9 p -147.25 124.62 11.6 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.518 1.136 . . . . 61.5 110.421 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.764 HD13 HG13 ' A' ' 83' ' ' ILE . 1.1 mp -84.32 128.65 38.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.528 1.143 . . . . 65.310000000000002 109.353 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.717 HD12 ' C ' ' A' ' 136' ' ' ILE . 2.0 mp -110.96 101.69 10.23 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.508 1.13 . . . . 74.329999999999998 109.252 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.726 HD23 ' HB3' ' A' ' 89' ' ' ASP . 0.1 OUTLIER -62.02 89.87 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.43 1.081 . . . . 73.519999999999996 109.306 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.864 HD21 HG23 ' A' ' 185' ' ' THR . 5.2 tp -63.04 99.99 0.19 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.472 1.107 . . . . 72.329999999999998 109.27 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 18.9 m -131.11 154.11 48.65 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.542 1.151 . . . . 74.219999999999999 110.397 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -52.71 -34.32 51.81 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.54 1.15 . . . . 72.120000000000005 110.304 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -89.39 -53.06 4.72 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.541 1.151 . . . . 73.010000000000005 109.324 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.592 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 58.7 t80 -55.16 -19.8 8.69 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.442 1.089 . . . . 71.109999999999999 110.982 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.594 HD13 ' C ' ' A' ' 144' ' ' LEU . 3.0 tm? -63.08 -67.83 0.39 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.52 1.138 . . . . 64.150000000000006 109.3 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.454 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 0.2 OUTLIER -62.7 -15.03 50.87 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.521 1.138 . . . . 72.040000000000006 110.255 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -64.21 -60.65 2.95 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.551 1.157 . . . . 65.409999999999997 109.246 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.573 HG23 ' CZ ' ' A' ' 151' ' ' PHE . 1.0 OUTLIER -92.06 -47.03 7.48 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.523 1.139 . . . . 74.439999999999998 110.392 -179.946 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.502 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 30.2 t-105 -43.37 -35.72 1.65 Allowed 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.503 1.127 . . . . 73.0 108.017 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' CYS . . . . . 0.454 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 17.9 t -80.37 -45.01 18.45 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.479 1.112 . . . . 73.420000000000002 108.282 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' ASN . . . . . 0.427 ' N ' ' O ' ' A' ' 147' ' ' THR . 24.3 t-20 -60.7 -15.65 31.26 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.461 1.1 . . . . 50.240000000000002 109.317 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.698 ' CZ ' HD12 ' A' ' 157' ' ' LEU . 10.7 m-30 -82.41 -50.91 8.36 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.54 1.15 . . . . 75.209999999999994 110.951 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -46.26 -38.11 8.11 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.507 1.13 . . . . 72.049999999999997 110.385 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -77.66 -33.76 53.32 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.483 1.114 . . . . 72.400000000000006 110.957 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -116.41 91.32 3.55 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.468 1.105 . . . . 73.219999999999999 110.966 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.2 t -62.56 -13.03 26.52 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.5 1.125 . . . . 72.409999999999997 110.334 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 12.1 t -70.19 -18.64 63.19 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.461 1.1 . . . . 63.240000000000002 109.956 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.698 HD12 ' CZ ' ' A' ' 151' ' ' PHE . 0.2 OUTLIER -88.58 -36.02 16.57 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.523 1.139 . . . . 74.239999999999995 109.315 179.98 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' MET . . . . . 0.479 ' CE ' ' HA ' ' A' ' 158' ' ' MET . 2.2 mmt -68.67 -11.55 60.3 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.53 1.144 . . . . 65.049999999999997 110.989 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -77.58 -48.52 16.73 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.465 1.103 . . . . 75.329999999999998 109.317 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' SER . . . . . 0.471 ' HB3' ' CG2' ' A' ' 170' ' ' VAL . 0.4 OUTLIER -59.86 -24.88 64.59 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.495 1.122 . . . . 70.430000000000007 110.019 179.958 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . 0.832 ' O ' HD11 ' A' ' 192' ' ' ILE . 44.2 t -62.01 -18.03 18.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.513 1.133 . . . . 60.130000000000003 109.337 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' ASN . . . . . 0.42 ' HB3' ' NE2' ' A' ' 164' ' ' GLN . 4.0 t-20 -79.45 1.36 25.82 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.427 1.079 . . . . 45.030000000000001 109.271 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.487 ' NH1' ' ND2' ' A' ' 193' ' ' ASN . 17.6 mmm-85 63.33 62.97 0.93 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.449 1.093 . . . . 62.030000000000001 110.323 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . 0.549 ' N ' HE21 ' A' ' 164' ' ' GLN . 0.0 OUTLIER -60.1 -173.66 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 75.209999999999994 110.244 -179.973 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -124.54 24.72 7.8 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.572 1.17 . . . . 73.129999999999995 109.62 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -82.95 174.89 10.49 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.566 1.166 . . . . 74.219999999999999 109.284 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 167' ' ' TYR . . . . . 0.714 ' HB2' HG22 ' A' ' 221' ' ' ILE . 9.9 t80 -45.27 -65.47 0.53 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.53 1.144 . . . . 74.400000000000006 111.04 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . 0.413 ' H ' ' ND2' ' A' ' 168' ' ' ASN . 2.6 p30 -76.84 154.67 33.64 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.487 1.117 . . . . 63.32 109.316 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.54 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 43.2 m -140.23 168.09 20.63 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.479 1.112 . . . . 73.349999999999994 110.065 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.99 ' O ' HD12 ' A' ' 171' ' ' ILE . 73.0 t -122.72 130.96 74.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.546 1.154 . . . . 52.43 109.253 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.99 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.1 mp -142.34 110.74 5.9 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.52 1.138 . . . . 73.099999999999994 109.313 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . 0.674 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.0 Cg_endo -75.06 106.77 2.34 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.533 1.807 . . . . 75.430000000000007 110.939 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . 0.814 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.1 ttt -87.37 155.69 19.92 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.515 1.135 . . . . 62.119999999999997 110.968 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . 0.517 HH21 ' HB2' ' A' ' 139' ' ' LEU . 0.0 OUTLIER -115.89 116.53 40.44 Favored Pre-proline 0 C--N 1.325 -0.46 0 O-C-N 124.49 1.119 . . . . 73.209999999999994 110.321 -179.966 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 175' ' ' PRO . . . . . 0.663 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -75.04 160.12 40.41 Favored 'Trans proline' 0 C--N 1.359 1.109 0 O-C-N 124.492 1.786 . . . . 43.25 110.943 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . 0.824 HD13 ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -95.25 -43.8 7.9 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.526 1.141 . . . . 73.420000000000002 109.257 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . 0.469 ' ND2' ' H ' ' A' ' 177' ' ' ASN . 1.9 p30 -72.77 -25.71 61.28 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.509 1.13 . . . . 60.130000000000003 109.25 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -110.26 102.38 51.05 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.52 1.138 . . . . 73.349999999999994 109.326 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.04 134.32 17.61 Favored 'Trans proline' 0 C--N 1.359 1.118 0 O-C-N 124.48 1.779 . . . . 71.040000000000006 110.969 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.401 ' HA ' HD22 ' A' ' 180' ' ' LEU . 1.2 tm? -141.18 97.18 6.98 Favored Pre-proline 0 C--N 1.326 -0.42 0 O-C-N 124.493 1.121 . . . . 61.520000000000003 109.3 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.02 165.8 30.52 Favored 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.495 1.787 . . . . 61.350000000000001 110.973 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . 0.416 ' HG3' ' N ' ' A' ' 183' ' ' GLU . 5.4 ptm180 -68.11 -22.33 64.9 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.54 1.15 . . . . 73.209999999999994 110.283 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' A' ' 182' ' ' ARG . 11.6 pt-20 -61.96 -14.5 35.45 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.53 1.144 . . . . 72.310000000000002 110.262 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -121.4 3.43 10.26 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.594 1.184 . . . . 74.439999999999998 110.313 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 185' ' ' THR . . . . . 0.864 HG23 HD21 ' A' ' 139' ' ' LEU . 10.5 m -100.42 144.13 27.87 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.476 1.11 . . . . 64.049999999999997 110.425 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 186' ' ' PRO . . . . . 0.786 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -74.95 164.38 33.52 Favored 'Trans proline' 0 C--N 1.36 1.179 0 O-C-N 124.522 1.801 . . . . 72.310000000000002 110.97 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 187' ' ' PHE . . . . . 0.495 ' O ' ' CG2' ' A' ' 191' ' ' THR . 5.7 p90 -77.01 -7.0 54.87 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.515 1.134 . . . . 74.439999999999998 110.996 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -95.03 -51.36 4.69 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.557 1.161 . . . . 74.530000000000001 109.252 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.786 HD12 ' CG ' ' A' ' 186' ' ' PRO . 51.9 mt -68.41 -42.55 78.82 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.555 1.159 . . . . 63.43 109.37 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 190' ' ' GLN . . . . . 0.436 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.9 pt20 -65.3 -9.41 24.07 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.494 1.121 . . . . 74.140000000000001 110.241 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 191' ' ' THR . . . . . 0.495 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 67.7 p -119.32 17.95 13.0 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.472 1.107 . . . . 63.039999999999999 110.439 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.832 HD11 ' O ' ' A' ' 161' ' ' VAL . 7.4 mt -112.97 157.36 13.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.552 1.157 . . . . 72.219999999999999 109.277 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 193' ' ' ASN . . . . . 0.555 HD21 HD11 ' A' ' 171' ' ' ILE . 46.2 p-10 -65.53 75.38 0.06 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.477 1.111 . . . . 72.430000000000007 109.324 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . 0.674 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -71.9 149.58 45.0 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.424 1.078 . . . . 74.310000000000002 109.292 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 195' ' ' LEU . . . . . 0.584 HD23 HD12 ' A' ' 209' ' ' ILE . 0.5 OUTLIER -93.15 124.53 37.19 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.533 1.146 . . . . 64.439999999999998 109.291 -179.951 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -118.6 109.17 15.83 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.529 1.143 . . . . 72.209999999999994 110.287 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.819 ' CG ' HD11 ' A' ' 176' ' ' LEU . 14.0 pt-20 -79.63 -34.03 40.93 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.453 1.095 . . . . 73.510000000000005 110.314 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . 0.575 ' CG ' HD12 ' A' ' 176' ' ' LEU . 11.7 pt-20 -79.62 2.43 22.51 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.49 1.119 . . . . 64.310000000000002 110.303 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 29.4 t -96.52 145.35 25.78 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.445 1.09 . . . . 53.450000000000003 110.063 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -57.55 -28.69 63.76 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.535 1.147 . . . . 72.439999999999998 110.371 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -93.59 23.44 30.41 Favored Glycine 0 CA--C 1.53 1.027 0 O-C-N 124.552 1.158 . . . . 72.209999999999994 111.03 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 202' ' ' PHE . . . . . 0.863 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.2 OUTLIER -59.04 -43.14 97.04 Favored Pre-proline 0 C--N 1.324 -0.534 0 O-C-N 124.567 0.804 . . . . 75.299999999999997 111.027 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 203' ' ' PRO . . . . . 0.619 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -75.03 -36.05 2.76 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.487 1.783 . . . . 71.030000000000001 110.971 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -57.87 -47.2 83.42 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.483 1.114 . . . . 70.140000000000001 110.36 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 205' ' ' GLN . . . . . 0.401 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 1.8 mt-30 -70.67 -40.04 73.19 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.495 1.122 . . . . 64.439999999999998 110.293 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 206' ' ' VAL . . . . . 0.863 HG23 ' O ' ' A' ' 202' ' ' PHE . 89.7 t -66.85 -27.83 41.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.453 1.095 . . . . 63.229999999999997 109.273 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 207' ' ' GLU . . . . . 0.477 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 2.3 mt-10 -80.31 -51.72 8.56 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.494 1.121 . . . . 72.120000000000005 110.253 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 77.4 mtt180 -62.75 -57.92 9.26 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.518 1.136 . . . . 55.350000000000001 110.34 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 209' ' ' ILE . . . . . 0.766 HG22 ' CD1' ' A' ' 210' ' ' PHE . 65.5 mt -52.49 -53.82 18.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.485 1.116 . . . . 73.019999999999996 109.29 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 210' ' ' PHE . . . . . 0.766 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.1 m-85 -104.97 57.51 0.69 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.488 1.118 . . . . 74.439999999999998 110.959 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 211' ' ' GLN . . . . . 0.503 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -96.23 139.51 32.28 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.414 1.071 . . . . 53.43 110.291 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 215' ' ' TYR . 56.9 tt0 -49.98 -53.35 27.03 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.516 1.135 . . . . 73.209999999999994 110.309 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -47.1 -24.25 0.63 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.478 1.111 . . . . 64.340000000000003 110.013 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.503 HG23 ' HG2' ' A' ' 211' ' ' GLN . 34.6 t -95.9 -32.02 4.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.513 1.133 . . . . 62.109999999999999 109.261 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 215' ' ' TYR . . . . . 0.45 ' N ' ' O ' ' A' ' 212' ' ' GLU . 4.5 t80 -63.3 -36.41 83.6 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.512 1.133 . . . . 72.530000000000001 111.027 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt -50.4 -60.86 2.57 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.547 1.154 . . . . 72.230000000000004 109.289 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 217' ' ' THR . . . . . 0.966 HG22 HD11 ' A' ' 221' ' ' ILE . 1.3 m -51.98 -46.89 65.03 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.446 1.091 . . . . 73.209999999999994 110.443 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 218' ' ' GLN . . . . . 0.695 ' HA ' HD12 ' A' ' 221' ' ' ILE . 11.0 mm-40 -49.11 -54.67 15.11 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.476 1.11 . . . . 71.010000000000005 110.265 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 219' ' ' GLN . . . . . 0.417 ' NE2' ' HB2' ' A' ' 223' ' ' LYS . 21.8 tp60 -45.42 -52.81 9.59 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.514 1.134 . . . . 75.129999999999995 110.295 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -59.09 -44.87 91.96 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.483 1.115 . . . . 74.019999999999996 110.399 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 221' ' ' ILE . . . . . 0.966 HD11 HG22 ' A' ' 217' ' ' THR . 17.4 mt -59.18 -27.31 36.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.536 1.148 . . . . 72.409999999999997 109.311 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 222' ' ' TRP . . . . . 0.572 ' HB2' ' CE1' ' A' ' 167' ' ' TYR . 21.2 t90 -89.41 -17.42 28.8 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.98 -1.119 . . . . 71.519999999999996 107.98 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.417 ' HB2' ' NE2' ' A' ' 219' ' ' GLN . 1.6 tmmm? -85.91 -29.73 23.41 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.457 1.098 . . . . 71.430000000000007 109.351 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . 0.463 ' CG ' ' HA ' ' A' ' 221' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.444 0 O-C-N 124.458 1.099 . . . . 72.409999999999997 110.262 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.505 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 2.9 p . . . . . 0 N--CA 1.454 -0.245 0 N-CA-C 109.307 -0.627 . . . . 72.340000000000003 109.307 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.499 ' CE2' ' HG3' ' A' ' 108' ' ' PRO . 51.4 p90 -89.72 30.95 0.98 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.448 1.092 . . . . 71.209999999999994 110.984 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.626 HD11 HG22 ' A' ' 110' ' ' ILE . 6.1 tp -39.91 134.81 1.39 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.553 1.158 . . . . 72.129999999999995 109.359 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.475 ' O ' ' CB ' ' A' ' 133' ' ' ALA . 9.1 ttmt -74.84 -67.07 0.67 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.589 1.181 . . . . 71.319999999999993 109.365 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 1.08 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 1.5 p90 -152.16 140.68 20.69 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.384 1.052 . . . . 64.219999999999999 111.018 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.576 HG12 ' HB ' ' A' ' 135' ' ' THR . 8.6 p -84.07 171.59 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 O-C-N 124.48 1.112 . . . . 64.340000000000003 109.306 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 1.08 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 2.8 mp -137.4 86.04 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.574 1.172 . . . . 73.540000000000006 109.224 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.753 HD11 ' HB3' ' A' ' 128' ' ' ALA . 12.8 mt -70.41 101.38 1.94 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.501 1.125 . . . . 73.430000000000007 109.275 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.654 ' CE1' ' HB2' ' A' ' 113' ' ' ALA . 0.0 OUTLIER -121.32 174.62 6.61 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 124.552 1.157 . . . . 65.150000000000006 109.6 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.435 ' HB2' ' CD1' ' A' ' 143' ' ' PHE . . . -117.37 164.49 14.78 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.444 1.09 . . . . 74.400000000000006 109.252 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.4 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 21.0 tt0 -63.54 -11.4 24.04 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.512 1.132 . . . . 71.540000000000006 110.316 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -83.66 -45.93 12.89 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.488 1.118 . . . . 44.210000000000001 109.278 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.415 ' CG ' HD23 ' A' ' 138' ' ' LEU . 1.3 p30 -123.05 44.44 2.66 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.475 1.11 . . . . 74.519999999999996 109.324 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.623 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -76.03 -28.94 57.89 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.49 1.119 . . . . 71.319999999999993 110.42 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -84.72 -24.2 29.0 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.472 1.108 . . . . 73.230000000000004 109.408 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.424 ' HG3' ' ND2' ' A' ' 177' ' ' ASN . 0.0 OUTLIER -71.68 -54.73 9.38 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.495 1.122 . . . . 43.340000000000003 110.325 179.972 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.944 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -59.63 -35.63 74.75 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.471 1.107 . . . . 45.020000000000003 109.296 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.842 HD22 ' O ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -69.95 -49.6 50.17 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.537 1.148 . . . . 64.420000000000002 109.249 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.705 ' N ' HD13 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -44.97 -37.83 4.29 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.515 1.134 . . . . 63.009999999999998 110.232 -179.955 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.591 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.1 t -73.63 -64.51 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.489 1.118 . . . . 53.0 109.268 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.453 ' N ' HG12 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -41.67 -26.53 0.08 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.463 1.102 . . . . 74.200000000000003 110.302 -179.95 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.449 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.4 t-20 -71.34 -49.68 39.96 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.516 1.135 . . . . 73.299999999999997 109.286 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.85 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -74.95 -22.19 58.72 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.555 1.159 . . . . 74.120000000000005 109.333 -179.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.85 ' N ' HD23 ' A' ' 99' ' ' LEU . 30.8 mt -62.83 -51.73 65.89 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.529 1.143 . . . . 65.319999999999993 109.281 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 101' ' ' GLN . 10.0 pt20 -79.81 51.48 1.32 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.538 1.149 . . . . 73.120000000000005 110.297 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -170.13 -66.55 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.566 1.166 . . . . 61.140000000000001 109.27 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -50.28 -44.67 53.95 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.466 1.104 . . . . 72.430000000000007 109.36 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.513 ' HE2' HD23 ' A' ' 100' ' ' LEU . 1.6 m-85 -116.5 -32.27 5.28 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.514 1.134 . . . . 74.530000000000001 111.011 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.429 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 98.47 44.7 2.47 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 124.474 1.109 . . . . 64.409999999999997 110.978 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.414 HG23 ' HD3' ' A' ' 80' ' ' LYS . 8.9 mm -84.1 72.64 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.519 0.776 . . . . 71.230000000000004 109.31 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.522 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -119.9 156.69 54.01 Favored Pre-proline 0 C--N 1.324 -0.51 0 O-C-N 124.515 1.135 . . . . 74.439999999999998 109.322 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.522 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.1 Cg_endo -75.06 164.39 88.49 Favored 'Cis proline' 0 C--N 1.359 1.121 0 C-N-CA 120.994 -2.502 . . . . 65.209999999999994 110.953 0.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.44 125.4 5.02 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.405 1.066 . . . . 72.340000000000003 111.008 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.626 HG22 HD11 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -141.17 130.27 24.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.439 0.729 . . . . 70.310000000000002 109.271 179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . 1.107 HD12 ' HB3' ' A' ' 113' ' ' ALA . 1.8 pt -94.19 148.49 4.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 124.447 1.092 . . . . 72.230000000000004 109.326 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.573 ' CE1' HD21 ' A' ' 84' ' ' LEU . 2.6 t80 -51.59 -20.25 1.88 Allowed 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.49 1.119 . . . . 70.420000000000002 110.965 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 1.107 ' HB3' HD12 ' A' ' 111' ' ' ILE . . . -78.89 -35.98 42.78 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.512 1.132 . . . . 64.439999999999998 109.288 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -83.37 -24.87 31.83 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.474 1.109 . . . . 71.400000000000006 110.327 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 42.1 tpp -37.37 110.81 0.51 Allowed Pre-proline 0 C--N 1.326 -0.45 0 O-C-N 124.536 1.147 . . . . 74.5 110.997 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo . . . . . 0 C--N 1.36 1.158 0 O-C-N 124.525 1.803 . . . . 74.409999999999997 110.994 179.993 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.779 HD12 ' N ' ' A' ' 126' ' ' ASP . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.302 0 N-CA-C 109.31 -0.626 . . . . 71.430000000000007 109.31 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.779 ' N ' HD12 ' A' ' 125' ' ' LEU . 1.4 t70 -59.8 -20.23 55.52 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.504 1.127 . . . . 71.409999999999997 109.328 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -55.3 -21.87 16.49 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.434 1.084 . . . . 72.519999999999996 109.281 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.753 ' HB3' HD11 ' A' ' 84' ' ' LEU . . . -77.42 -40.87 41.99 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.488 1.118 . . . . 62.420000000000002 109.326 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.534 HG11 HG22 ' A' ' 170' ' ' VAL . 3.6 m -92.27 29.3 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 O-C-N 124.576 1.173 . . . . 73.530000000000001 109.26 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 24.4 m-20 -109.97 124.22 51.03 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.493 1.121 . . . . 73.120000000000005 109.283 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . 0.556 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 44.21 73.05 0.28 Allowed Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.532 1.145 . . . . 41.200000000000003 111.028 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . 0.402 ' O ' ' O ' ' A' ' 167' ' ' TYR . 2.5 m -162.96 -175.79 4.56 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.491 0.76 . . . . 73.239999999999995 109.955 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.564 ' CB ' ' CE3' ' A' ' 134' ' ' TRP . . . -99.83 -77.11 0.53 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.497 1.123 . . . . 54.219999999999999 109.296 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.586 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 0.8 OUTLIER -125.18 176.16 6.91 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.544 1.153 . . . . 74.030000000000001 108.001 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . 0.576 ' HB ' HG12 ' A' ' 82' ' ' VAL . 3.4 t -153.98 130.86 10.89 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.462 1.101 . . . . 73.329999999999998 110.423 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.763 HD13 ' HE2' ' A' ' 81' ' ' PHE . 1.4 mp -84.33 133.53 29.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.514 1.134 . . . . 64.040000000000006 109.303 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.692 HD11 ' CG1' ' A' ' 170' ' ' VAL . 10.2 mt -116.13 96.75 5.71 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.51 1.131 . . . . 75.109999999999999 109.311 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.944 HD21 ' HB2' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.34 92.08 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.522 1.139 . . . . 63.219999999999999 109.311 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.576 HD11 ' HB2' ' A' ' 172' ' ' PRO . 97.4 mt -68.43 111.04 4.42 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.513 1.133 . . . . 61.340000000000003 109.3 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . 0.663 HG23 ' CG ' ' A' ' 178' ' ' ASN . 4.5 m -124.61 160.97 27.26 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 124.482 1.114 . . . . 72.140000000000001 110.47 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -56.04 -39.12 71.51 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.523 1.14 . . . . 73.430000000000007 110.352 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -89.6 -52.62 4.92 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.452 1.095 . . . . 71.310000000000002 109.318 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.54 ' CE2' HG21 ' A' ' 147' ' ' THR . 55.3 t80 -53.23 -24.92 12.34 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.536 1.148 . . . . 72.540000000000006 110.968 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.611 HD13 ' N ' ' A' ' 145' ' ' ARG . 2.0 tm? -70.95 -67.19 0.52 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.545 1.153 . . . . 75.340000000000003 109.304 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.611 ' N ' HD13 ' A' ' 144' ' ' LEU . 0.8 OUTLIER -46.23 -25.03 0.54 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.526 1.141 . . . . 70.319999999999993 110.296 179.99 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -81.03 -54.54 5.46 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.545 1.153 . . . . 55.100000000000001 109.263 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.545 ' O ' ' CG ' ' A' ' 151' ' ' PHE . 27.2 p -70.48 -7.54 44.23 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.497 1.123 . . . . 74.319999999999993 110.414 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.564 ' CZ2' ' HB3' ' A' ' 186' ' ' PRO . 0.8 OUTLIER -96.77 -25.75 15.39 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.447 1.092 . . . . 75.230000000000004 108.059 179.916 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 14.5 t -82.77 -39.48 21.77 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.448 1.093 . . . . 74.420000000000002 108.269 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' ASN . . . . . 0.405 ' O ' ' N ' ' A' ' 154' ' ' TYR . 4.0 m120 -68.12 -53.13 27.6 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.442 1.089 . . . . 75.150000000000006 109.269 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 1.009 ' CZ ' HD12 ' A' ' 157' ' ' LEU . 6.9 m-30 -46.43 -53.2 11.55 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.512 1.132 . . . . 74.120000000000005 111.01 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -46.83 -47.53 21.12 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.534 1.146 . . . . 74.430000000000007 110.301 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -79.54 -19.43 49.57 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.581 1.176 . . . . 74.409999999999997 110.965 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.405 ' N ' ' O ' ' A' ' 150' ' ' ASN . 3.1 m-30 -113.31 97.82 6.72 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.551 1.157 . . . . 73.540000000000006 110.998 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.416 ' O ' ' ND2' ' A' ' 159' ' ' ASN . 1.2 t -74.93 -3.01 29.63 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.509 1.131 . . . . 64.120000000000005 110.389 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 8.8 t -78.51 -67.82 0.7 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.578 1.174 . . . . 54.32 109.939 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 1.009 HD12 ' CZ ' ' A' ' 151' ' ' PHE . 0.4 OUTLIER -44.04 -51.69 7.65 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.491 1.12 . . . . 71.340000000000003 109.263 -179.933 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' MET . . . . . 0.488 ' HA ' ' CE ' ' A' ' 158' ' ' MET . 6.6 mmt -44.15 -43.24 6.91 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.558 1.161 . . . . 75.120000000000005 110.937 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' ASN . . . . . 0.416 ' ND2' ' O ' ' A' ' 155' ' ' THR . 17.6 m-20 -64.24 -42.29 96.6 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 74.209999999999994 109.241 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' SER . . . . . 0.575 ' HB2' HG21 ' A' ' 170' ' ' VAL . 1.3 m -59.37 -35.2 73.46 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.592 1.183 . . . . 72.140000000000001 110.001 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . 0.861 ' O ' HD13 ' A' ' 192' ' ' ILE . 36.1 t -62.08 -18.36 19.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 O-C-N 124.577 1.173 . . . . 71.430000000000007 109.348 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -87.48 11.42 14.79 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.579 1.174 . . . . 70.319999999999993 109.282 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.697 ' NE ' HG23 ' A' ' 192' ' ' ILE . 0.6 OUTLIER 38.75 59.08 1.63 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.55 1.156 . . . . 74.5 110.271 -179.956 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -73.17 -173.11 1.23 Allowed 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.557 1.161 . . . . 74.109999999999999 110.284 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 27.6 p80 -85.59 51.04 2.08 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.528 1.143 . . . . 64.519999999999996 109.595 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.584 ' C ' HG21 ' A' ' 221' ' ' ILE . 0.0 OUTLIER -109.9 173.33 6.38 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.518 1.136 . . . . 75.450000000000003 109.23 -179.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 167' ' ' TYR . . . . . 0.402 ' O ' ' O ' ' A' ' 132' ' ' SER . 28.2 p90 -87.46 40.33 0.92 Allowed 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.465 1.103 . . . . 75.099999999999994 110.964 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -164.16 124.13 2.06 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.519 1.137 . . . . 71.319999999999993 109.296 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.504 ' HB3' ' CD1' ' A' ' 134' ' ' TRP . 27.6 t -118.28 105.79 12.12 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.441 1.088 . . . . 74.230000000000004 110.052 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.692 ' CG1' HD11 ' A' ' 137' ' ' LEU . 5.0 t -79.53 122.08 34.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.495 1.122 . . . . 65.510000000000005 109.319 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.597 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.3 mp -128.67 113.74 19.24 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.464 1.103 . . . . 51.310000000000002 109.251 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . 0.915 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.1 Cg_endo -75.04 107.43 2.48 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.502 1.791 . . . . 74.209999999999994 110.992 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . 0.664 ' CE ' HD12 ' A' ' 195' ' ' LEU . 3.2 ttt -87.75 152.25 22.27 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.501 1.126 . . . . 64.420000000000002 110.976 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . 0.424 ' N ' ' HG2' ' A' ' 173' ' ' MET . 0.0 OUTLIER -100.76 112.41 64.64 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.509 1.131 . . . . 63.020000000000003 110.305 179.975 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 175' ' ' PRO . . . . . 0.413 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.2 Cg_endo -74.97 151.57 39.86 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.58 1.831 . . . . 74.019999999999996 111.026 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . 0.873 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -86.56 -42.68 13.31 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.581 1.175 . . . . 65.219999999999999 109.33 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . 0.424 ' ND2' ' HG3' ' A' ' 92' ' ' GLU . 7.2 p30 -72.17 -28.0 62.94 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.528 1.142 . . . . 71.209999999999994 109.269 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 178' ' ' ASN . . . . . 0.663 ' CG ' HG23 ' A' ' 140' ' ' THR . 6.7 m-20 -110.7 98.19 36.41 Favored Pre-proline 0 C--N 1.324 -0.507 0 O-C-N 124.533 1.146 . . . . 73.400000000000006 109.325 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.98 114.98 4.15 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.565 1.824 . . . . 43.100000000000001 110.992 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.628 HD12 ' OG1' ' A' ' 185' ' ' THR . 0.4 OUTLIER -121.88 96.65 46.8 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.509 1.131 . . . . 71.310000000000002 109.313 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.05 167.49 26.89 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.44 1.758 . . . . 55.43 110.989 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 14.4 ptt180 -61.55 -25.58 67.39 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.563 1.164 . . . . 71.219999999999999 110.33 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -71.31 -9.99 59.03 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.433 1.083 . . . . 72.510000000000005 110.343 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -112.95 -28.87 7.56 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.482 1.114 . . . . 74.040000000000006 110.295 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 185' ' ' THR . . . . . 0.628 ' OG1' HD12 ' A' ' 180' ' ' LEU . 53.4 m -72.3 143.92 86.29 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.463 1.102 . . . . 70.510000000000005 110.352 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 186' ' ' PRO . . . . . 0.669 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.7 Cg_endo -74.96 146.56 32.96 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.492 1.785 . . . . 62.420000000000002 111.067 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 187' ' ' PHE . . . . . 0.606 ' O ' HG23 ' A' ' 191' ' ' THR . 24.7 p90 -61.69 -12.49 16.71 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.56 1.162 . . . . 73.540000000000006 110.991 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . 0.417 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -87.05 -53.62 4.77 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.53 1.144 . . . . 53.409999999999997 109.306 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.669 HD12 ' CG ' ' A' ' 186' ' ' PRO . 23.2 mt -74.53 -16.34 60.83 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.562 1.164 . . . . 53.299999999999997 109.311 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 190' ' ' GLN . . . . . 0.401 ' O ' ' CG ' ' A' ' 190' ' ' GLN . 6.2 tt0 -86.68 -8.25 57.59 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.567 1.167 . . . . 64.120000000000005 110.243 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 191' ' ' THR . . . . . 0.606 HG23 ' O ' ' A' ' 187' ' ' PHE . 31.5 p -115.73 18.71 15.63 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.515 1.134 . . . . 75.140000000000001 110.322 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.861 HD13 ' O ' ' A' ' 161' ' ' VAL . 8.8 mt -130.73 145.84 34.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.444 1.09 . . . . 54.340000000000003 109.248 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -52.77 118.53 3.73 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.504 1.127 . . . . 41.0 109.27 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . 0.915 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -110.95 177.6 4.61 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.5 1.125 . . . . 70.329999999999998 109.297 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 195' ' ' LEU . . . . . 0.665 HD23 HD12 ' A' ' 209' ' ' ILE . 0.2 OUTLIER -109.63 127.84 54.82 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.452 1.095 . . . . 74.099999999999994 109.238 -179.958 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -109.51 120.04 41.28 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.526 1.141 . . . . 75.349999999999994 110.258 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.873 ' HG3' HD21 ' A' ' 176' ' ' LEU . 12.0 tp10 -101.84 -22.41 14.36 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.516 1.135 . . . . 63.100000000000001 110.236 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . 0.432 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 1.3 pt-20 -94.06 9.88 35.9 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.455 1.097 . . . . 75.5 110.298 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 2.3 t -112.31 151.22 29.96 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.504 1.127 . . . . 64.099999999999994 109.979 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 26.5 ttt85 -64.23 -26.46 68.51 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.52 1.138 . . . . 72.540000000000006 110.286 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -89.51 26.7 8.75 Favored Glycine 0 CA--C 1.53 0.989 0 O-C-N 124.465 1.103 . . . . 63.039999999999999 111.001 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 202' ' ' PHE . . . . . 0.778 ' O ' HG23 ' A' ' 206' ' ' VAL . 3.3 t80 -68.34 -38.72 13.75 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 124.506 0.768 . . . . 73.510000000000005 110.972 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 203' ' ' PRO . . . . . 0.687 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.1 Cg_endo -74.95 -30.11 7.59 Favored 'Trans proline' 0 C--N 1.36 1.168 0 O-C-N 124.519 1.8 . . . . 62.439999999999998 111.021 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 204' ' ' THR . . . . . 0.419 HG22 ' N ' ' A' ' 205' ' ' GLN . 0.9 OUTLIER -64.14 -65.73 0.64 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.475 1.109 . . . . 72.530000000000001 110.4 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 205' ' ' GLN . . . . . 0.419 ' N ' HG22 ' A' ' 204' ' ' THR . 2.4 mt-30 -50.09 -41.82 48.92 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.49 1.118 . . . . 73.340000000000003 110.334 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 206' ' ' VAL . . . . . 0.794 HG11 HD22 ' A' ' 100' ' ' LEU . 53.7 t -59.84 -30.06 44.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.514 1.134 . . . . 62.329999999999998 109.288 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -79.81 -53.25 6.96 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.516 1.135 . . . . 70.040000000000006 110.297 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . 0.419 ' N ' ' HD2' ' A' ' 208' ' ' ARG . 3.2 mpt_? -55.91 -59.15 5.3 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.503 1.127 . . . . 73.319999999999993 110.305 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 209' ' ' ILE . . . . . 0.665 HD12 HD23 ' A' ' 195' ' ' LEU . 73.2 mt -54.29 -59.15 2.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.572 1.17 . . . . 73.510000000000005 109.29 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 210' ' ' PHE . . . . . 0.647 ' CD2' HG13 ' A' ' 206' ' ' VAL . 1.0 OUTLIER -92.17 62.34 4.11 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.501 1.126 . . . . 73.310000000000002 111.05 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 211' ' ' GLN . . . . . 0.536 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -110.87 145.46 38.23 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.52 1.137 . . . . 73.319999999999993 110.289 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 215' ' ' TYR . 27.8 tt0 -49.11 -55.14 13.19 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.487 1.117 . . . . 74.140000000000001 110.333 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.68 -24.23 1.3 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.517 1.136 . . . . 71.540000000000006 110.022 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.536 HG23 ' HG2' ' A' ' 211' ' ' GLN . 40.4 t -96.31 -27.46 3.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.539 1.149 . . . . 42.140000000000001 109.265 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 215' ' ' TYR . . . . . 0.447 ' N ' ' O ' ' A' ' 212' ' ' GLU . 12.0 t80 -66.08 -27.21 67.9 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.493 1.121 . . . . 64.239999999999995 110.973 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . 0.443 ' O ' ' N ' ' A' ' 220' ' ' THR . 12.8 mmtp -59.49 -58.27 9.35 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.382 1.051 . . . . 53.140000000000001 109.274 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 217' ' ' THR . . . . . 0.636 HG22 HD11 ' A' ' 221' ' ' ILE . 4.4 m -50.1 -62.94 1.28 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.503 1.127 . . . . 64.340000000000003 110.355 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 218' ' ' GLN . . . . . 0.475 ' HA ' HD12 ' A' ' 221' ' ' ILE . 3.5 mp0 -54.2 -27.1 32.1 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.533 1.146 . . . . 64.25 110.333 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 219' ' ' GLN . . . . . 0.444 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 30.8 tp60 -82.29 -25.86 33.63 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.464 1.102 . . . . 71.209999999999994 110.269 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 220' ' ' THR . . . . . 0.444 ' O ' ' CG ' ' A' ' 224' ' ' GLU . 1.1 m -88.09 -20.32 25.86 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.53 1.144 . . . . 74.540000000000006 110.388 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 221' ' ' ILE . . . . . 0.636 HD11 HG22 ' A' ' 217' ' ' THR . 19.8 mt -82.12 -41.76 18.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.424 1.078 . . . . 72.120000000000005 109.27 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 222' ' ' TRP . . . . . 0.556 ' CD1' ' HA2' ' A' ' 131' ' ' GLY . 13.9 t90 -64.51 -55.86 17.9 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.507 1.13 . . . . 73.329999999999998 107.999 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.02 -18.64 25.48 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.46 1.1 . . . . 73.340000000000003 109.318 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . 0.444 ' CG ' ' O ' ' A' ' 220' ' ' THR . 3.0 mm-40 . . . . . 0 C--N 1.325 -0.468 0 O-C-N 124.522 1.139 . . . . 72.349999999999994 110.304 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.592 HG22 ' H ' ' A' ' 79' ' ' LEU . 6.5 p . . . . . 0 N--CA 1.452 -0.34 0 N-CA-C 109.274 -0.639 . . . . 74.310000000000002 109.274 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.415 ' O ' ' C ' ' A' ' 79' ' ' LEU . 34.1 t80 -80.38 12.76 2.77 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.463 1.102 . . . . 74.540000000000006 111.016 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.592 ' H ' HG22 ' A' ' 77' ' ' VAL . 15.5 tp -39.19 157.58 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.531 1.144 . . . . 71.400000000000006 109.299 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.834 ' HZ3' ' HA ' ' A' ' 106' ' ' ILE . 5.0 ptpt -100.83 -45.81 5.33 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.515 1.134 . . . . 70.349999999999994 109.333 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.833 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.7 OUTLIER -167.78 129.1 1.46 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.46 1.1 . . . . 73.299999999999997 110.963 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.953 HG12 HG22 ' A' ' 135' ' ' THR . 9.3 p -84.51 174.33 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.506 1.129 . . . . 74.140000000000001 109.317 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.861 ' CG2' ' HB1' ' A' ' 93' ' ' ALA . 2.1 mp -129.32 95.1 2.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.419 1.075 . . . . 70.439999999999998 109.344 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.814 HD11 ' HB3' ' A' ' 128' ' ' ALA . 1.0 OUTLIER -74.21 93.73 2.37 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.479 1.112 . . . . 74.409999999999997 109.232 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.706 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -112.85 174.49 5.87 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.49 1.119 . . . . 73.439999999999998 109.643 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.86 ' HB2' ' CD1' ' A' ' 143' ' ' PHE . . . -110.75 148.35 32.51 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.472 1.107 . . . . 62.530000000000001 109.276 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -50.3 -21.8 1.54 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.562 1.164 . . . . 74.519999999999996 110.411 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -77.37 -46.26 23.36 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.47 1.106 . . . . 72.439999999999998 109.299 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.68 ' CB ' HD12 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -117.05 44.46 2.07 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.581 1.176 . . . . 75.109999999999999 109.288 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.609 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -76.79 -44.1 34.12 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.478 1.112 . . . . 72.120000000000005 110.366 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -63.14 -37.67 88.13 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.487 1.117 . . . . 51.32 109.339 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.446 ' O ' ' N ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -55.63 -69.38 0.14 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.428 1.08 . . . . 61.299999999999997 110.339 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 1.154 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -47.73 -36.75 11.89 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.496 1.122 . . . . 52.229999999999997 109.268 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.646 HD23 ' O ' ' A' ' 94' ' ' LEU . 0.6 OUTLIER -67.7 -36.18 80.18 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.466 1.104 . . . . 75.420000000000002 109.364 179.936 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.446 ' N ' ' O ' ' A' ' 92' ' ' GLU . 17.5 tpp85 -61.0 -47.84 84.58 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.448 1.093 . . . . 73.540000000000006 110.32 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.622 HG21 ' HE1' ' A' ' 173' ' ' MET . 0.3 OUTLIER -69.59 -52.83 28.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.595 1.185 . . . . 74.140000000000001 109.31 179.993 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.549 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -51.8 -17.77 1.05 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.612 1.195 . . . . 71.150000000000006 110.347 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.411 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -81.83 -52.41 7.14 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.484 1.115 . . . . 74.209999999999994 109.27 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.827 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -68.16 -22.46 64.85 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.475 1.109 . . . . 74.430000000000007 109.328 -179.937 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.827 ' N ' HD23 ' A' ' 99' ' ' LEU . 32.8 mt -66.81 -48.36 69.19 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.46 1.1 . . . . 73.040000000000006 109.298 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -79.52 52.84 1.45 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.501 1.126 . . . . 72.420000000000002 110.323 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -175.97 -64.17 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.529 1.143 . . . . 62.409999999999997 109.263 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -46.01 -45.95 16.19 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.473 1.108 . . . . 63.210000000000001 109.283 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -116.47 -32.02 5.38 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.444 1.09 . . . . 70.519999999999996 111.01 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.404 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 108.15 37.9 2.07 Favored Glycine 0 CA--C 1.53 1.02 0 O-C-N 124.538 1.148 . . . . 73.439999999999998 111.015 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.834 ' HA ' ' HZ3' ' A' ' 80' ' ' LYS . 16.6 mm -78.56 74.87 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.516 0.774 . . . . 72.150000000000006 109.362 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.557 ' H ' ' NZ ' ' A' ' 80' ' ' LYS . 0.0 OUTLIER -126.92 155.99 74.76 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.516 1.135 . . . . 72.109999999999999 109.28 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.53 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.4 Cg_endo -74.94 161.22 95.27 Favored 'Cis proline' 0 C--N 1.36 1.152 0 C-N-CA 121.026 -2.489 . . . . 61.219999999999999 111.02 -0.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -117.6 119.3 4.38 Favored Glycine 0 CA--C 1.53 0.97 0 O-C-N 124.422 1.076 . . . . 61.450000000000003 111.036 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.402 HD11 ' C ' ' A' ' 114' ' ' GLU . 0.0 OUTLIER -138.95 128.59 31.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.469 0.746 . . . . 72.5 109.287 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . 0.706 HD12 ' NE2' ' A' ' 85' ' ' HIS . 39.3 pt -89.28 174.4 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.456 1.097 . . . . 72.200000000000003 109.323 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.986 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 2.4 t80 -75.2 -18.65 60.1 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.418 1.074 . . . . 71.409999999999997 110.967 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.5 -3.11 53.53 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.493 1.121 . . . . 71.319999999999993 109.256 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.402 ' C ' HD11 ' A' ' 110' ' ' ILE . 23.5 mt-10 -107.65 -26.74 10.71 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.532 1.145 . . . . 71.129999999999995 110.281 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 35.6 tpp -41.72 110.77 0.81 Allowed Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.502 1.126 . . . . 74.25 111.011 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo . . . . . 0 C--N 1.36 1.148 0 O-C-N 124.479 1.779 . . . . 74.400000000000006 111.066 179.949 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 1.04 HD11 HD11 ' A' ' 157' ' ' LEU . 3.6 pp . . . . . 0 N--CA 1.454 -0.269 0 N-CA-C 109.304 -0.628 . . . . 65.129999999999995 109.304 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -63.09 -14.3 46.7 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.566 1.166 . . . . 74.549999999999997 109.332 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.48 -48.79 65.7 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.438 1.087 . . . . 51.450000000000003 109.292 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.986 ' HB2' ' CE1' ' A' ' 112' ' ' PHE . . . -65.64 -22.71 66.67 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.499 1.124 . . . . 61.240000000000002 109.357 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.627 ' O ' HG12 ' A' ' 129' ' ' VAL . 70.9 t -86.6 10.04 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.517 1.136 . . . . 72.230000000000004 109.339 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -135.64 119.34 17.15 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 124.534 1.146 . . . . 75.219999999999999 109.302 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 91.76 47.98 3.29 Favored Glycine 0 CA--C 1.53 0.974 0 O-C-N 124.474 1.109 . . . . 51.420000000000002 111.033 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . 0.51 ' OG ' HD23 ' A' ' 79' ' ' LEU . 3.2 m -163.35 171.14 16.5 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.496 0.762 . . . . 75.310000000000002 109.956 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.525 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -104.85 -27.35 11.79 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.535 1.147 . . . . 60.43 109.251 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.587 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 6.6 m-90 -158.82 157.83 32.34 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.536 1.148 . . . . 74.230000000000004 108.0 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . 0.953 HG22 HG12 ' A' ' 82' ' ' VAL . 6.3 p -140.56 128.77 22.31 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.5 1.125 . . . . 61.340000000000003 110.412 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.54 HD13 ' HE2' ' A' ' 81' ' ' PHE . 1.4 mp -84.07 149.6 4.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 124.423 1.077 . . . . 71.230000000000004 109.321 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.678 HD11 HG13 ' A' ' 170' ' ' VAL . 47.6 mt -131.35 108.02 9.35 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.507 1.13 . . . . 74.010000000000005 109.356 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 1.154 HD21 ' HB2' ' A' ' 93' ' ' ALA . 1.4 mm? -62.35 93.25 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.502 1.126 . . . . 63.32 109.306 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.853 HD21 HG23 ' A' ' 185' ' ' THR . 6.3 tp -69.12 99.15 1.08 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.55 1.156 . . . . 73.140000000000001 109.334 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . 0.427 ' O ' ' N ' ' A' ' 144' ' ' LEU . 2.5 m -127.05 162.68 25.47 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.568 1.167 . . . . 71.219999999999999 110.401 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -69.41 -29.95 67.81 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.5 1.125 . . . . 70.5 110.329 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -89.61 -25.06 21.49 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.457 1.098 . . . . 62.229999999999997 109.318 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.86 ' CD1' ' HB2' ' A' ' 86' ' ' ALA . 82.0 t80 -90.16 -19.8 23.82 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.472 1.107 . . . . 73.019999999999996 111.016 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.584 HD13 ' C ' ' A' ' 144' ' ' LEU . 2.7 tm? -53.62 -67.61 0.24 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.602 1.188 . . . . 75.430000000000007 109.292 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.49 ' N ' HD13 ' A' ' 144' ' ' LEU . 54.6 mmm-85 -57.98 -16.38 12.25 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.545 1.153 . . . . 61.43 110.273 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -77.47 -34.68 54.27 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.522 1.139 . . . . 52.100000000000001 109.336 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.855 HG21 ' CE2' ' A' ' 143' ' ' PHE . 2.1 p -102.87 -8.3 20.85 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.555 1.16 . . . . 73.329999999999998 110.406 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.424 ' HA ' ' CE3' ' A' ' 148' ' ' TRP . 0.3 OUTLIER -95.85 -25.35 16.05 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.077 -1.082 . . . . 62.229999999999997 108.077 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 16.8 t -92.53 -37.71 12.34 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.534 1.146 . . . . 71.340000000000003 108.275 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' ASN . . . . . 0.516 ' O ' ' CG ' ' A' ' 154' ' ' TYR . 68.7 m-20 -68.47 -49.65 58.25 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.52 1.137 . . . . 73.439999999999998 109.255 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.789 ' CD1' HD13 ' A' ' 157' ' ' LEU . 6.4 m-30 -60.88 -55.33 34.34 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.505 1.128 . . . . 63.210000000000001 111.007 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 30.3 tp60 -48.1 -47.74 34.16 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.517 1.136 . . . . 54.310000000000002 110.323 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -74.1 -20.3 60.31 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.495 1.122 . . . . 74.239999999999995 110.962 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.516 ' CG ' ' O ' ' A' ' 150' ' ' ASN . 15.8 m-30 -117.79 83.2 1.95 Allowed 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.49 1.119 . . . . 71.420000000000002 111.032 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.3 t -49.7 -22.84 1.49 Allowed 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.429 1.081 . . . . 73.25 110.364 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 11.3 p -62.03 -40.58 96.22 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.49 1.119 . . . . 65.340000000000003 109.992 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 1.04 HD11 HD11 ' A' ' 125' ' ' LEU . 6.4 mt -68.5 -47.41 67.07 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.441 1.088 . . . . 65.0 109.272 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' MET . . . . . 0.436 ' HE2' HG11 ' A' ' 161' ' ' VAL . 5.3 mmt -47.04 -33.04 4.45 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.512 1.133 . . . . 64.420000000000002 111.0 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -66.11 -44.76 83.36 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 124.496 1.122 . . . . 52.340000000000003 109.328 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' SER . . . . . 0.542 ' HB3' HG21 ' A' ' 170' ' ' VAL . 1.4 m -71.83 -28.76 63.79 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.542 1.151 . . . . 74.239999999999995 110.011 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . 0.649 ' CG2' ' CE2' ' A' ' 151' ' ' PHE . 3.5 t -56.84 -18.08 6.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.508 1.13 . . . . 73.25 109.318 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' ASN . . . . . 0.479 ' O ' ' N ' ' A' ' 164' ' ' GLN . 1.5 t-20 -90.61 20.97 4.24 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.491 1.12 . . . . 74.140000000000001 109.354 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.422 ' C ' ' O ' ' A' ' 162' ' ' ASN . 0.1 OUTLIER 36.43 31.79 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.492 1.12 . . . . 71.450000000000003 110.294 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . 0.479 ' N ' ' O ' ' A' ' 162' ' ' ASN . 34.1 mt-30 -38.34 132.03 1.12 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.471 1.107 . . . . 65.430000000000007 110.224 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' HIS . . . . . 0.527 ' CG ' ' O ' ' A' ' 165' ' ' HIS . 5.4 p80 -69.47 72.2 0.32 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.513 1.133 . . . . 73.430000000000007 109.565 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.44 ' O ' ' NE2' ' A' ' 218' ' ' GLN . 0.5 OUTLIER -125.13 -178.7 4.28 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.467 1.104 . . . . 63.299999999999997 109.336 179.928 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 167' ' ' TYR . . . . . 0.467 ' CD1' ' HB2' ' A' ' 168' ' ' ASN . 37.8 p90 -49.82 -35.83 24.38 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.662 1.226 . . . . 73.0 111.029 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . 0.467 ' HB2' ' CD1' ' A' ' 167' ' ' TYR . 2.9 t30 -117.12 129.41 55.95 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.52 1.138 . . . . 74.299999999999997 109.323 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.451 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 0.4 OUTLIER -119.87 155.59 32.37 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.436 1.085 . . . . 62.509999999999998 109.992 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.804 ' C ' HD12 ' A' ' 171' ' ' ILE . 18.5 t -118.82 122.06 68.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.437 1.086 . . . . 54.210000000000001 109.26 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.804 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -127.1 112.84 21.71 Favored Pre-proline 0 C--N 1.324 -0.522 0 O-C-N 124.503 1.127 . . . . 71.340000000000003 109.348 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . 0.719 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.96 106.6 2.3 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.518 1.799 . . . . 75.329999999999998 111.024 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . 0.647 ' CE ' HD12 ' A' ' 195' ' ' LEU . 11.0 ttt -82.92 166.32 18.99 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.531 1.144 . . . . 74.329999999999998 110.943 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . 0.424 ' N ' ' HG2' ' A' ' 173' ' ' MET . 17.0 mmm-85 -131.21 126.47 21.47 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.485 1.115 . . . . 74.209999999999994 110.356 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 175' ' ' PRO . . . . . 0.489 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.4 Cg_endo -75.01 163.18 35.83 Favored 'Trans proline' 0 C--N 1.36 1.14 0 O-C-N 124.481 1.78 . . . . 73.439999999999998 110.984 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . 0.921 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -94.85 -47.19 6.56 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.531 1.144 . . . . 73.540000000000006 109.289 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -71.27 -25.27 62.39 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.533 1.146 . . . . 63.350000000000001 109.365 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 178' ' ' ASN . . . . . 0.489 ' CB ' ' HG2' ' A' ' 175' ' ' PRO . 7.5 m-80 -109.39 100.95 43.78 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.551 1.157 . . . . 72.519999999999996 109.305 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.03 138.92 23.59 Favored 'Trans proline' 0 C--N 1.361 1.205 0 O-C-N 124.488 1.783 . . . . 72.310000000000002 111.037 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.436 ' HA ' HD22 ' A' ' 180' ' ' LEU . 0.4 OUTLIER -141.18 96.76 7.08 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.465 1.103 . . . . 73.430000000000007 109.314 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.95 166.31 29.51 Favored 'Trans proline' 0 C--N 1.361 1.22 0 O-C-N 124.51 1.795 . . . . 42.409999999999997 111.039 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 26.2 mtm105 -60.38 -26.72 66.86 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.467 1.104 . . . . 70.519999999999996 110.283 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -61.49 -18.74 60.42 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.514 1.134 . . . . 72.409999999999997 110.367 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -113.09 -0.59 14.66 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.508 1.13 . . . . 63.130000000000003 110.265 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 185' ' ' THR . . . . . 0.853 HG23 HD21 ' A' ' 139' ' ' LEU . 20.6 m -108.53 143.66 27.94 Favored Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.493 1.12 . . . . 53.149999999999999 110.368 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 186' ' ' PRO . . . . . 0.819 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.5 Cg_endo -74.95 155.78 43.18 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.428 1.751 . . . . 75.310000000000002 111.027 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 187' ' ' PHE . . . . . 0.502 ' O ' ' CG2' ' A' ' 191' ' ' THR . 49.3 p90 -69.45 -7.27 36.43 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.541 1.151 . . . . 73.120000000000005 111.024 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.81 -52.91 4.23 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.551 1.157 . . . . 45.43 109.305 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.819 HD12 ' CG ' ' A' ' 186' ' ' PRO . 44.6 mt -68.57 -42.3 78.49 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.515 1.134 . . . . 71.340000000000003 109.285 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 190' ' ' GLN . . . . . 0.426 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.3 pt20 -63.73 -11.09 23.26 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.551 1.157 . . . . 75.439999999999998 110.334 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 191' ' ' THR . . . . . 0.502 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 35.5 p -113.35 6.91 17.49 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.451 1.095 . . . . 61.329999999999998 110.383 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.476 ' CG2' ' N ' ' A' ' 193' ' ' ASN . 7.5 mt -103.79 162.2 4.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.465 1.103 . . . . 74.310000000000002 109.315 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 193' ' ' ASN . . . . . 0.476 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 30.8 p-10 -66.57 74.44 0.1 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.553 1.158 . . . . 75.109999999999999 109.251 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . 0.719 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -79.3 128.58 33.5 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.617 1.198 . . . . 61.030000000000001 109.298 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 195' ' ' LEU . . . . . 0.647 HD12 ' CE ' ' A' ' 173' ' ' MET . 0.3 OUTLIER -68.47 124.8 24.56 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.45 1.094 . . . . 51.340000000000003 109.241 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -109.18 111.18 22.65 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.468 1.105 . . . . 72.319999999999993 110.379 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.921 ' HG3' HD21 ' A' ' 176' ' ' LEU . 35.6 tp10 -87.7 -22.45 24.63 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.547 1.154 . . . . 75.310000000000002 110.278 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . 0.482 ' HB3' HD12 ' A' ' 176' ' ' LEU . 7.3 pt-20 -95.08 22.86 6.16 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.451 1.095 . . . . 74.439999999999998 110.275 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 4.0 t -127.58 143.91 51.12 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.548 1.155 . . . . 74.129999999999995 109.936 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 55.1 mtt180 -58.79 -20.93 54.38 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.537 1.148 . . . . 71.230000000000004 110.29 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -88.77 11.53 68.46 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.517 1.136 . . . . 54.329999999999998 110.97 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 202' ' ' PHE . . . . . 0.848 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.1 OUTLIER -53.45 -45.19 98.64 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.531 0.783 . . . . 71.420000000000002 110.976 179.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 203' ' ' PRO . . . . . 0.594 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.07 -37.89 1.8 Allowed 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.518 1.799 . . . . 70.400000000000006 110.944 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.49 -49.54 72.28 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.506 1.129 . . . . 44.130000000000003 110.367 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -68.86 -41.35 78.53 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.51 1.131 . . . . 74.219999999999999 110.314 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 206' ' ' VAL . . . . . 0.848 HG23 ' O ' ' A' ' 202' ' ' PHE . 69.3 t -64.64 -27.37 42.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.476 1.11 . . . . 75.030000000000001 109.283 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -80.64 -51.1 9.1 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.45 1.094 . . . . 72.439999999999998 110.349 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 87.6 mtt-85 -64.43 -62.31 1.68 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.461 1.101 . . . . 73.430000000000007 110.278 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 209' ' ' ILE . . . . . 0.815 HG22 ' CE1' ' A' ' 210' ' ' PHE . 90.9 mt -46.87 -44.75 7.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.454 1.096 . . . . 75.109999999999999 109.286 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 210' ' ' PHE . . . . . 0.815 ' CE1' HG22 ' A' ' 209' ' ' ILE . 1.3 m-85 -111.92 67.82 0.66 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.521 1.138 . . . . 74.420000000000002 111.066 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 211' ' ' GLN . . . . . 0.528 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.1 OUTLIER -110.7 143.61 40.92 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.508 1.13 . . . . 62.049999999999997 110.267 -179.937 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . 0.456 ' O ' ' N ' ' A' ' 215' ' ' TYR . 23.8 tt0 -49.58 -54.66 16.95 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.403 1.064 . . . . 70.120000000000005 110.273 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.89 -24.29 0.98 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.571 1.169 . . . . 72.120000000000005 110.005 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.528 HG23 ' HG2' ' A' ' 211' ' ' GLN . 40.0 t -96.15 -29.71 3.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.489 1.118 . . . . 71.310000000000002 109.294 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 215' ' ' TYR . . . . . 0.456 ' N ' ' O ' ' A' ' 212' ' ' GLU . 6.3 t80 -64.5 -34.08 77.38 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.477 1.111 . . . . 72.519999999999996 111.006 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp -55.59 -59.88 4.21 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 71.010000000000005 109.326 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 217' ' ' THR . . . . . 1.058 HG22 HD11 ' A' ' 221' ' ' ILE . 99.2 m -58.43 -66.45 0.49 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.523 1.139 . . . . 70.420000000000002 110.386 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 218' ' ' GLN . . . . . 0.821 ' HA ' HD12 ' A' ' 221' ' ' ILE . 28.0 mm-40 -39.44 -40.48 0.83 Allowed 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.527 1.142 . . . . 71.420000000000002 110.313 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 219' ' ' GLN . . . . . 0.449 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 16.9 tp60 -65.96 -46.66 77.32 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.441 1.088 . . . . 70.430000000000007 110.254 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 220' ' ' THR . . . . . 0.456 ' N ' ' O ' ' A' ' 217' ' ' THR . 1.3 m -68.04 -23.1 64.94 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.506 1.129 . . . . 63.299999999999997 110.435 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 221' ' ' ILE . . . . . 1.058 HD11 HG22 ' A' ' 217' ' ' THR . 17.1 mt -78.6 -32.5 16.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 O-C-N 124.508 1.13 . . . . 75.510000000000005 109.33 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 222' ' ' TRP . . . . . 0.426 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 26.5 t90 -71.13 -50.59 31.94 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.539 1.15 . . . . 63.219999999999999 108.038 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.95 -18.04 63.85 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.425 1.078 . . . . 62.149999999999999 109.285 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 . . . . . 0 C--N 1.325 -0.495 0 O-C-N 124.47 1.106 . . . . 75.340000000000003 110.28 179.966 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.41 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 5.8 p . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 109.329 -0.619 . . . . 61.310000000000002 109.329 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.404 ' O ' ' C ' ' A' ' 79' ' ' LEU . 55.1 p90 -88.56 24.37 1.99 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.436 1.085 . . . . 74.230000000000004 110.966 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.404 ' C ' ' O ' ' A' ' 78' ' ' PHE . 6.6 tp -40.14 152.77 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.463 1.102 . . . . 74.340000000000003 109.27 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.54 ' HD3' HG23 ' A' ' 106' ' ' ILE . 6.4 ttmt -92.43 -60.29 1.87 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.522 1.139 . . . . 71.219999999999999 109.281 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.557 ' CE1' HD11 ' A' ' 83' ' ' ILE . 0.4 OUTLIER -162.14 138.69 7.95 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.532 1.145 . . . . 72.540000000000006 110.969 179.996 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.628 HG11 ' O ' ' A' ' 128' ' ' ALA . 2.8 p -89.63 160.23 2.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 O-C-N 124.567 1.167 . . . . 73.319999999999993 109.347 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.557 HD11 ' CE1' ' A' ' 81' ' ' PHE . 4.3 mp -118.13 92.46 2.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.499 1.124 . . . . 73.239999999999995 109.33 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.611 HD13 HD12 ' A' ' 125' ' ' LEU . 6.1 mt -70.18 118.73 13.38 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.54 1.15 . . . . 73.25 109.291 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.821 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -143.89 174.53 10.75 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.463 1.102 . . . . 73.219999999999999 109.574 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -110.85 152.1 27.07 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.463 1.102 . . . . 73.219999999999999 109.273 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.09 -18.34 5.33 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.439 1.087 . . . . 70.409999999999997 110.277 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -69.97 -46.35 65.42 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.586 1.179 . . . . 65.239999999999995 109.225 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.435 ' CG ' ' ND2' ' A' ' 178' ' ' ASN . 2.5 m-20 -130.16 43.76 3.07 Favored 'General case' 0 C--N 1.323 -0.557 0 O-C-N 124.497 1.123 . . . . 73.030000000000001 109.319 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.606 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -73.91 -20.85 60.27 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.54 1.15 . . . . 72.310000000000002 110.412 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -81.44 -39.13 25.34 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.568 1.167 . . . . 71.409999999999997 109.301 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -59.86 -50.46 73.7 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 124.535 1.147 . . . . 71.109999999999999 110.261 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 1.053 ' HB2' ' CD2' ' A' ' 138' ' ' LEU . . . -59.93 -35.09 74.17 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.446 1.091 . . . . 61.420000000000002 109.286 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.997 ' HB2' HD13 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -68.66 -44.62 73.72 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.518 1.136 . . . . 64.25 109.306 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.705 ' N ' HD13 ' A' ' 94' ' ' LEU . 8.8 tpt180 -48.94 -31.57 7.56 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.58 1.175 . . . . 62.310000000000002 110.261 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.823 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.1 t -78.64 -65.26 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.557 1.16 . . . . 61.310000000000002 109.288 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.761 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -40.3 -27.35 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.486 1.117 . . . . 75.129999999999995 110.315 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.455 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.3 t-20 -71.75 -60.48 2.21 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.475 1.11 . . . . 73.040000000000006 109.288 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.852 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -61.6 -22.55 65.32 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.542 1.151 . . . . 74.219999999999999 109.339 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.852 ' N ' HD23 ' A' ' 99' ' ' LEU . 26.7 mt -65.59 -50.81 63.73 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.492 1.12 . . . . 74.230000000000004 109.277 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -76.97 55.69 1.14 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.469 1.105 . . . . 71.510000000000005 110.311 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.0 t70 179.71 -63.29 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.489 1.118 . . . . 73.140000000000001 109.299 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.559 ' HB3' ' CD1' ' A' ' 104' ' ' PHE . 64.0 t0 -43.99 -53.71 6.03 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.488 1.117 . . . . 75.319999999999993 109.292 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.683 ' CE1' HG11 ' A' ' 206' ' ' VAL . 0.3 OUTLIER -113.43 -23.87 9.61 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.496 1.123 . . . . 64.120000000000005 111.014 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.98 37.68 4.33 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.509 1.131 . . . . 50.25 111.036 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.54 HG23 ' HD3' ' A' ' 80' ' ' LYS . 8.1 mm -81.97 81.14 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.436 0.727 . . . . 75.129999999999995 109.362 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.516 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -128.21 156.76 76.06 Favored Pre-proline 0 C--N 1.325 -0.459 0 O-C-N 124.537 1.148 . . . . 65.239999999999995 109.276 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.516 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.93 152.89 98.8 Favored 'Cis proline' 0 C--N 1.36 1.141 0 C-N-CA 121.052 -2.479 . . . . 74.140000000000001 111.015 -0.062 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . 0.436 ' O ' ' NE2' ' A' ' 97' ' ' GLN . . . -119.28 110.86 1.95 Allowed Glycine 0 CA--C 1.531 1.043 0 O-C-N 124.513 1.133 . . . . 62.329999999999998 111.018 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.445 ' CD1' ' HA ' ' A' ' 115' ' ' MET . 0.3 OUTLIER -129.02 144.68 37.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.54 0.788 . . . . 72.239999999999995 109.32 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . 0.997 HD13 ' HB2' ' A' ' 94' ' ' LEU . 20.7 pt -97.16 -177.3 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.499 1.124 . . . . 71.329999999999998 109.275 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.509 ' CD1' ' SD ' ' A' ' 115' ' ' MET . 2.2 t80 -81.77 -18.85 42.73 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.464 1.103 . . . . 62.119999999999997 110.964 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -96.44 -2.55 45.2 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.479 1.112 . . . . 73.129999999999995 109.312 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.595 ' HG2' HD11 ' A' ' 111' ' ' ILE . 67.1 mm-40 -110.44 -26.69 9.39 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.465 1.103 . . . . 73.530000000000001 110.328 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.509 ' SD ' ' CD1' ' A' ' 112' ' ' PHE . 1.2 ptp -70.02 135.03 87.4 Favored Pre-proline 0 C--N 1.325 -0.462 0 O-C-N 124.534 1.146 . . . . 50.450000000000003 111.016 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo . . . . . 0 C--N 1.36 1.163 0 O-C-N 124.51 1.795 . . . . 53.450000000000003 111.004 179.991 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.643 HD22 ' CG ' ' A' ' 150' ' ' ASN . 1.0 OUTLIER . . . . . 0 N--CA 1.454 -0.271 0 N-CA-C 109.296 -0.631 . . . . 65.030000000000001 109.296 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.407 ' O ' ' N ' ' A' ' 129' ' ' VAL . 10.9 t70 -49.69 -37.49 29.05 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.47 1.106 . . . . 74.209999999999994 109.26 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -50.88 -41.31 58.14 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.551 1.157 . . . . 74.099999999999994 109.335 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.628 ' O ' HG11 ' A' ' 82' ' ' VAL . . . -69.99 -26.44 64.08 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.493 1.12 . . . . 74.420000000000002 109.246 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.662 ' O ' HG12 ' A' ' 129' ' ' VAL . 63.1 t -89.11 14.38 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.509 1.131 . . . . 64.239999999999995 109.281 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -111.55 140.06 46.47 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.464 1.102 . . . . 75.219999999999999 109.272 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . 0.484 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 39.29 77.78 0.06 OUTLIER Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.485 1.116 . . . . 23.550000000000001 110.98 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -163.48 167.02 22.04 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.475 0.75 . . . . 75.219999999999999 110.017 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.76 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -95.67 -36.0 11.38 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.549 1.156 . . . . 71.430000000000007 109.285 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.76 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.1 m-90 -161.57 170.13 20.42 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.505 1.128 . . . . 74.319999999999993 108.039 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 56.2 p -138.78 138.19 37.37 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.573 1.171 . . . . 63.030000000000001 110.41 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.744 ' O ' HD22 ' A' ' 137' ' ' LEU . 39.2 mm -84.35 140.97 15.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.491 1.119 . . . . 63.549999999999997 109.28 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.744 HD22 ' O ' ' A' ' 136' ' ' ILE . 3.3 mm? -128.61 86.97 2.51 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.509 1.131 . . . . 53.530000000000001 109.323 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 1.053 ' CD2' ' HB2' ' A' ' 93' ' ' ALA . 0.3 OUTLIER -62.74 88.06 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.48 1.112 . . . . 74.530000000000001 109.306 -179.99 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.709 HD22 ' O ' ' A' ' 137' ' ' LEU . 0.6 OUTLIER -61.81 116.64 4.99 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.503 1.127 . . . . 64.019999999999996 109.246 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . 0.628 HG23 ' OD1' ' A' ' 178' ' ' ASN . 7.4 m -136.41 169.69 17.26 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.491 1.12 . . . . 71.530000000000001 110.381 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -64.25 -39.74 94.58 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.559 1.162 . . . . 75.519999999999996 110.275 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . 0.441 ' CG ' ' N ' ' A' ' 143' ' ' PHE . 7.9 p30 -89.54 -46.74 8.46 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.45 1.094 . . . . 73.329999999999998 109.279 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.783 ' CE1' HG21 ' A' ' 147' ' ' THR . 7.1 t80 -53.07 -25.94 14.47 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.481 1.113 . . . . 64.129999999999995 110.951 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.705 HD13 ' C ' ' A' ' 144' ' ' LEU . 1.8 tm? -54.46 -68.11 0.21 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.54 1.15 . . . . 75.349999999999994 109.319 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.459 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 28.5 mmm180 -65.94 -14.33 61.38 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.415 1.072 . . . . 61.409999999999997 110.313 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -70.69 -51.87 24.82 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.511 1.132 . . . . 74.230000000000004 109.349 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.783 HG21 ' CE1' ' A' ' 143' ' ' PHE . 4.3 p -92.75 -52.99 4.35 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.513 1.133 . . . . 74.310000000000002 110.422 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.568 ' CH2' ' HB2' ' A' ' 186' ' ' PRO . 20.5 t-105 -41.87 -47.4 4.22 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.565 1.165 . . . . 71.25 107.977 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' CYS . . . . . 0.459 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 7.4 t -69.85 -44.54 69.66 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.436 1.085 . . . . 52.240000000000002 108.322 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' ASN . . . . . 0.643 ' CG ' HD22 ' A' ' 125' ' ' LEU . 34.2 t-20 -51.7 -29.52 18.63 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.465 1.103 . . . . 73.349999999999994 109.302 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.564 ' CD1' ' HG ' ' A' ' 157' ' ' LEU . 8.2 m-30 -77.6 -44.94 26.73 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.472 1.108 . . . . 75.319999999999993 111.005 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 42.2 tp60 -41.46 -39.73 1.59 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.437 1.086 . . . . 74.150000000000006 110.256 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -80.78 -34.3 34.27 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.453 1.096 . . . . 74.420000000000002 110.959 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.441 ' N ' ' O ' ' A' ' 151' ' ' PHE . 3.3 m-85 -117.05 87.52 2.72 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.558 1.161 . . . . 75.230000000000004 111.015 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 2.3 t -60.14 -25.17 65.3 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.451 1.095 . . . . 63.100000000000001 110.368 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 54.7 p -58.57 -16.88 17.62 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 124.527 1.142 . . . . 63.32 109.998 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.564 ' HG ' ' CD1' ' A' ' 151' ' ' PHE . 0.2 OUTLIER -75.85 -51.73 11.91 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.451 1.094 . . . . 73.519999999999996 109.316 -179.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' MET . . . . . 0.487 ' CE ' HG21 ' A' ' 161' ' ' VAL . 5.6 mmt -50.04 -32.99 16.79 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.436 1.085 . . . . 63.420000000000002 110.962 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -64.16 -38.6 91.63 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.524 1.14 . . . . 74.450000000000003 109.312 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' SER . . . . . 0.663 ' HB2' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -66.19 -33.1 75.0 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.555 1.159 . . . . 73.430000000000007 109.948 -179.962 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . 0.859 ' O ' HD13 ' A' ' 192' ' ' ILE . 48.3 t -59.09 -18.16 13.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.425 1.078 . . . . 61.409999999999997 109.358 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 30.8 m-20 -77.95 -27.71 49.35 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.46 1.1 . . . . 64.109999999999999 109.308 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.559 ' HE ' HD11 ' A' ' 171' ' ' ILE . 21.3 mtp180 68.78 29.06 5.3 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.464 1.102 . . . . 71.140000000000001 110.253 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . 0.404 ' O ' ' O ' ' A' ' 163' ' ' ARG . 8.8 mt-30 -50.75 -177.84 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.527 1.142 . . . . 72.230000000000004 110.315 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -78.93 70.64 5.3 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.577 1.173 . . . . 75.310000000000002 109.567 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.681 ' HA ' HG21 ' A' ' 221' ' ' ILE . 0.1 OUTLIER -123.92 177.47 5.75 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.496 1.122 . . . . 74.219999999999999 109.353 179.974 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 167' ' ' TYR . . . . . . . . . . . . . 49.9 p90 -90.02 29.85 1.16 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.489 1.118 . . . . 75.219999999999999 110.957 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . 0.467 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 3.5 p30 -169.56 108.8 0.42 Allowed 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.435 1.085 . . . . 70.239999999999995 109.29 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.474 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 6.3 m -102.04 164.04 11.92 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.436 1.085 . . . . 73.420000000000002 110.003 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.838 ' O ' HD12 ' A' ' 171' ' ' ILE . 76.0 t -130.5 125.03 58.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 124.459 1.099 . . . . 53.32 109.273 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.838 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.5 mp -131.48 113.75 15.61 Favored Pre-proline 0 C--N 1.326 -0.445 0 O-C-N 124.475 1.109 . . . . 61.039999999999999 109.237 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . 0.664 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.04 111.72 3.39 Favored 'Trans proline' 0 C--N 1.36 1.139 0 O-C-N 124.539 1.81 . . . . 64.430000000000007 110.975 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . 0.823 ' HE1' HG21 ' A' ' 96' ' ' VAL . 4.5 ttt -92.74 152.08 19.69 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.531 1.144 . . . . 72.019999999999996 111.004 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . 0.421 ' N ' ' HG2' ' A' ' 173' ' ' MET . 21.2 mtp180 -110.85 116.66 51.7 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.546 1.154 . . . . 74.510000000000005 110.239 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 175' ' ' PRO . . . . . 0.419 ' C ' HD23 ' A' ' 176' ' ' LEU . 18.3 Cg_endo -75.01 164.61 33.01 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.474 1.776 . . . . 74.439999999999998 111.006 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . 0.879 HD22 ' HB3' ' A' ' 198' ' ' GLU . 0.1 OUTLIER -104.02 -44.4 5.02 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.597 1.186 . . . . 72.200000000000003 109.264 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -72.13 -20.81 61.56 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.409 1.068 . . . . 73.25 109.266 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 178' ' ' ASN . . . . . 0.628 ' OD1' HG23 ' A' ' 140' ' ' THR . 0.6 OUTLIER -110.2 107.49 58.64 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.539 1.149 . . . . 71.409999999999997 109.293 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 118.12 5.15 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.549 1.815 . . . . 72.439999999999998 111.041 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.576 HD13 ' HB2' ' A' ' 184' ' ' ARG . 1.1 tm? -140.42 96.56 7.78 Favored Pre-proline 0 C--N 1.325 -0.475 0 O-C-N 124.505 1.128 . . . . 73.430000000000007 109.28 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.95 168.23 25.3 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.47 1.774 . . . . 72.219999999999999 111.025 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -56.48 -27.69 57.7 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.435 1.084 . . . . 72.129999999999995 110.302 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -61.35 -26.56 67.9 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 124.474 1.109 . . . . 64.400000000000006 110.262 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 184' ' ' ARG . . . . . 0.576 ' HB2' HD13 ' A' ' 180' ' ' LEU . 69.0 mmt-85 -96.4 -24.51 16.1 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.455 1.097 . . . . 60.140000000000001 110.288 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 185' ' ' THR . . . . . 0.507 HG22 ' HD2' ' A' ' 186' ' ' PRO . 18.9 m -74.77 143.94 79.25 Favored Pre-proline 0 C--N 1.325 -0.468 0 O-C-N 124.436 1.085 . . . . 72.129999999999995 110.396 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 186' ' ' PRO . . . . . 0.743 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -74.94 155.41 43.21 Favored 'Trans proline' 0 C--N 1.36 1.142 0 O-C-N 124.476 1.777 . . . . 75.129999999999995 110.983 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 187' ' ' PHE . . . . . 0.498 ' O ' ' CG2' ' A' ' 191' ' ' THR . 17.1 p90 -69.76 -6.89 35.15 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.461 1.101 . . . . 75.310000000000002 111.035 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . 0.544 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -94.37 -52.96 4.11 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.491 1.12 . . . . 75.430000000000007 109.289 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.743 HD12 ' CG ' ' A' ' 186' ' ' PRO . 51.5 mt -68.45 -42.08 79.31 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.378 1.049 . . . . 74.120000000000005 109.268 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 190' ' ' GLN . . . . . 0.416 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.3 pt20 -64.48 -10.09 23.03 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.485 1.116 . . . . 73.230000000000004 110.327 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 191' ' ' THR . . . . . 0.498 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 39.9 p -115.08 11.12 16.32 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.545 1.153 . . . . 64.150000000000006 110.343 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.859 HD13 ' O ' ' A' ' 161' ' ' VAL . 4.0 mt -125.46 148.82 29.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.457 1.098 . . . . 74.209999999999994 109.255 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 193' ' ' ASN . . . . . 0.663 ' OD1' HD11 ' A' ' 209' ' ' ILE . 54.5 t-20 -47.55 102.64 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.392 1.058 . . . . 60.439999999999998 109.254 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . 0.664 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -99.54 129.84 45.74 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.499 1.124 . . . . 65.409999999999997 109.327 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 195' ' ' LEU . . . . . 0.83 HD23 HD12 ' A' ' 209' ' ' ILE . 0.6 OUTLIER -66.58 136.9 56.3 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.49 1.119 . . . . 73.450000000000003 109.316 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . 0.448 ' CB ' ' HB3' ' A' ' 199' ' ' SER . 31.3 mt-10 -114.93 131.48 56.87 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.463 1.102 . . . . 73.109999999999999 110.325 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.751 ' HG2' HD11 ' A' ' 176' ' ' LEU . 3.4 tt0 -109.47 -23.19 11.64 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.492 1.12 . . . . 61.409999999999997 110.321 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . 0.879 ' HB3' HD22 ' A' ' 176' ' ' LEU . 0.0 OUTLIER -107.09 8.44 30.22 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.483 1.115 . . . . 72.150000000000006 110.269 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . 0.448 ' HB3' ' CB ' ' A' ' 196' ' ' GLU . 28.6 t -99.91 163.49 12.43 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.545 1.153 . . . . 75.040000000000006 109.982 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 200' ' ' ARG . . . . . 0.431 ' HA ' ' NE ' ' A' ' 200' ' ' ARG . 5.8 tpm_? -75.81 -20.83 57.88 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.477 1.111 . . . . 74.019999999999996 110.301 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -99.88 26.26 25.12 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.53 1.143 . . . . 70.409999999999997 111.045 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 202' ' ' PHE . . . . . 0.81 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.2 OUTLIER -60.87 -43.9 93.08 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.483 0.755 . . . . 71.010000000000005 110.983 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 203' ' ' PRO . . . . . 0.616 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -74.96 -37.89 1.85 Allowed 'Trans proline' 0 C--N 1.361 1.19 0 O-C-N 124.447 1.761 . . . . 61.509999999999998 110.944 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.04 -57.99 9.47 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.558 1.161 . . . . 65.420000000000002 110.431 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 205' ' ' GLN . . . . . 0.441 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 1.1 mt-30 -59.57 -45.64 91.25 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.45 1.094 . . . . 74.310000000000002 110.293 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 206' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 202' ' ' PHE . 55.0 t -56.48 -33.8 39.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 O-C-N 124.477 1.11 . . . . 74.430000000000007 109.269 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -73.57 -60.0 2.45 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.496 1.123 . . . . 64.5 110.241 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 80.5 mtt-85 -56.06 -63.38 1.2 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.538 1.149 . . . . 74.150000000000006 110.332 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 209' ' ' ILE . . . . . 0.83 HD12 HD23 ' A' ' 195' ' ' LEU . 25.7 mt -46.45 -62.46 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.554 1.159 . . . . 72.209999999999994 109.339 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 210' ' ' PHE . . . . . 0.781 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.8 m-85 -97.09 68.8 2.29 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.502 1.126 . . . . 73.239999999999995 111.034 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 211' ' ' GLN . . . . . 0.553 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -110.79 144.52 39.65 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.497 1.123 . . . . 74.109999999999999 110.299 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 215' ' ' TYR . 39.6 tt0 -49.21 -55.16 13.41 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.479 1.112 . . . . 64.420000000000002 110.355 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.26 -23.96 1.04 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.452 1.095 . . . . 33.310000000000002 110.005 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.553 HG23 ' HG2' ' A' ' 211' ' ' GLN . 40.6 t -96.25 -29.19 3.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.412 1.07 . . . . 63.520000000000003 109.237 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 215' ' ' TYR . . . . . 0.45 ' N ' ' O ' ' A' ' 212' ' ' GLU . 5.8 t80 -62.98 -32.42 73.76 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.469 1.106 . . . . 73.310000000000002 110.966 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 45.6 mmtt -63.33 -46.95 84.24 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.51 1.131 . . . . 74.409999999999997 109.27 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 217' ' ' THR . . . . . 0.902 HG22 HD11 ' A' ' 221' ' ' ILE . 87.9 m -53.49 -66.45 0.39 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.457 1.098 . . . . 63.140000000000001 110.372 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 218' ' ' GLN . . . . . 0.501 ' HA ' HD12 ' A' ' 221' ' ' ILE . 12.5 mp0 -55.5 -18.54 7.43 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.451 1.094 . . . . 74.420000000000002 110.23 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 219' ' ' GLN . . . . . 0.438 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 23.8 tp60 -84.62 -33.31 23.33 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 124.471 1.107 . . . . 75.209999999999994 110.28 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 220' ' ' THR . . . . . 0.461 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 3.0 m -82.42 -28.93 31.06 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.508 1.13 . . . . 43.310000000000002 110.458 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 221' ' ' ILE . . . . . 0.902 HD11 HG22 ' A' ' 217' ' ' THR . 8.9 mt -75.07 -34.67 32.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.462 1.101 . . . . 53.119999999999997 109.323 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 222' ' ' TRP . . . . . 0.484 ' CD1' ' HA2' ' A' ' 131' ' ' GLY . 35.8 t90 -71.51 -57.84 4.05 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.492 1.12 . . . . 72.319999999999993 107.985 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.461 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -52.74 -24.09 8.06 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.522 1.139 . . . . 74.209999999999994 109.239 179.989 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 . . . . . 0 C--N 1.325 -0.482 0 O-C-N 124.501 1.126 . . . . 62.119999999999997 110.373 179.977 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.59 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 7.3 p . . . . . 0 N--CA 1.453 -0.296 0 N-CA-C 109.262 -0.644 . . . . 74.239999999999995 109.262 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.436 ' N ' HG22 ' A' ' 77' ' ' VAL . 31.9 t80 -86.83 18.25 3.58 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.473 1.108 . . . . 74.239999999999995 110.969 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.413 ' HB2' HG13 ' A' ' 77' ' ' VAL . 3.9 tp -39.31 157.33 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.498 1.124 . . . . 74.420000000000002 109.318 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.852 ' HD3' HG22 ' A' ' 106' ' ' ILE . 4.9 ptmm? -104.69 -51.59 3.04 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.472 1.108 . . . . 71.420000000000002 109.335 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.603 ' HE2' HD11 ' A' ' 136' ' ' ILE . 0.2 OUTLIER -167.51 142.83 3.94 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.479 1.112 . . . . 73.310000000000002 111.043 179.99 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.57 HG22 ' H ' ' A' ' 83' ' ' ILE . 7.4 p -97.98 172.7 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.51 1.131 . . . . 64.340000000000003 109.272 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.883 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.3 mp -129.55 96.87 3.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.481 1.113 . . . . 71.5 109.288 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.465 ' HG ' ' CB ' ' A' ' 128' ' ' ALA . 5.5 mt -70.41 117.62 12.18 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.537 1.148 . . . . 74.519999999999996 109.317 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.765 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -142.22 174.57 10.49 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.559 1.162 . . . . 73.519999999999996 109.622 179.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.565 ' HB2' ' CD1' ' A' ' 143' ' ' PHE . . . -117.0 149.55 40.07 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.492 1.12 . . . . 63.549999999999997 109.282 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.08 -21.34 1.83 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.459 1.099 . . . . 73.420000000000002 110.28 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -66.66 -45.87 77.52 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.543 1.152 . . . . 60.520000000000003 109.304 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.409 ' O ' HD23 ' A' ' 138' ' ' LEU . 5.9 t0 -132.0 44.22 2.93 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.453 1.096 . . . . 74.519999999999996 109.328 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.619 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -74.73 -23.83 58.63 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.466 1.104 . . . . 73.140000000000001 110.44 179.955 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -76.3 -39.04 55.18 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.464 1.103 . . . . 75.099999999999994 109.264 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.409 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 0.1 OUTLIER -61.57 -50.54 72.2 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.482 1.114 . . . . 71.219999999999999 110.285 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 1.047 ' HB2' ' CD2' ' A' ' 138' ' ' LEU . . . -59.71 -27.95 66.9 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.569 1.168 . . . . 63.310000000000002 109.348 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.935 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -82.87 -33.38 27.02 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.524 1.14 . . . . 61.310000000000002 109.323 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.624 ' N ' HD13 ' A' ' 94' ' ' LEU . 9.3 tpp180 -57.16 -28.51 62.82 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.517 1.136 . . . . 72.329999999999998 110.368 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.842 HG21 ' HE1' ' A' ' 173' ' ' MET . 1.7 t -84.48 -65.35 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.435 1.085 . . . . 75.519999999999996 109.324 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.587 ' HA ' HD12 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -39.99 -28.12 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.538 1.149 . . . . 63.119999999999997 110.319 179.993 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.442 ' N ' ' O ' ' A' ' 96' ' ' VAL . 2.1 t-20 -69.85 -52.67 22.91 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.504 1.128 . . . . 74.129999999999995 109.252 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.822 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -71.03 -21.58 62.25 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.549 1.155 . . . . 71.340000000000003 109.355 179.981 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.822 ' N ' HD23 ' A' ' 99' ' ' LEU . 25.4 mt -60.15 -58.23 9.44 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.508 1.13 . . . . 70.099999999999994 109.277 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . 0.477 ' HB2' ' CE ' ' A' ' 107' ' ' LYS . 5.6 pt20 -75.28 59.13 1.0 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.534 1.146 . . . . 64.230000000000004 110.336 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -178.2 -64.06 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.439 1.087 . . . . 53.310000000000002 109.241 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -49.73 -50.68 43.19 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.491 1.119 . . . . 73.420000000000002 109.324 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.565 ' CZ ' HG11 ' A' ' 206' ' ' VAL . 2.6 m-85 -114.42 -22.47 9.84 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.494 1.121 . . . . 64.140000000000001 110.997 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.49 44.7 3.93 Favored Glycine 0 CA--C 1.53 1.021 0 O-C-N 124.524 1.14 . . . . 44.409999999999997 110.987 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.852 HG22 ' HD3' ' A' ' 80' ' ' LYS . 3.6 mm -86.97 87.66 2.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.476 0.75 . . . . 73.209999999999994 109.323 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.51 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -132.36 158.5 75.46 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.555 1.159 . . . . 70.140000000000001 109.28 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.51 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.01 167.06 81.6 Favored 'Cis proline' 0 C--N 1.36 1.175 0 C-N-CA 121.033 -2.486 . . . . 73.420000000000002 110.979 0.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.75 129.07 6.06 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.547 1.155 . . . . 74.409999999999997 110.989 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.4 HD11 ' C ' ' A' ' 114' ' ' GLU . 0.0 OUTLIER -148.05 132.4 9.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.502 0.766 . . . . 72.040000000000006 109.318 179.989 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . 0.78 HD13 ' HB2' ' A' ' 94' ' ' LEU . 44.2 pt -91.83 -178.35 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.457 1.098 . . . . 65.200000000000003 109.318 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -81.53 -19.1 42.84 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.522 1.139 . . . . 70.549999999999997 111.006 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -91.54 -3.05 56.92 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.455 1.097 . . . . 74.129999999999995 109.332 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.4 ' C ' HD11 ' A' ' 110' ' ' ILE . 9.7 mm-40 -109.79 -26.75 9.66 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.465 1.103 . . . . 52.25 110.314 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 23.4 tpp -39.93 111.06 0.69 Allowed Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.571 1.169 . . . . 74.299999999999997 111.017 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 C--N 1.36 1.16 0 O-C-N 124.479 1.779 . . . . 75.129999999999995 111.021 179.98 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.293 0 N-CA-C 109.263 -0.643 . . . . 42.5 109.263 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.438 ' O ' ' N ' ' A' ' 129' ' ' VAL . 2.4 t70 -64.44 -22.24 66.9 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.526 1.141 . . . . 75.230000000000004 109.29 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -49.91 -23.48 1.98 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.501 1.126 . . . . 75.120000000000005 109.363 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.465 ' CB ' ' HG ' ' A' ' 84' ' ' LEU . . . -89.3 -33.16 17.03 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.469 1.105 . . . . 62.130000000000003 109.261 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.739 ' O ' HG12 ' A' ' 129' ' ' VAL . 73.6 t -92.94 30.48 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.499 1.124 . . . . 65.420000000000002 109.299 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -135.29 118.89 16.99 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.544 1.152 . . . . 74.329999999999998 109.234 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . 0.561 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 66.59 62.97 4.17 Favored Glycine 0 CA--C 1.531 1.033 0 O-C-N 124.51 1.131 . . . . 73.209999999999994 111.009 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -154.92 -176.87 6.15 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.552 0.796 . . . . 75.540000000000006 110.068 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.746 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -113.23 -32.22 6.36 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.438 1.086 . . . . 73.299999999999997 109.235 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.746 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.4 m-90 -161.48 160.2 28.93 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.489 1.118 . . . . 73.239999999999995 107.997 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.9 p -132.82 131.49 41.1 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.487 1.117 . . . . 63.450000000000003 110.428 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.883 ' HB ' HG23 ' A' ' 83' ' ' ILE . 9.8 mm -84.6 138.64 18.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.524 1.14 . . . . 74.030000000000001 109.334 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.766 HD11 HG13 ' A' ' 170' ' ' VAL . 4.1 mt -130.34 94.5 3.68 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.477 1.111 . . . . 62.229999999999997 109.341 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 1.047 ' CD2' ' HB2' ' A' ' 93' ' ' ALA . 0.5 OUTLIER -62.55 99.63 0.15 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.528 1.142 . . . . 64.230000000000004 109.32 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.583 HD21 ' HB2' ' A' ' 172' ' ' PRO . 0.4 OUTLIER -63.55 116.35 5.54 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.43 1.081 . . . . 64.409999999999997 109.334 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . 0.588 HG22 ' H ' ' A' ' 141' ' ' GLU . 5.8 m -139.4 179.69 6.4 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.559 1.162 . . . . 72.519999999999996 110.397 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . 0.588 ' H ' HG22 ' A' ' 140' ' ' THR . 5.5 mp0 -84.87 -36.67 21.39 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.482 1.114 . . . . 74.150000000000006 110.227 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -88.44 -32.82 18.09 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.494 1.121 . . . . 74.109999999999999 109.308 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.739 ' O ' HG23 ' A' ' 147' ' ' THR . 51.1 t80 -72.44 -36.75 68.63 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.437 1.086 . . . . 72.329999999999998 110.926 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.711 HD13 ' N ' ' A' ' 145' ' ' ARG . 1.5 tm? -54.7 -67.49 0.26 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.533 1.145 . . . . 71.219999999999999 109.32 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.711 ' N ' HD13 ' A' ' 144' ' ' LEU . 0.0 OUTLIER -55.39 -18.4 6.7 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.551 1.157 . . . . 73.420000000000002 110.312 -179.975 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.69 -32.93 25.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.466 1.104 . . . . 64.430000000000007 109.321 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.739 HG23 ' O ' ' A' ' 143' ' ' PHE . 80.8 p -97.39 -7.02 32.76 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.552 1.158 . . . . 44.340000000000003 110.388 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.549 ' CH2' ' HB2' ' A' ' 186' ' ' PRO . 0.1 OUTLIER -94.24 -26.55 16.59 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.951 -1.129 . . . . 74.129999999999995 107.951 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 51.6 t -95.62 -26.39 15.77 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.488 1.117 . . . . 63.439999999999998 108.316 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 9.6 m-20 -77.92 -42.79 31.97 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.506 1.129 . . . . 72.150000000000006 109.347 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.71 ' CE2' HD12 ' A' ' 157' ' ' LEU . 4.0 m-85 -69.39 -51.08 40.11 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 72.450000000000003 110.981 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -46.6 -47.78 19.84 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.518 1.136 . . . . 73.349999999999994 110.266 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -68.83 -22.66 64.22 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.54 1.15 . . . . 72.129999999999995 110.983 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -118.9 91.94 3.68 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.464 1.103 . . . . 73.030000000000001 110.949 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.6 t -60.87 -15.65 32.93 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.537 1.148 . . . . 44.039999999999999 110.372 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 93.0 p -69.86 -20.7 63.4 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.449 1.093 . . . . 70.140000000000001 109.966 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.748 ' O ' HG23 ' A' ' 161' ' ' VAL . 0.0 OUTLIER -86.27 -37.17 18.84 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.563 1.164 . . . . 73.010000000000005 109.279 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' MET . . . . . 0.535 ' CE ' HG11 ' A' ' 161' ' ' VAL . 18.4 mmt -62.95 -11.58 19.67 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.517 1.136 . . . . 71.510000000000005 111.001 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -62.47 -68.48 0.33 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.513 1.133 . . . . 71.200000000000003 109.29 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' SER . . . . . 0.467 ' HB2' ' CG2' ' A' ' 170' ' ' VAL . 0.0 OUTLIER -59.19 -34.21 71.86 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.506 1.129 . . . . 74.510000000000005 110.042 179.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . 0.813 ' CG1' ' HB1' ' A' ' 188' ' ' ALA . 87.5 t -55.68 -18.99 5.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.516 1.135 . . . . 71.340000000000003 109.357 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -92.03 35.7 0.98 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.555 1.16 . . . . 74.219999999999999 109.278 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.466 ' CD ' ' CG1' ' A' ' 192' ' ' ILE . 0.1 OUTLIER 40.18 64.31 0.93 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.494 1.121 . . . . 72.299999999999997 110.294 -179.998 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -96.28 -174.78 3.16 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.479 1.112 . . . . 73.329999999999998 110.293 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 31.9 p80 -141.72 55.75 1.5 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.479 1.112 . . . . 73.299999999999997 109.598 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.2 tptm -90.89 -175.46 4.36 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.497 1.123 . . . . 74.129999999999995 109.272 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 167' ' ' TYR . . . . . 1.164 ' CD1' HG22 ' A' ' 221' ' ' ILE . 10.8 m-85 -37.65 -46.86 0.91 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.435 1.084 . . . . 74.349999999999994 110.893 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . 0.435 ' ND2' ' O ' ' A' ' 129' ' ' VAL . 0.6 OUTLIER -112.58 164.11 13.71 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.467 1.104 . . . . 74.439999999999998 109.305 -179.99 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.467 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 5.9 m -124.66 175.11 7.42 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.515 1.135 . . . . 72.409999999999997 110.057 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.803 ' O ' HD12 ' A' ' 171' ' ' ILE . 2.1 t -133.88 122.44 42.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 O-C-N 124.491 1.119 . . . . 75.430000000000007 109.319 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.907 HG12 HG21 ' A' ' 209' ' ' ILE . 1.4 mp -132.72 103.24 13.36 Favored Pre-proline 0 C--N 1.324 -0.506 0 O-C-N 124.583 1.177 . . . . 72.439999999999998 109.254 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . 0.583 ' HB2' HD21 ' A' ' 139' ' ' LEU . 18.3 Cg_endo -74.99 112.65 3.61 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.51 1.795 . . . . 72.109999999999999 111.025 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . 0.842 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.5 ttt -92.92 157.55 16.29 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.443 1.089 . . . . 73.150000000000006 110.961 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . 0.439 ' N ' ' HG2' ' A' ' 173' ' ' MET . 1.4 mpt_? -113.54 120.26 39.96 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.511 1.132 . . . . 75.340000000000003 110.288 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 175' ' ' PRO . . . . . 0.474 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.3 Cg_endo -75.01 154.47 42.46 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.455 1.766 . . . . 70.5 110.963 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . 0.907 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -88.22 -43.21 11.77 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.528 1.143 . . . . 74.219999999999999 109.249 -179.996 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -72.23 -27.15 62.34 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.461 1.101 . . . . 72.310000000000002 109.296 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 178' ' ' ASN . . . . . 0.474 ' CB ' ' HG2' ' A' ' 175' ' ' PRO . 9.8 m-20 -110.33 99.39 40.15 Favored Pre-proline 0 C--N 1.325 -0.483 0 O-C-N 124.484 1.115 . . . . 74.319999999999993 109.279 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -74.97 124.61 8.77 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.493 1.786 . . . . 74.129999999999995 111.058 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.487 ' HA ' HD22 ' A' ' 180' ' ' LEU . 0.4 OUTLIER -136.0 96.34 13.02 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.531 1.145 . . . . 71.010000000000005 109.304 -179.983 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -75.07 171.7 17.79 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.481 1.78 . . . . 73.040000000000006 110.998 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 17.2 ptt180 -59.37 -32.27 69.97 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 65.519999999999996 110.255 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -60.74 -14.82 23.58 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.487 1.117 . . . . 75.299999999999997 110.328 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 184' ' ' ARG . . . . . 0.422 ' HB2' HD13 ' A' ' 180' ' ' LEU . 30.8 mmt180 -113.79 -28.61 7.37 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.48 1.113 . . . . 72.109999999999999 110.232 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 185' ' ' THR . . . . . . . . . . . . . 61.0 m -66.51 139.47 96.1 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.49 1.119 . . . . 71.239999999999995 110.422 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 186' ' ' PRO . . . . . 0.581 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -74.96 145.4 31.53 Favored 'Trans proline' 0 C--N 1.36 1.132 0 O-C-N 124.488 1.783 . . . . 52.420000000000002 110.997 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 187' ' ' PHE . . . . . 0.479 ' O ' ' CD1' ' A' ' 187' ' ' PHE . 5.2 t80 -59.73 -13.67 11.05 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.512 1.133 . . . . 72.230000000000004 110.985 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . 0.813 ' HB1' ' CG1' ' A' ' 161' ' ' VAL . . . -86.92 -53.77 4.71 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.509 1.131 . . . . 74.430000000000007 109.301 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.928 ' HA ' HD12 ' A' ' 192' ' ' ILE . 23.9 mt -76.57 -11.8 59.92 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.41 1.068 . . . . 74.5 109.261 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 190' ' ' GLN . . . . . 0.499 ' O ' ' CG ' ' A' ' 190' ' ' GLN . 4.7 tt0 -86.81 -0.78 57.03 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.494 1.121 . . . . 53.140000000000001 110.283 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 191' ' ' THR . . . . . 0.401 ' OG1' ' O ' ' A' ' 188' ' ' ALA . 3.4 p -115.72 -30.7 6.05 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.517 1.135 . . . . 74.540000000000006 110.426 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.928 HD12 ' HA ' ' A' ' 189' ' ' LEU . 7.2 mt -65.1 169.36 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.507 1.129 . . . . 74.230000000000004 109.3 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 193' ' ' ASN . . . . . 0.535 ' N ' HG22 ' A' ' 192' ' ' ILE . 5.7 m-20 -76.17 57.32 1.11 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.497 1.123 . . . . 54.439999999999998 109.32 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . 0.477 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -43.07 142.08 1.03 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.451 1.094 . . . . 72.299999999999997 109.307 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 195' ' ' LEU . . . . . 0.594 HD12 ' CE ' ' A' ' 173' ' ' MET . 0.4 OUTLIER -88.9 126.1 35.24 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.499 1.125 . . . . 63.420000000000002 109.297 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . 0.404 ' HB3' ' CB ' ' A' ' 199' ' ' SER . 38.7 mt-10 -101.44 130.57 47.7 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.549 1.156 . . . . 72.420000000000002 110.326 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.907 ' HG3' HD21 ' A' ' 176' ' ' LEU . 8.8 tp10 -113.61 -23.94 9.49 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.517 1.135 . . . . 75.129999999999995 110.311 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -103.06 4.03 36.72 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.498 1.124 . . . . 72.010000000000005 110.296 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . 0.404 ' CB ' ' HB3' ' A' ' 196' ' ' GLU . 14.7 t -97.59 174.9 6.42 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.489 1.118 . . . . 70.349999999999994 109.98 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -70.64 -60.36 2.3 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.515 1.134 . . . . 73.200000000000003 110.244 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -78.82 51.34 3.76 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.459 1.099 . . . . 71.409999999999997 110.976 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 202' ' ' PHE . . . . . 0.614 ' C ' ' CD1' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -78.39 -47.27 2.0 Allowed Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.526 0.78 . . . . 74.150000000000006 110.972 -179.993 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 203' ' ' PRO . . . . . 0.654 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.3 Cg_endo -75.02 -27.44 9.97 Favored 'Trans proline' 0 C--N 1.36 1.145 0 O-C-N 124.444 1.76 . . . . 71.230000000000004 110.99 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.51 -50.77 71.38 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.615 1.197 . . . . 72.540000000000006 110.438 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 205' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 0.2 OUTLIER -58.75 -63.18 1.38 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.518 1.136 . . . . 75.120000000000005 110.31 -179.989 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 206' ' ' VAL . . . . . 0.776 HG21 HD22 ' A' ' 100' ' ' LEU . 2.7 p -38.82 -33.86 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.495 1.122 . . . . 71.200000000000003 109.304 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 207' ' ' GLU . . . . . 0.414 ' N ' ' C ' ' A' ' 205' ' ' GLN . 1.0 OUTLIER -76.39 -65.68 0.9 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.541 1.151 . . . . 71.510000000000005 110.283 -179.961 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 82.9 mtt-85 -47.82 -58.07 4.82 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.53 1.144 . . . . 71.540000000000006 110.276 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 209' ' ' ILE . . . . . 0.907 HG21 HG12 ' A' ' 171' ' ' ILE . 3.3 mt -52.56 -70.75 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.481 1.113 . . . . 73.109999999999999 109.341 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 210' ' ' PHE . . . . . 0.607 ' CD2' HG23 ' A' ' 206' ' ' VAL . 0.7 OUTLIER -84.9 65.28 9.11 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.534 1.146 . . . . 72.319999999999993 111.045 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 211' ' ' GLN . . . . . 0.447 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.2 OUTLIER -110.59 146.65 35.73 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.447 1.092 . . . . 65.109999999999999 110.262 -179.968 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' A' ' 215' ' ' TYR . 60.7 tt0 -48.33 -55.39 10.8 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 73.430000000000007 110.334 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.3 m -48.6 -25.23 1.64 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.544 1.152 . . . . 54.329999999999998 109.995 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.447 HG23 ' HG2' ' A' ' 211' ' ' GLN . 32.8 t -96.21 -26.35 4.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.485 1.116 . . . . 70.200000000000003 109.304 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 215' ' ' TYR . . . . . 0.455 ' N ' ' O ' ' A' ' 212' ' ' GLU . 8.5 t80 -69.27 -33.83 73.82 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.519 1.137 . . . . 75.430000000000007 110.987 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . 0.442 ' O ' ' N ' ' A' ' 220' ' ' THR . 4.2 mmtp -52.18 -54.84 25.92 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.486 1.116 . . . . 71.209999999999994 109.265 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 217' ' ' THR . . . . . 0.485 ' CG2' HD11 ' A' ' 221' ' ' ILE . 1.3 m -54.82 -65.19 0.62 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.478 1.111 . . . . 61.350000000000001 110.38 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 218' ' ' GLN . . . . . 0.657 ' HA ' HD12 ' A' ' 221' ' ' ILE . 3.2 mp0 -48.87 -28.35 3.7 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.472 1.107 . . . . 71.030000000000001 110.284 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 219' ' ' GLN . . . . . 0.417 ' NE2' ' HB2' ' A' ' 223' ' ' LYS . 39.1 tp60 -84.68 -27.75 26.85 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.483 1.115 . . . . 73.230000000000004 110.328 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 220' ' ' THR . . . . . 0.452 ' N ' ' O ' ' A' ' 217' ' ' THR . 1.0 OUTLIER -79.96 -17.41 53.03 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.529 1.143 . . . . 64.049999999999997 110.465 179.923 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 221' ' ' ILE . . . . . 1.164 HG22 ' CD1' ' A' ' 167' ' ' TYR . 7.4 mt -89.21 -45.58 15.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.559 1.162 . . . . 72.5 109.329 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 222' ' ' TRP . . . . . 0.59 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 41.7 t90 -68.57 -18.74 64.4 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.573 1.171 . . . . 72.25 107.982 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.417 ' HB2' ' NE2' ' A' ' 219' ' ' GLN . 0.0 OUTLIER -90.76 -24.12 20.46 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.448 1.093 . . . . 62.049999999999997 109.271 -179.98 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 . . . . . 0 C--N 1.324 -0.514 0 O-C-N 124.495 1.122 . . . . 72.239999999999995 110.294 179.998 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.61 ' O ' ' CZ2' ' A' ' 222' ' ' TRP . 3.2 p . . . . . 0 N--CA 1.454 -0.268 0 N-CA-C 109.257 -0.646 . . . . 70.439999999999998 109.257 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.488 ' N ' HG22 ' A' ' 77' ' ' VAL . 5.8 t80 -87.75 26.9 1.22 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.511 1.132 . . . . 75.450000000000003 110.969 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.634 HD11 HG22 ' A' ' 110' ' ' ILE . 4.5 tp -41.03 160.89 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.538 1.149 . . . . 73.340000000000003 109.309 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.722 ' HD3' HG22 ' A' ' 106' ' ' ILE . 6.4 ptmt -111.9 -47.22 3.15 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.529 1.143 . . . . 71.329999999999998 109.336 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.664 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.2 OUTLIER -167.32 139.58 3.31 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.516 1.135 . . . . 74.019999999999996 110.998 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.737 ' CG1' HG22 ' A' ' 135' ' ' THR . 7.3 p -96.72 165.42 2.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.544 1.152 . . . . 64.349999999999994 109.322 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.822 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.3 mp -126.01 97.2 4.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.569 1.168 . . . . 63.450000000000003 109.283 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.697 HD11 ' CB ' ' A' ' 128' ' ' ALA . 10.9 mt -70.88 117.37 12.3 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.525 1.14 . . . . 74.200000000000003 109.341 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.671 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -138.66 174.26 10.72 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.449 1.093 . . . . 70.099999999999994 109.646 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.48 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -124.83 149.08 47.83 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.499 1.125 . . . . 54.530000000000001 109.306 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -44.6 -27.05 0.43 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.436 1.085 . . . . 70.010000000000005 110.262 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 57.3 t0 -66.62 -44.83 80.99 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.542 1.151 . . . . 70.420000000000002 109.309 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.452 ' N ' ' O ' ' A' ' 86' ' ' ALA . 22.9 m-20 -124.01 41.27 3.53 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.515 1.135 . . . . 74.099999999999994 109.296 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.596 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -70.51 -41.11 73.03 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.469 1.106 . . . . 74.120000000000005 110.442 179.947 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -69.92 -31.96 70.0 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.468 1.105 . . . . 74.510000000000005 109.319 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -60.16 -69.45 0.22 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.525 1.141 . . . . 74.140000000000001 110.288 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.827 ' HB2' HD22 ' A' ' 138' ' ' LEU . . . -46.09 -28.87 1.31 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.526 1.141 . . . . 52.210000000000001 109.269 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.498 ' HG ' HD13 ' A' ' 111' ' ' ILE . 0.7 OUTLIER -69.37 -57.63 5.04 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.516 1.135 . . . . 71.129999999999995 109.286 -179.977 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 11.4 tpp180 -41.4 -36.2 0.8 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.457 1.098 . . . . 74.519999999999996 110.347 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.887 HG21 ' HE1' ' A' ' 173' ' ' MET . 1.9 t -77.75 -65.15 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 O-C-N 124.493 1.121 . . . . 74.420000000000002 109.334 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.5 ' N ' HG12 ' A' ' 96' ' ' VAL . 0.1 OUTLIER -45.14 -21.84 0.09 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.52 1.138 . . . . 72.099999999999994 110.309 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.44 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.1 t-20 -78.57 -59.64 2.7 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.519 1.137 . . . . 71.409999999999997 109.3 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.845 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -61.8 -22.11 65.18 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.556 1.16 . . . . 70.129999999999995 109.312 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.845 ' N ' HD23 ' A' ' 99' ' ' LEU . 15.5 mt -64.64 -55.55 19.46 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.534 1.147 . . . . 44.420000000000002 109.252 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -78.82 54.01 1.47 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.506 1.129 . . . . 74.409999999999997 110.287 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -174.78 -67.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.515 1.135 . . . . 72.510000000000005 109.242 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -45.26 -51.86 10.29 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.523 1.14 . . . . 71.239999999999995 109.346 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.404 ' CE2' HG11 ' A' ' 206' ' ' VAL . 4.6 m-85 -113.4 -24.92 9.05 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.41 1.069 . . . . 75.219999999999999 110.942 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.406 ' C ' ' CD ' ' A' ' 107' ' ' LYS . . . 92.59 44.72 3.89 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.538 1.149 . . . . 53.32 111.031 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.722 HG22 ' HD3' ' A' ' 80' ' ' LYS . 8.5 mm -84.35 75.22 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 O-C-N 124.497 0.763 . . . . 72.420000000000002 109.35 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.536 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -119.56 156.38 53.51 Favored Pre-proline 0 C--N 1.326 -0.451 0 O-C-N 124.417 1.073 . . . . 71.209999999999994 109.282 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.536 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.95 161.36 94.99 Favored 'Cis proline' 0 C--N 1.359 1.111 0 C-N-CA 121.001 -2.499 . . . . 62.310000000000002 111.015 -0.048 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -135.91 118.7 1.89 Allowed Glycine 0 CA--C 1.53 0.995 0 O-C-N 124.422 1.076 . . . . 73.219999999999999 111.016 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.634 HG22 HD11 ' A' ' 79' ' ' LEU . 1.3 tt -136.06 149.89 27.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.55 0.794 . . . . 74.519999999999996 109.296 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . 0.671 HD12 ' NE2' ' A' ' 85' ' ' HIS . 33.5 pt -98.11 161.0 3.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.439 1.087 . . . . 73.239999999999995 109.336 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.871 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 2.5 t80 -62.04 -19.21 62.66 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.52 1.138 . . . . 74.340000000000003 111.059 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.401 ' HB2' ' HE1' ' A' ' 85' ' ' HIS . . . -87.33 -11.6 48.96 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.517 1.136 . . . . 62.399999999999999 109.386 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.401 ' C ' HD11 ' A' ' 110' ' ' ILE . 7.7 mm-40 -104.08 -20.88 13.69 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.486 1.117 . . . . 73.409999999999997 110.321 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.471 ' CE ' ' CG2' ' A' ' 82' ' ' VAL . 21.9 tpp -44.57 134.36 4.66 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 124.464 1.102 . . . . 52.030000000000001 110.98 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 C--N 1.36 1.177 0 O-C-N 124.531 1.806 . . . . 54.43 110.992 -179.981 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.769 ' HB2' HD11 ' A' ' 157' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.271 0 N-CA-C 109.291 -0.633 . . . . 65.040000000000006 109.291 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.426 ' HA ' ' CG2' ' A' ' 129' ' ' VAL . 0.6 OUTLIER -41.31 -59.02 1.66 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.481 1.113 . . . . 73.299999999999997 109.307 -179.996 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -43.64 -46.95 7.54 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.492 1.12 . . . . 71.549999999999997 109.333 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.871 ' HB2' ' CE1' ' A' ' 112' ' ' PHE . . . -61.52 -46.66 89.0 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.427 1.079 . . . . 73.209999999999994 109.268 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.706 ' HA ' HG21 ' A' ' 135' ' ' THR . 35.2 m -92.38 30.94 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.525 1.14 . . . . 63.399999999999999 109.309 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . 0.403 ' N ' ' O ' ' A' ' 126' ' ' ASP . 8.9 t30 -148.46 118.48 7.2 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.494 1.121 . . . . 75.540000000000006 109.32 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 102.78 34.15 4.16 Favored Glycine 0 CA--C 1.53 1.028 0 O-C-N 124.515 1.135 . . . . 71.109999999999999 110.928 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . 0.403 ' O ' ' O ' ' A' ' 167' ' ' TYR . 0.7 OUTLIER -163.54 -173.81 3.46 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.503 0.767 . . . . 73.109999999999999 110.025 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' A' ' 80' ' ' LYS . . . -91.09 -68.59 0.78 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.456 1.097 . . . . 74.349999999999994 109.275 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.605 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 0.9 OUTLIER -121.52 174.86 6.51 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.509 1.131 . . . . 73.409999999999997 108.021 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . 0.737 HG22 ' CG1' ' A' ' 82' ' ' VAL . 2.5 p -143.28 136.0 27.56 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.483 1.114 . . . . 51.409999999999997 110.374 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.822 ' HB ' HG23 ' A' ' 83' ' ' ILE . 14.5 mm -89.5 113.46 25.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.477 1.111 . . . . 71.219999999999999 109.29 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.693 HD11 ' CG1' ' A' ' 170' ' ' VAL . 2.8 mt -99.06 89.65 4.34 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.536 1.147 . . . . 75.239999999999995 109.278 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.827 HD22 ' HB2' ' A' ' 93' ' ' ALA . 2.4 tp -62.2 102.3 0.29 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.472 1.107 . . . . 65.120000000000005 109.286 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.562 HD13 HG23 ' A' ' 185' ' ' THR . 55.2 mt -77.37 121.24 23.5 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.461 1.101 . . . . 63.409999999999997 109.344 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . 0.668 HG23 ' ND2' ' A' ' 178' ' ' ASN . 10.6 m -139.74 162.19 35.73 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.523 1.14 . . . . 70.530000000000001 110.397 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -53.65 -40.86 66.21 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.566 1.166 . . . . 74.430000000000007 110.295 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . 0.418 ' ND2' ' N ' ' A' ' 143' ' ' PHE . 2.5 p-10 -89.76 -52.32 5.05 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.442 1.089 . . . . 72.310000000000002 109.326 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.48 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 6.6 t80 -49.51 -27.64 4.58 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.481 1.113 . . . . 71.420000000000002 110.926 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.708 HD13 ' C ' ' A' ' 144' ' ' LEU . 2.1 tm? -63.0 -67.98 0.38 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.471 1.107 . . . . 60.450000000000003 109.336 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.463 ' C ' ' CD ' ' A' ' 145' ' ' ARG . 0.2 OUTLIER -65.32 -14.7 61.39 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.507 1.129 . . . . 71.310000000000002 110.242 -179.977 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . 0.418 ' N ' ' HD2' ' A' ' 145' ' ' ARG . 21.1 t0 -67.51 -60.64 2.4 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.498 1.124 . . . . 74.409999999999997 109.313 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.517 ' HB ' ' CE1' ' A' ' 151' ' ' PHE . 2.3 p -84.91 -47.52 10.22 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.519 1.137 . . . . 75.219999999999999 110.416 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.475 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 33.0 t-105 -45.7 -30.52 1.61 Allowed 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.517 1.136 . . . . 71.409999999999997 108.084 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' CYS . . . . . 0.452 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 40.5 t -78.47 -45.68 21.52 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.462 1.101 . . . . 75.319999999999993 108.27 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' ASN . . . . . 0.463 ' N ' ' O ' ' A' ' 147' ' ' THR . 17.2 m-80 -67.41 -13.66 62.22 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.475 1.109 . . . . 75.129999999999995 109.289 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.886 ' CE1' HD22 ' A' ' 157' ' ' LEU . 5.4 m-30 -80.62 -51.05 9.17 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.505 1.128 . . . . 70.239999999999995 111.025 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -50.91 -40.36 56.78 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.541 1.151 . . . . 73.340000000000003 110.349 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 51.4 t80 -83.8 -17.37 41.29 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.489 1.118 . . . . 62.399999999999999 111.017 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.429 ' CE2' ' HB3' ' A' ' 156' ' ' SER . 1.3 t80 -136.9 105.7 5.89 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.515 1.134 . . . . 72.109999999999999 110.946 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 4.0 t -78.06 -2.96 39.8 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.411 1.07 . . . . 53.340000000000003 110.461 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . 0.429 ' HB3' ' CE2' ' A' ' 154' ' ' TYR . 10.2 p -44.39 -49.42 9.68 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.474 1.109 . . . . 54.439999999999998 110.032 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.886 HD22 ' CE1' ' A' ' 151' ' ' PHE . 4.4 mp -70.76 -42.47 70.39 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.458 1.099 . . . . 71.209999999999994 109.278 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -50.57 -21.53 1.58 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.512 1.132 . . . . 73.510000000000005 111.002 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' ASN . . . . . 0.437 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 74.1 m-20 -82.87 -32.77 27.26 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.549 1.156 . . . . 73.340000000000003 109.289 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 160' ' ' SER . . . . . 0.605 ' HB2' HG21 ' A' ' 170' ' ' VAL . 6.0 m -79.88 -31.56 40.35 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.55 1.156 . . . . 74.040000000000006 110.014 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . 0.589 HG12 HD11 ' A' ' 192' ' ' ILE . 96.5 t -61.28 -18.59 18.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.482 1.114 . . . . 74.200000000000003 109.264 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -66.41 -20.54 66.09 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.526 1.141 . . . . 61.030000000000001 109.267 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.553 ' HD3' HG23 ' A' ' 192' ' ' ILE . 15.7 mmm-85 69.03 43.79 1.09 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.543 1.152 . . . . 60.520000000000003 110.301 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . 0.437 ' NE2' ' O ' ' A' ' 159' ' ' ASN . 12.3 mt-30 -69.99 176.73 3.55 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.484 1.115 . . . . 62.039999999999999 110.255 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 11.2 m80 -90.69 39.58 0.99 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.523 1.14 . . . . 71.019999999999996 109.607 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -90.74 -178.73 5.34 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.53 1.144 . . . . 73.329999999999998 109.319 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 167' ' ' TYR . . . . . 0.515 ' HB3' HG22 ' A' ' 221' ' ' ILE . 0.4 OUTLIER -85.63 44.46 1.11 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.514 1.133 . . . . 73.150000000000006 110.976 -179.983 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . 0.408 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 7.7 p30 -170.36 124.27 0.71 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.505 1.128 . . . . 60.409999999999997 109.301 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.461 ' O ' ' HA ' ' A' ' 134' ' ' TRP . 2.5 m -125.0 111.52 15.49 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.486 1.116 . . . . 54.520000000000003 110.017 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.776 ' C ' HD12 ' A' ' 171' ' ' ILE . 3.8 t -79.45 112.78 17.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.57 1.168 . . . . 52.109999999999999 109.296 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.776 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -129.15 102.53 18.79 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.524 1.14 . . . . 54.210000000000001 109.264 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . 0.915 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.03 114.8 4.11 Favored 'Trans proline' 0 C--N 1.36 1.164 0 O-C-N 124.479 1.779 . . . . 51.409999999999997 111.056 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . 0.887 ' HE1' HG21 ' A' ' 96' ' ' VAL . 6.1 ttt -80.2 161.55 25.14 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.527 1.142 . . . . 75.230000000000004 110.982 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 195' ' ' LEU . 75.0 mtt-85 -107.63 112.1 62.39 Favored Pre-proline 0 C--N 1.326 -0.435 0 O-C-N 124.528 1.142 . . . . 73.439999999999998 110.259 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 175' ' ' PRO . . . . . 0.727 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -74.98 154.69 42.79 Favored 'Trans proline' 0 C--N 1.36 1.168 0 O-C-N 124.446 1.761 . . . . 72.439999999999998 110.987 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . 0.901 HD11 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -100.36 -45.34 5.61 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.453 1.095 . . . . 45.43 109.312 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . 0.453 ' ND2' ' H ' ' A' ' 177' ' ' ASN . 2.1 p30 -72.73 -25.12 61.1 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 73.120000000000005 109.323 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 178' ' ' ASN . . . . . 0.668 ' ND2' HG23 ' A' ' 140' ' ' THR . 8.1 t-20 -108.75 101.7 44.89 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.507 1.129 . . . . 72.430000000000007 109.211 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.05 117.61 4.96 Favored 'Trans proline' 0 C--N 1.36 1.184 0 O-C-N 124.499 1.789 . . . . 64.400000000000006 111.001 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.482 ' HA ' HD22 ' A' ' 180' ' ' LEU . 0.9 OUTLIER -132.97 96.67 17.57 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.561 1.163 . . . . 61.549999999999997 109.279 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 181' ' ' PRO . . . . . 0.45 ' HG2' ' CG ' ' A' ' 183' ' ' GLU . 18.2 Cg_endo -75.04 164.31 33.54 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.471 1.774 . . . . 63.420000000000002 110.991 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.04 -38.98 54.79 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.473 1.108 . . . . 73.239999999999995 110.279 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . 0.45 ' CG ' ' HG2' ' A' ' 181' ' ' PRO . 4.4 pt-20 -49.45 -33.16 13.46 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.483 1.115 . . . . 74.239999999999995 110.325 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 184' ' ' ARG . . . . . 0.475 ' HB2' HD13 ' A' ' 180' ' ' LEU . 58.7 mmt-85 -91.83 -21.77 20.47 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.584 1.178 . . . . 73.230000000000004 110.317 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 185' ' ' THR . . . . . 0.562 HG23 HD13 ' A' ' 139' ' ' LEU . 19.4 m -84.36 143.86 42.54 Favored Pre-proline 0 C--N 1.325 -0.468 0 O-C-N 124.452 1.095 . . . . 74.409999999999997 110.412 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 186' ' ' PRO . . . . . 0.823 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -74.99 156.56 43.04 Favored 'Trans proline' 0 C--N 1.36 1.164 0 O-C-N 124.496 1.787 . . . . 63.420000000000002 111.007 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 187' ' ' PHE . . . . . 0.451 ' O ' ' CG2' ' A' ' 191' ' ' THR . 32.3 p90 -70.03 -7.03 37.71 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.493 1.121 . . . . 74.109999999999999 110.996 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . 0.473 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -94.26 -52.9 4.16 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.46 1.1 . . . . 63.219999999999999 109.23 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.823 HD12 ' CG ' ' A' ' 186' ' ' PRO . 44.2 mt -68.48 -42.09 79.19 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.513 1.133 . . . . 72.049999999999997 109.334 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 190' ' ' GLN . . . . . 0.409 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.4 pt20 -64.01 -9.9 18.67 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.523 1.139 . . . . 75.450000000000003 110.27 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 191' ' ' THR . . . . . 0.451 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 41.4 p -116.56 20.0 14.32 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.451 1.095 . . . . 75.319999999999993 110.38 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.589 HD11 HG12 ' A' ' 161' ' ' VAL . 6.5 mt -120.58 154.43 23.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.478 1.111 . . . . 74.409999999999997 109.285 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 193' ' ' ASN . . . . . 0.486 ' H ' ' NH1' ' A' ' 163' ' ' ARG . 35.4 t30 -64.84 77.47 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.491 1.12 . . . . 64.439999999999998 109.294 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . 0.915 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -73.51 174.78 7.75 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.496 1.123 . . . . 43.130000000000003 109.28 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 195' ' ' LEU . . . . . 0.936 HD23 HD12 ' A' ' 209' ' ' ILE . 0.4 OUTLIER -108.3 150.88 26.73 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.472 1.108 . . . . 71.120000000000005 109.348 179.97 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . 0.512 ' N ' HD13 ' A' ' 195' ' ' LEU . 26.3 mt-10 -141.92 141.4 32.98 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.429 1.08 . . . . 73.120000000000005 110.338 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.901 ' HG3' HD11 ' A' ' 176' ' ' LEU . 1.2 pt-20 -113.21 -28.78 7.5 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.474 1.109 . . . . 72.099999999999994 110.283 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . 0.56 ' CG ' HD12 ' A' ' 176' ' ' LEU . 21.0 pt-20 -88.37 3.01 51.37 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.488 1.117 . . . . 74.010000000000005 110.3 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 5.5 t -97.84 144.47 27.39 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.503 1.127 . . . . 73.349999999999994 110.03 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 4.8 tpm_? -61.87 -17.52 56.82 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.454 1.096 . . . . 71.230000000000004 110.253 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -103.07 19.05 47.63 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.47 1.106 . . . . 64.329999999999998 111.02 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 202' ' ' PHE . . . . . 0.885 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.1 OUTLIER -55.03 -44.34 99.55 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.469 0.747 . . . . 71.310000000000002 111.025 179.969 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 203' ' ' PRO . . . . . 0.597 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.05 -35.01 3.35 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.516 1.798 . . . . 60.049999999999997 110.963 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.98 -48.3 78.74 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.498 1.124 . . . . 62.549999999999997 110.362 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 205' ' ' GLN . . . . . 0.454 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 3.1 mt-30 -71.34 -38.7 71.64 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.443 1.09 . . . . 74.400000000000006 110.267 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 206' ' ' VAL . . . . . 0.885 HG23 ' O ' ' A' ' 202' ' ' PHE . 70.7 t -65.71 -28.96 45.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.544 1.153 . . . . 73.310000000000002 109.327 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 207' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 2.8 mt-10 -78.04 -47.37 18.54 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.49 1.119 . . . . 72.510000000000005 110.337 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -68.97 -62.39 1.4 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.497 1.123 . . . . 62.43 110.253 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 209' ' ' ILE . . . . . 0.936 HD12 HD23 ' A' ' 195' ' ' LEU . 59.8 mt -47.92 -58.28 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.491 1.119 . . . . 64.319999999999993 109.328 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 210' ' ' PHE . . . . . 0.785 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.7 m-85 -99.46 66.68 1.48 Allowed 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.547 1.154 . . . . 61.229999999999997 110.996 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 211' ' ' GLN . . . . . 0.543 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -108.5 144.75 35.74 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.543 1.152 . . . . 75.319999999999993 110.321 179.974 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' A' ' 215' ' ' TYR . 29.3 tt0 -48.79 -55.26 12.06 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.575 1.172 . . . . 64.439999999999998 110.243 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.43 -24.85 1.39 Allowed 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.484 1.115 . . . . 74.420000000000002 110.017 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.543 HG23 ' HG2' ' A' ' 211' ' ' GLN . 43.9 t -96.71 -26.66 4.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.431 1.082 . . . . 72.120000000000005 109.277 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 215' ' ' TYR . . . . . 0.488 ' O ' ' CB ' ' A' ' 219' ' ' GLN . 1.8 t80 -69.2 -29.87 67.93 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.481 1.113 . . . . 75.120000000000005 110.98 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 29.8 mmtt -65.13 -66.32 0.56 Allowed 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.502 1.126 . . . . 74.439999999999998 109.322 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 217' ' ' THR . . . . . 0.796 HG22 HD11 ' A' ' 221' ' ' ILE . 10.1 m -44.44 -66.46 0.39 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.453 1.095 . . . . 52.229999999999997 110.376 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 218' ' ' GLN . . . . . 0.946 ' HA ' HD12 ' A' ' 221' ' ' ILE . 6.3 mp0 -47.29 -62.36 1.46 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.54 1.15 . . . . 72.450000000000003 110.285 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 219' ' ' GLN . . . . . 0.488 ' CB ' ' O ' ' A' ' 215' ' ' TYR . 33.8 tp60 -40.01 -46.03 2.02 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.452 1.095 . . . . 75.129999999999995 110.281 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.1 m -66.09 -44.39 84.52 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.463 1.102 . . . . 71.120000000000005 110.4 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 221' ' ' ILE . . . . . 0.946 HD12 ' HA ' ' A' ' 218' ' ' GLN . 15.4 mt -56.19 -24.4 17.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 O-C-N 124.559 1.162 . . . . 60.240000000000002 109.274 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 222' ' ' TRP . . . . . 0.61 ' CZ2' ' O ' ' A' ' 77' ' ' VAL . 73.4 t90 -78.24 -74.09 0.29 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.529 1.143 . . . . 73.209999999999994 108.006 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.419 ' HG3' ' N ' ' A' ' 224' ' ' GLU . 0.3 OUTLIER -44.28 -26.08 0.29 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.44 1.087 . . . . 75.209999999999994 109.334 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . 0.436 ' N ' ' C ' ' A' ' 222' ' ' TRP . 3.2 mm-40 . . . . . 0 C--N 1.326 -0.436 0 O-C-N 124.521 1.138 . . . . 73.310000000000002 110.263 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.491 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.5 p . . . . . 0 N--CA 1.453 -0.325 0 N-CA-C 109.332 -0.618 . . . . 70.109999999999999 109.332 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.564 ' CE2' ' HD3' ' A' ' 108' ' ' PRO . 8.5 p90 -89.61 29.35 1.15 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.422 1.076 . . . . 63.450000000000003 110.99 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 5.8 tp -39.9 155.66 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.529 1.143 . . . . 74.140000000000001 109.328 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.814 ' HZ3' HG23 ' A' ' 106' ' ' ILE . 1.4 ttpt -95.69 -58.54 2.08 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.548 1.155 . . . . 72.030000000000001 109.31 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.825 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.2 OUTLIER -165.05 146.69 7.76 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.468 1.105 . . . . 61.340000000000003 111.056 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.635 HG21 ' CE ' ' A' ' 115' ' ' MET . 12.0 p -99.62 151.37 4.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.559 1.162 . . . . 64.430000000000007 109.335 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.864 HG23 ' HB ' ' A' ' 136' ' ' ILE . 4.6 mp -114.77 99.41 8.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.525 1.141 . . . . 74.099999999999994 109.268 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.019 HD11 ' HB1' ' A' ' 128' ' ' ALA . 1.9 mp -73.45 117.46 15.24 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.566 1.166 . . . . 65.200000000000003 109.31 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.792 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -135.58 166.49 23.1 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.531 1.144 . . . . 75.510000000000005 109.611 -179.999 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.453 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -105.03 155.61 18.81 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.566 1.166 . . . . 62.520000000000003 109.341 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -57.49 -17.03 11.4 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.536 1.148 . . . . 45.119999999999997 110.349 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -82.99 -43.16 16.71 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.465 1.103 . . . . 63.520000000000003 109.292 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.463 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -119.1 42.97 2.7 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.525 1.141 . . . . 72.430000000000007 109.306 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.594 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -80.62 -25.97 38.07 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.571 1.169 . . . . 64.310000000000002 110.409 179.979 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.441 ' O ' ' N ' ' A' ' 95' ' ' ARG . 0.8 OUTLIER -79.81 -35.44 38.43 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.477 1.111 . . . . 75.530000000000001 109.334 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.462 ' O ' ' N ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -62.75 -66.89 0.47 Allowed 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.499 1.124 . . . . 44.539999999999999 110.259 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.698 ' HB2' HD22 ' A' ' 138' ' ' LEU . . . -47.31 -36.89 9.92 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.523 1.139 . . . . 53.32 109.302 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.841 HD22 ' O ' ' A' ' 94' ' ' LEU . 0.1 OUTLIER -74.97 -33.39 61.88 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 124.483 1.115 . . . . 64.120000000000005 109.298 -179.966 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 92' ' ' GLU . 11.6 tpt180 -54.09 -46.67 72.13 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.515 1.135 . . . . 73.120000000000005 110.293 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.543 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 0.3 OUTLIER -76.21 -52.39 17.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.415 1.072 . . . . 71.319999999999993 109.327 179.978 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.543 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -48.15 -23.49 0.86 Allowed 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.521 1.138 . . . . 44.439999999999998 110.343 179.951 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -75.65 -38.59 58.72 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.557 1.161 . . . . 73.420000000000002 109.298 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.71 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -83.26 -21.67 33.26 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.515 1.134 . . . . 54.420000000000002 109.318 179.954 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.852 HD22 HG21 ' A' ' 206' ' ' VAL . 51.1 mt -61.97 -51.84 66.44 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.485 1.116 . . . . 74.099999999999994 109.285 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -76.39 55.1 0.97 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.524 1.14 . . . . 73.430000000000007 110.281 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -179.71 -67.43 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.497 1.123 . . . . 74.329999999999998 109.318 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -40.73 -60.96 1.03 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.523 1.139 . . . . 65.120000000000005 109.36 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.48 ' CZ ' HG11 ' A' ' 206' ' ' VAL . 1.3 m-85 -104.25 -19.47 14.1 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.477 1.111 . . . . 43.409999999999997 110.977 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.06 45.18 4.22 Favored Glycine 0 CA--C 1.529 0.945 0 O-C-N 124.493 1.121 . . . . 73.239999999999995 111.042 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.814 HG23 ' HZ3' ' A' ' 80' ' ' LYS . 6.6 mm -85.29 86.36 2.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.436 0.727 . . . . 73.0 109.298 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.529 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -138.06 157.2 73.39 Favored Pre-proline 0 C--N 1.326 -0.454 0 O-C-N 124.475 1.11 . . . . 74.200000000000003 109.322 179.951 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.564 ' HD3' ' CE2' ' A' ' 78' ' ' PHE . 18.0 Cg_endo -75.12 150.17 94.83 Favored 'Cis proline' 0 C--N 1.36 1.141 0 C-N-CA 120.938 -2.526 . . . . 75.420000000000002 110.987 0.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -122.65 137.73 11.44 Favored Glycine 0 CA--C 1.53 1.0 0 O-C-N 124.484 1.115 . . . . 73.349999999999994 110.955 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 1.2 tt -153.72 148.26 13.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.516 0.774 . . . . 73.299999999999997 109.334 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . 0.792 HD12 ' NE2' ' A' ' 85' ' ' HIS . 32.4 pt -101.39 161.45 3.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.482 1.114 . . . . 73.019999999999996 109.272 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -61.55 -19.6 62.33 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.46 1.1 . . . . 73.329999999999998 110.95 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.429 ' HB2' ' HE1' ' A' ' 85' ' ' HIS . . . -87.64 -12.41 45.59 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.536 1.148 . . . . 71.299999999999997 109.304 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -103.83 -17.49 15.03 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.528 1.142 . . . . 64.310000000000002 110.276 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.635 ' CE ' HG21 ' A' ' 82' ' ' VAL . 9.1 ttm -50.84 143.52 14.93 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.523 1.139 . . . . 71.209999999999994 110.996 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.459 ' HD2' ' CG ' ' A' ' 115' ' ' MET . 18.1 Cg_endo . . . . . 0 C--N 1.359 1.13 0 O-C-N 124.532 1.806 . . . . 72.25 111.057 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.802 HD11 ' HB3' ' A' ' 150' ' ' ASN . 2.9 mt . . . . . 0 N--CA 1.454 -0.256 0 N-CA-C 109.339 -0.615 . . . . 70.099999999999994 109.339 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.474 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 0.2 OUTLIER -40.31 -44.23 1.88 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.49 1.119 . . . . 64.519999999999996 109.278 -179.995 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -50.07 -49.68 50.54 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.477 1.11 . . . . 55.310000000000002 109.362 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 1.019 ' HB1' HD11 ' A' ' 84' ' ' LEU . . . -68.87 -38.56 79.8 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.53 1.144 . . . . 73.209999999999994 109.324 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.712 HG12 ' O ' ' A' ' 129' ' ' VAL . 86.9 t -92.93 30.64 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.462 1.101 . . . . 74.400000000000006 109.288 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . 0.474 ' CB ' ' O ' ' A' ' 126' ' ' ASP . 6.2 t30 -138.47 152.3 48.18 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.437 1.086 . . . . 75.439999999999998 109.296 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 51.35 53.51 27.83 Favored Glycine 0 CA--C 1.53 0.983 0 O-C-N 124.448 1.092 . . . . 31.41 110.982 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 1.2 p -163.4 -179.73 6.74 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.501 0.766 . . . . 74.430000000000007 109.974 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.85 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -104.25 -46.26 4.46 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.524 1.14 . . . . 33.340000000000003 109.29 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.85 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 0.5 OUTLIER -145.51 174.29 11.28 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.567 1.167 . . . . 73.439999999999998 108.042 -179.978 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . 0.447 HG22 ' CG1' ' A' ' 82' ' ' VAL . 2.4 p -139.22 129.18 25.01 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.497 1.123 . . . . 63.299999999999997 110.387 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.864 ' HB ' HG23 ' A' ' 83' ' ' ILE . 15.0 mm -84.4 95.0 3.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.393 1.058 . . . . 52.439999999999998 109.292 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 13.2 mt -82.69 94.19 7.53 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.486 1.116 . . . . 71.420000000000002 109.344 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.698 HD22 ' HB2' ' A' ' 93' ' ' ALA . 3.3 tp -61.3 97.71 0.07 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.513 1.133 . . . . 62.420000000000002 109.345 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.748 HD11 HD13 ' A' ' 189' ' ' LEU . 2.0 tp -70.22 105.75 3.07 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.478 1.112 . . . . 74.129999999999995 109.296 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 4.8 m -133.63 154.88 50.56 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.471 1.107 . . . . 54.43 110.389 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -49.96 -39.1 39.59 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.546 1.154 . . . . 74.019999999999996 110.302 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -89.0 -53.89 4.38 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.53 1.144 . . . . 55.32 109.318 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.59 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 16.8 t80 -51.19 -20.53 1.59 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.521 1.138 . . . . 73.109999999999999 111.044 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.694 ' C ' HD13 ' A' ' 144' ' ' LEU . 2.0 tm? -60.85 -68.06 0.34 Allowed 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.45 1.094 . . . . 70.549999999999997 109.336 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.544 HH11 HD12 ' A' ' 144' ' ' LEU . 2.0 mpt_? -67.52 -12.21 59.81 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.462 1.101 . . . . 75.040000000000006 110.3 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . 0.4 ' O ' ' CG ' ' A' ' 150' ' ' ASN . 27.6 t0 -65.84 -61.45 2.05 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.563 1.164 . . . . 73.430000000000007 109.303 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.666 HG23 ' CZ ' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -88.23 -46.5 9.19 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.554 1.159 . . . . 62.539999999999999 110.407 -179.981 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.519 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 32.1 t-105 -44.52 -34.4 2.09 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.522 1.139 . . . . 61.020000000000003 107.979 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' CYS . . . . . 0.451 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 42.3 t -77.87 -45.43 24.24 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.502 1.126 . . . . 62.130000000000003 108.304 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' ASN . . . . . 0.802 ' HB3' HD11 ' A' ' 125' ' ' LEU . 31.1 m-20 -62.51 -16.93 58.41 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.446 1.091 . . . . 74.430000000000007 109.306 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.871 ' CD1' HD21 ' A' ' 157' ' ' LEU . 8.7 m-30 -82.19 -47.8 12.05 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.515 1.135 . . . . 71.409999999999997 111.063 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -48.15 -39.83 21.93 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.499 1.124 . . . . 74.040000000000006 110.291 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -83.96 -23.23 31.18 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.47 1.106 . . . . 74.519999999999996 110.924 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.534 ' CE2' ' HB2' ' A' ' 156' ' ' SER . 5.6 t80 -129.13 97.99 4.78 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.467 1.105 . . . . 63.039999999999999 111.016 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.45 -2.7 57.64 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.523 1.139 . . . . 74.5 110.411 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . 0.534 ' HB2' ' CE2' ' A' ' 154' ' ' TYR . 1.8 m -53.88 -38.23 64.53 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.513 1.133 . . . . 73.219999999999999 110.01 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.871 HD21 ' CD1' ' A' ' 151' ' ' PHE . 2.3 pp -89.58 -27.66 20.08 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.451 1.094 . . . . 75.109999999999999 109.315 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' MET . . . . . 0.427 ' HE2' ' HA ' ' A' ' 158' ' ' MET . 12.4 tpp -54.66 -26.28 32.28 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.487 1.117 . . . . 64.340000000000003 110.972 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' ASN . . . . . 0.424 ' HB3' ' NE2' ' A' ' 164' ' ' GLN . 54.6 m-80 -66.56 -31.17 71.7 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.559 1.162 . . . . 74.120000000000005 109.322 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 160' ' ' SER . . . . . 0.462 ' HB3' ' CG2' ' A' ' 170' ' ' VAL . 0.3 OUTLIER -74.86 -28.15 60.55 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.521 1.138 . . . . 75.030000000000001 110.077 179.922 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . 0.771 HG13 HD11 ' A' ' 192' ' ' ILE . 82.4 t -57.39 -17.85 7.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.487 1.117 . . . . 74.310000000000002 109.348 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -91.42 35.71 0.94 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.622 1.201 . . . . 73.299999999999997 109.211 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.457 ' CD ' HG12 ' A' ' 192' ' ' ILE . 0.0 OUTLIER 47.34 32.44 2.22 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.49 1.119 . . . . 70.040000000000006 110.294 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . 0.424 ' NE2' ' HB3' ' A' ' 159' ' ' ASN . 0.2 OUTLIER -56.42 129.01 38.8 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.469 1.106 . . . . 71.420000000000002 110.261 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 165' ' ' HIS . . . . . 0.612 ' CE1' HG21 ' A' ' 217' ' ' THR . 16.0 t-80 -85.97 48.57 1.63 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.507 1.129 . . . . 74.439999999999998 109.589 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 3.0 tptp -95.63 171.89 8.39 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.506 1.129 . . . . 75.129999999999995 109.204 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 167' ' ' TYR . . . . . 0.787 ' CE2' ' CD1' ' A' ' 222' ' ' TRP . 3.4 t80 -38.45 -64.49 0.42 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.501 1.125 . . . . 64.319999999999993 111.075 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . 0.431 ' ND2' ' CG1' ' A' ' 129' ' ' VAL . 1.2 p-10 -90.78 133.07 35.47 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.428 1.08 . . . . 70.519999999999996 109.271 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.454 ' N ' ' O ' ' A' ' 133' ' ' ALA . 1.8 t -108.78 177.24 4.83 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.569 1.168 . . . . 65.439999999999998 109.98 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.725 ' C ' HD12 ' A' ' 171' ' ' ILE . 3.2 t -137.36 103.36 2.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.498 1.124 . . . . 75.310000000000002 109.279 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.725 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -121.95 99.95 43.57 Favored Pre-proline 0 C--N 1.324 -0.513 0 O-C-N 124.527 1.142 . . . . 62.200000000000003 109.274 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . 0.657 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.3 Cg_endo -75.03 118.85 5.4 Favored 'Trans proline' 0 C--N 1.36 1.178 0 O-C-N 124.444 1.76 . . . . 73.439999999999998 110.98 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . 0.586 ' HB2' HG23 ' A' ' 136' ' ' ILE . 4.1 ttt -89.09 151.64 22.11 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.471 1.107 . . . . 54.329999999999998 110.962 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . 0.555 ' NH2' ' H ' ' A' ' 180' ' ' LEU . 0.2 OUTLIER -105.68 117.52 57.71 Favored Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.469 1.105 . . . . 65.329999999999998 110.286 -179.991 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 175' ' ' PRO . . . . . 0.509 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -75.04 150.0 37.34 Favored 'Trans proline' 0 C--N 1.359 1.112 0 O-C-N 124.515 1.797 . . . . 60.100000000000001 110.99 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . 0.797 HD11 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -88.64 -38.86 14.48 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.528 1.142 . . . . 72.129999999999995 109.331 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -72.78 -26.48 61.55 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.459 1.099 . . . . 74.420000000000002 109.255 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 178' ' ' ASN . . . . . 0.437 ' O ' ' NH2' ' A' ' 174' ' ' ARG . 4.0 m-80 -110.76 103.03 53.9 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.55 1.156 . . . . 60.329999999999998 109.297 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.05 115.65 4.34 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.543 1.812 . . . . 71.140000000000001 110.963 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.555 ' H ' ' NH2' ' A' ' 174' ' ' ARG . 0.4 OUTLIER -116.98 97.09 50.28 Favored Pre-proline 0 C--N 1.325 -0.484 0 O-C-N 124.557 1.161 . . . . 52.229999999999997 109.3 179.969 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 164.51 33.22 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.467 1.772 . . . . 75.219999999999999 111.016 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 59.4 mtt180 -67.13 -16.64 64.45 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.544 1.152 . . . . 72.310000000000002 110.335 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -74.81 -17.09 60.67 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.512 1.133 . . . . 65.400000000000006 110.342 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -117.41 16.69 14.71 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.525 1.141 . . . . 73.409999999999997 110.357 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 185' ' ' THR . . . . . 0.498 ' OG1' ' CD1' ' A' ' 180' ' ' LEU . 19.1 m -116.86 143.6 31.82 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.456 1.098 . . . . 73.239999999999995 110.435 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 186' ' ' PRO . . . . . 0.828 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.5 Cg_endo -75.04 155.99 42.77 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.539 1.81 . . . . 73.540000000000006 111.022 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 187' ' ' PHE . . . . . 0.503 ' O ' ' CG2' ' A' ' 191' ' ' THR . 37.9 p90 -69.74 -7.26 37.95 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.516 1.135 . . . . 72.340000000000003 110.956 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.87 -52.74 4.29 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.502 1.126 . . . . 70.299999999999997 109.312 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.875 ' HA ' HD12 ' A' ' 192' ' ' ILE . 43.4 mt -68.45 -42.31 78.99 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.521 1.138 . . . . 73.420000000000002 109.29 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 190' ' ' GLN . . . . . 0.409 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.3 pt20 -63.98 -10.76 23.35 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.46 1.1 . . . . 75.400000000000006 110.344 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 191' ' ' THR . . . . . 0.503 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 35.7 p -113.64 19.92 16.37 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.535 1.147 . . . . 75.239999999999995 110.383 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.875 HD12 ' HA ' ' A' ' 189' ' ' LEU . 28.1 mt -113.28 160.64 12.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.486 1.116 . . . . 71.030000000000001 109.262 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 193' ' ' ASN . . . . . 0.44 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 35.7 t30 -76.39 62.88 1.89 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.502 1.127 . . . . 71.439999999999998 109.301 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . 0.657 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -56.96 143.41 38.03 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.441 1.088 . . . . 53.109999999999999 109.308 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 195' ' ' LEU . . . . . 0.548 HD12 ' CE ' ' A' ' 173' ' ' MET . 0.7 OUTLIER -80.26 123.49 28.01 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.47 1.106 . . . . 71.450000000000003 109.27 -179.926 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . 0.407 ' O ' ' HA ' ' A' ' 202' ' ' PHE . 14.1 mt-10 -103.43 137.5 41.44 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.453 1.096 . . . . 73.319999999999993 110.294 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.797 ' HG3' HD11 ' A' ' 176' ' ' LEU . 0.6 OUTLIER -113.71 -24.73 9.02 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.552 1.157 . . . . 74.209999999999994 110.292 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . 0.573 ' HG2' HD12 ' A' ' 176' ' ' LEU . 6.5 pt-20 -102.51 21.72 14.75 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.518 1.136 . . . . 62.109999999999999 110.269 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -117.34 162.99 17.02 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 124.513 1.133 . . . . 63.399999999999999 110.014 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 21.5 ttt-85 -64.88 -42.77 94.55 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.499 1.124 . . . . 71.239999999999995 110.316 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -90.9 41.62 2.91 Favored Glycine 0 CA--C 1.531 1.072 0 O-C-N 124.475 1.11 . . . . 71.329999999999998 110.97 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 202' ' ' PHE . . . . . 0.611 ' CD1' ' C ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -77.63 -47.71 2.36 Favored Pre-proline 0 C--N 1.325 -0.495 0 O-C-N 124.555 0.797 . . . . 71.230000000000004 110.974 -179.983 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 203' ' ' PRO . . . . . 0.654 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.5 Cg_endo -75.02 -25.94 11.35 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.528 1.804 . . . . 73.209999999999994 111.053 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 204' ' ' THR . . . . . 0.453 ' O ' ' HB2' ' A' ' 207' ' ' GLU . 0.8 OUTLIER -61.69 -55.45 30.31 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.572 1.17 . . . . 54.030000000000001 110.407 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 205' ' ' GLN . . . . . 0.463 ' HB2' ' CD2' ' A' ' 195' ' ' LEU . 2.1 mt-30 -54.55 -62.43 1.66 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.599 1.187 . . . . 75.109999999999999 110.377 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 206' ' ' VAL . . . . . 0.852 HG21 HD22 ' A' ' 100' ' ' LEU . 3.2 p -40.75 -30.98 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.518 1.136 . . . . 71.439999999999998 109.351 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 207' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 204' ' ' THR . 0.9 OUTLIER -79.56 -65.88 0.94 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.516 1.135 . . . . 72.209999999999994 110.302 179.969 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . 0.429 ' HD3' ' O ' ' A' ' 204' ' ' THR . 4.8 mpt_? -46.13 -58.0 4.01 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.507 1.129 . . . . 74.319999999999993 110.264 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 209' ' ' ILE . . . . . 0.575 HG22 ' CD1' ' A' ' 210' ' ' PHE . 15.3 mt -54.57 -66.43 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 O-C-N 124.474 1.109 . . . . 65.040000000000006 109.26 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 210' ' ' PHE . . . . . 0.583 ' CD2' HG23 ' A' ' 206' ' ' VAL . 0.4 OUTLIER -90.06 65.95 6.64 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.493 1.121 . . . . 65.510000000000005 111.024 -179.986 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 211' ' ' GLN . . . . . 0.434 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.1 OUTLIER -110.31 146.35 35.88 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.595 1.184 . . . . 72.230000000000004 110.297 -179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . 0.458 ' O ' ' N ' ' A' ' 215' ' ' TYR . 22.8 tt0 -48.88 -55.48 11.6 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 124.441 1.088 . . . . 72.0 110.293 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.41 -24.09 1.14 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.48 1.112 . . . . 74.129999999999995 109.993 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.434 HG23 ' HG2' ' A' ' 211' ' ' GLN . 24.1 t -96.16 -28.46 3.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.559 1.162 . . . . 73.109999999999999 109.297 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 215' ' ' TYR . . . . . 0.458 ' N ' ' O ' ' A' ' 212' ' ' GLU . 12.8 t80 -64.92 -23.41 67.22 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.524 1.14 . . . . 72.209999999999994 111.006 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -66.19 0.58 Allowed 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.525 1.141 . . . . 52.240000000000002 109.264 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 217' ' ' THR . . . . . 0.992 HG22 HD11 ' A' ' 221' ' ' ILE . 25.7 m -41.1 -66.12 0.36 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.514 1.134 . . . . 51.43 110.372 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 218' ' ' GLN . . . . . 0.511 ' HA ' HD12 ' A' ' 221' ' ' ILE . 0.0 OUTLIER -39.66 -53.56 2.15 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.408 1.068 . . . . 61.5 110.292 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 11.8 tp60 -53.92 -53.8 47.63 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.496 1.123 . . . . 64.200000000000003 110.261 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 220' ' ' THR . . . . . 0.428 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 1.3 m -62.87 -19.21 63.92 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.498 1.124 . . . . 64.400000000000006 110.438 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 221' ' ' ILE . . . . . 0.992 HD11 HG22 ' A' ' 217' ' ' THR . 56.3 mt -83.62 -25.36 7.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.525 1.141 . . . . 73.310000000000002 109.328 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 222' ' ' TRP . . . . . 0.787 ' CD1' ' CE2' ' A' ' 167' ' ' TYR . 6.9 t90 -78.13 -43.36 29.06 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.54 1.15 . . . . 73.150000000000006 107.999 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.428 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -68.39 -33.57 74.47 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.542 1.151 . . . . 70.019999999999996 109.313 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . 0.414 ' N ' ' HD3' ' A' ' 223' ' ' LYS . 1.8 mm-40 . . . . . 0 C--N 1.325 -0.47 0 O-C-N 124.538 1.149 . . . . 71.200000000000003 110.367 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.471 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 4.2 p . . . . . 0 N--CA 1.453 -0.277 0 N-CA-C 109.254 -0.647 . . . . 73.129999999999995 109.254 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.411 ' O ' ' C ' ' A' ' 79' ' ' LEU . 20.0 m-85 -88.39 26.88 1.34 Allowed 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.527 1.142 . . . . 74.310000000000002 110.989 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.618 HD23 ' OG ' ' A' ' 132' ' ' SER . 12.4 tp -39.65 152.05 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.497 1.123 . . . . 73.109999999999999 109.337 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.586 ' NZ ' HG23 ' A' ' 106' ' ' ILE . 1.4 ttpt -90.09 -60.4 1.94 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.553 1.158 . . . . 73.25 109.337 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.668 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.6 OUTLIER -161.28 131.61 5.05 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.515 1.134 . . . . 75.409999999999997 111.014 179.968 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.557 HG11 ' HA ' ' A' ' 128' ' ' ALA . 11.6 p -84.73 162.36 2.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 124.463 1.102 . . . . 65.209999999999994 109.29 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.668 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 4.9 mp -125.41 96.25 3.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.48 1.113 . . . . 71.040000000000006 109.274 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.436 ' O ' ' O ' ' A' ' 136' ' ' ILE . 6.8 mt -69.87 123.55 21.77 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.532 1.145 . . . . 74.430000000000007 109.292 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.743 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -146.15 174.46 11.29 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.513 1.133 . . . . 75.299999999999997 109.59 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.468 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -127.91 152.3 48.03 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.509 1.13 . . . . 74.140000000000001 109.366 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -46.31 -24.25 0.46 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.516 1.135 . . . . 75.349999999999994 110.305 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -63.45 -46.52 85.87 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.469 1.106 . . . . 73.209999999999994 109.267 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.449 ' OD1' ' ND2' ' A' ' 178' ' ' ASN . 0.0 OUTLIER -134.91 44.81 2.59 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.435 1.085 . . . . 74.409999999999997 109.307 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.628 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -75.18 -26.58 59.15 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.567 1.167 . . . . 73.310000000000002 110.417 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -82.43 -21.44 35.71 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.576 1.172 . . . . 73.200000000000003 109.314 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.3 -54.89 6.13 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.597 1.185 . . . . 71.319999999999993 110.261 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.734 ' HB2' HD22 ' A' ' 138' ' ' LEU . . . -59.06 -30.48 68.09 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.495 1.122 . . . . 52.140000000000001 109.371 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.783 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -78.62 -51.6 9.65 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.481 1.113 . . . . 62.210000000000001 109.326 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.725 ' N ' HD13 ' A' ' 94' ' ' LEU . 2.2 tmt_? -41.19 -43.19 2.26 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.573 1.17 . . . . 74.549999999999997 110.264 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.55 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 0.3 OUTLIER -75.57 -52.96 16.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.479 1.112 . . . . 73.329999999999998 109.259 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.55 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -48.87 -20.89 0.55 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.436 1.085 . . . . 73.400000000000006 110.304 -179.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.41 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -79.82 -41.2 26.89 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.555 1.16 . . . . 64.120000000000005 109.235 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.706 HD21 ' HZ ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -77.97 -22.09 49.96 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.44 1.088 . . . . 71.209999999999994 109.29 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.705 ' N ' HD23 ' A' ' 99' ' ' LEU . 36.8 mt -67.62 -44.72 77.35 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.513 1.133 . . . . 73.510000000000005 109.299 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -82.04 49.62 1.42 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.443 1.089 . . . . 65.120000000000005 110.237 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -174.44 -64.95 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.571 1.169 . . . . 74.140000000000001 109.294 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -41.56 -52.4 3.73 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.495 1.122 . . . . 70.129999999999995 109.241 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -111.03 -30.03 7.66 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.537 1.148 . . . . 71.409999999999997 110.995 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.464 ' O ' ' CD ' ' A' ' 107' ' ' LYS . . . 109.1 26.97 5.01 Favored Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.581 1.176 . . . . 55.420000000000002 110.979 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.586 HG23 ' NZ ' ' A' ' 80' ' ' LYS . 25.4 mm -70.82 95.42 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 O-C-N 124.473 0.749 . . . . 74.310000000000002 109.257 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.506 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -142.02 158.48 61.76 Favored Pre-proline 0 C--N 1.326 -0.451 0 O-C-N 124.487 1.117 . . . . 73.120000000000005 109.313 179.968 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.506 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.01 161.68 94.36 Favored 'Cis proline' 0 C--N 1.36 1.171 0 C-N-CA 121.009 -2.496 . . . . 73.530000000000001 111.011 0.057 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -117.29 112.12 2.41 Favored Glycine 0 CA--C 1.529 0.948 0 O-C-N 124.46 1.1 . . . . 73.230000000000004 111.009 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.402 HD11 ' C ' ' A' ' 114' ' ' GLU . 0.1 OUTLIER -135.84 128.81 47.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.44 0.729 . . . . 63.520000000000003 109.289 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . 0.743 HD12 ' NE2' ' A' ' 85' ' ' HIS . 43.4 pt -91.44 -176.59 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.528 1.143 . . . . 63.509999999999998 109.306 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -81.67 -19.99 40.5 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.474 1.109 . . . . 52.100000000000001 110.942 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -90.49 -3.45 57.63 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.496 1.122 . . . . 75.140000000000001 109.289 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.402 ' C ' HD11 ' A' ' 110' ' ' ILE . 4.4 mm-40 -110.23 -26.58 9.55 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.577 1.173 . . . . 70.540000000000006 110.306 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 26.8 tpp -38.77 110.88 0.6 Allowed Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.512 1.132 . . . . 73.120000000000005 110.995 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 C--N 1.36 1.141 0 O-C-N 124.481 1.78 . . . . 63.520000000000003 110.951 -179.965 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.69 HD13 ' OH ' ' A' ' 154' ' ' TYR . 0.3 OUTLIER . . . . . 0 N--CA 1.454 -0.234 0 N-CA-C 109.287 -0.634 . . . . 74.439999999999998 109.287 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.4 ' C ' ' O ' ' A' ' 125' ' ' LEU . 0.7 OUTLIER -40.14 -30.02 0.09 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.557 1.161 . . . . 53.210000000000001 109.36 179.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.434 ' N ' ' C ' ' A' ' 125' ' ' LEU . 1.0 OUTLIER -57.78 -53.42 58.37 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.474 1.109 . . . . 71.510000000000005 109.316 179.919 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.557 ' HA ' HG11 ' A' ' 82' ' ' VAL . . . -67.21 -25.13 65.96 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.573 1.17 . . . . 72.109999999999999 109.298 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.609 ' O ' HG12 ' A' ' 129' ' ' VAL . 67.2 t -89.99 15.62 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.429 1.08 . . . . 73.319999999999993 109.263 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . 0.406 ' O ' ' C ' ' A' ' 131' ' ' GLY . 3.9 m-20 -129.85 165.79 21.3 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.519 1.137 . . . . 74.329999999999998 109.276 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . 0.406 ' C ' ' O ' ' A' ' 130' ' ' ASN . . . 37.15 54.43 1.56 Allowed Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.448 1.093 . . . . 65.400000000000006 111.027 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . 0.618 ' OG ' HD23 ' A' ' 79' ' ' LEU . 7.8 m -163.33 174.23 12.26 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.484 0.755 . . . . 73.230000000000004 110.022 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.871 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -105.45 -28.12 11.03 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.537 1.148 . . . . 62.200000000000003 109.258 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.871 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.1 m-90 -161.95 178.71 8.64 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.974 -1.121 . . . . 74.129999999999995 107.974 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . 0.47 ' OG1' ' HA ' ' A' ' 170' ' ' VAL . 74.8 p -147.64 135.46 21.1 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.464 1.103 . . . . 44.350000000000001 110.359 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.638 ' HB ' HG23 ' A' ' 83' ' ' ILE . 6.9 mm -84.18 97.76 5.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 124.49 1.119 . . . . 73.340000000000003 109.304 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.527 ' O ' HD13 ' A' ' 139' ' ' LEU . 3.0 mm? -77.89 87.41 4.09 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.499 1.125 . . . . 54.439999999999998 109.374 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.734 HD22 ' HB2' ' A' ' 93' ' ' ALA . 2.3 tp -62.07 103.12 0.34 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.514 1.134 . . . . 72.209999999999994 109.318 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.527 HD13 ' O ' ' A' ' 137' ' ' LEU . 0.0 OUTLIER -75.25 106.46 6.78 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.435 1.085 . . . . 74.299999999999997 109.328 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . 0.503 ' O ' ' CB ' ' A' ' 144' ' ' LEU . 2.5 m -135.24 162.64 31.98 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.344 1.027 . . . . 62.119999999999997 110.459 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -63.44 -34.8 78.54 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.507 1.129 . . . . 73.329999999999998 110.227 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . 0.425 ' ND2' ' H ' ' A' ' 142' ' ' ASN . 1.9 p30 -89.35 -53.34 4.59 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.569 1.168 . . . . 71.340000000000003 109.262 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.592 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 31.2 t80 -53.32 -36.88 61.75 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.528 1.143 . . . . 52.219999999999999 110.958 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.699 HD13 ' C ' ' A' ' 144' ' ' LEU . 2.1 tm? -60.81 -68.15 0.33 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.471 1.107 . . . . 73.120000000000005 109.293 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.517 ' N ' HD13 ' A' ' 144' ' ' LEU . 6.8 mmt85 -55.01 -18.97 5.84 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.461 1.101 . . . . 65.25 110.344 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -75.57 -73.12 0.27 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.504 1.128 . . . . 71.310000000000002 109.253 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.51 ' CG2' ' N ' ' A' ' 148' ' ' TRP . 1.2 t -65.79 -52.02 54.25 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.502 1.126 . . . . 72.120000000000005 110.317 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.585 ' HB2' HD22 ' A' ' 144' ' ' LEU . 22.7 t-105 -43.5 -50.99 6.95 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.578 1.174 . . . . 74.219999999999999 107.971 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' CYS . . . . . 0.404 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 4.6 t -47.31 -45.86 24.74 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.482 1.114 . . . . 75.150000000000006 108.329 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' ASN . . . . . 0.455 ' N ' ' O ' ' A' ' 147' ' ' THR . 23.3 m120 -64.36 -56.66 12.86 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.458 1.099 . . . . 72.099999999999994 109.316 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 1.004 ' CZ ' HD22 ' A' ' 157' ' ' LEU . 8.6 m-30 -42.93 -38.05 2.08 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.492 1.12 . . . . 73.109999999999999 111.005 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -61.29 -45.02 96.2 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.54 1.15 . . . . 72.140000000000001 110.261 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.433 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 1.7 t80 -56.6 -25.68 53.49 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.518 1.136 . . . . 73.420000000000002 110.986 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.69 ' OH ' HD13 ' A' ' 125' ' ' LEU . 20.3 p90 -163.61 125.43 2.43 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.45 1.094 . . . . 75.530000000000001 110.982 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.517 HG23 ' OD1' ' A' ' 159' ' ' ASN . 6.3 t -70.39 -6.07 32.88 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.505 1.128 . . . . 74.439999999999998 110.47 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 1.6 m -39.51 -63.65 0.55 Allowed 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.493 1.121 . . . . 55.310000000000002 109.948 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 1.004 HD22 ' CZ ' ' A' ' 151' ' ' PHE . 2.9 tt -64.89 -40.28 94.84 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.514 1.133 . . . . 74.439999999999998 109.281 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' MET . . . . . 0.567 ' CE ' HG21 ' A' ' 161' ' ' VAL . 3.4 tpt -58.76 -15.18 11.0 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.494 1.121 . . . . 73.420000000000002 111.027 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' ASN . . . . . 0.517 ' OD1' HG23 ' A' ' 155' ' ' THR . 37.7 m-20 -81.59 -44.89 16.63 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.44 1.087 . . . . 72.150000000000006 109.339 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.63 -20.63 61.26 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.466 1.104 . . . . 70.019999999999996 110.069 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . 0.812 ' O ' HD13 ' A' ' 192' ' ' ILE . 4.4 t -64.21 -18.01 22.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.571 1.17 . . . . 75.200000000000003 109.34 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -86.48 10.23 15.85 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.467 1.104 . . . . 73.299999999999997 109.3 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.61 ' CZ ' HG23 ' A' ' 192' ' ' ILE . 0.7 OUTLIER 53.29 63.63 2.15 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.54 1.15 . . . . 75.540000000000006 110.32 179.97 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . 0.414 ' NE2' ' HB3' ' A' ' 159' ' ' ASN . 19.7 mt-30 -62.35 -174.49 0.06 Allowed 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.552 1.157 . . . . 73.430000000000007 110.222 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -99.77 38.26 1.48 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.52 1.138 . . . . 72.239999999999995 109.567 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -100.9 162.26 13.03 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.586 1.178 . . . . 70.420000000000002 109.284 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 167' ' ' TYR . . . . . 0.527 ' CD1' ' C ' ' A' ' 167' ' ' TYR . 3.2 p90 -66.89 -9.09 34.29 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 124.402 1.064 . . . . 71.140000000000001 111.014 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . 0.438 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 0.1 OUTLIER -112.01 130.13 55.97 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.506 1.129 . . . . 75.349999999999994 109.32 -179.967 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.496 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 1.2 m -128.53 172.93 10.7 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.511 1.132 . . . . 74.219999999999999 109.997 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.503 ' O ' HD13 ' A' ' 171' ' ' ILE . 0.9 OUTLIER -151.95 119.87 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.412 1.07 . . . . 73.129999999999995 109.284 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.61 HG22 ' HB2' ' A' ' 195' ' ' LEU . 11.5 mm -111.29 121.0 41.57 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 124.576 1.173 . . . . 51.399999999999999 109.308 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . 0.723 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.92 106.9 2.36 Favored 'Trans proline' 0 C--N 1.36 1.139 0 O-C-N 124.479 1.779 . . . . 53.409999999999997 110.997 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . 0.589 ' HE2' ' HG2' ' A' ' 197' ' ' GLU . 4.0 ttt -94.22 153.5 18.03 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.481 1.113 . . . . 74.030000000000001 110.989 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . 0.436 ' N ' ' HG2' ' A' ' 173' ' ' MET . 41.8 ttm-85 -114.39 126.28 28.17 Favored Pre-proline 0 C--N 1.326 -0.448 0 O-C-N 124.477 1.11 . . . . 75.150000000000006 110.345 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 175' ' ' PRO . . . . . 0.446 ' C ' HD23 ' A' ' 176' ' ' LEU . 18.3 Cg_endo -75.0 157.49 42.74 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.443 1.76 . . . . 73.239999999999995 111.034 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . 0.944 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.2 OUTLIER -99.58 -50.85 3.93 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.459 1.099 . . . . 62.219999999999999 109.289 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -71.74 -22.13 61.66 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.465 1.103 . . . . 72.120000000000005 109.321 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 178' ' ' ASN . . . . . 0.449 ' ND2' ' OD1' ' A' ' 89' ' ' ASP . 0.4 OUTLIER -107.67 107.79 60.77 Favored Pre-proline 0 C--N 1.325 -0.484 0 O-C-N 124.474 1.109 . . . . 64.030000000000001 109.335 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.96 127.54 10.79 Favored 'Trans proline' 0 C--N 1.36 1.158 0 O-C-N 124.543 1.812 . . . . 64.140000000000001 111.047 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.609 HD13 ' HB2' ' A' ' 184' ' ' ARG . 0.4 OUTLIER -141.27 96.66 7.05 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.524 1.14 . . . . 73.230000000000004 109.274 179.976 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.02 168.96 23.66 Favored 'Trans proline' 0 C--N 1.36 1.166 0 O-C-N 124.495 1.787 . . . . 55.340000000000003 111.021 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . 0.424 ' CB ' ' OE1' ' A' ' 190' ' ' GLN . 0.2 OUTLIER -58.45 -28.42 65.28 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.511 1.132 . . . . 73.450000000000003 110.327 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -62.85 -12.74 26.79 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.425 1.078 . . . . 72.450000000000003 110.339 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 184' ' ' ARG . . . . . 0.609 ' HB2' HD13 ' A' ' 180' ' ' LEU . 39.4 mmt180 -112.87 -28.26 7.81 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.467 1.104 . . . . 75.239999999999995 110.255 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 185' ' ' THR . . . . . 0.561 HG23 ' HD2' ' A' ' 186' ' ' PRO . 31.3 m -80.0 144.13 58.64 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.417 1.073 . . . . 73.129999999999995 110.342 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 186' ' ' PRO . . . . . 0.715 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.2 Cg_endo -74.98 147.45 34.01 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.59 1.837 . . . . 74.430000000000007 110.995 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 187' ' ' PHE . . . . . 0.506 ' O ' HG23 ' A' ' 191' ' ' THR . 4.4 p90 -63.21 -11.34 20.28 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.489 1.118 . . . . 74.0 111.039 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . 0.675 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -87.96 -54.12 4.39 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.545 1.153 . . . . 73.099999999999994 109.298 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.746 HD23 HG13 ' A' ' 161' ' ' VAL . 24.8 mt -72.61 -19.41 61.47 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.525 1.141 . . . . 70.409999999999997 109.333 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 190' ' ' GLN . . . . . 0.484 ' O ' ' CG ' ' A' ' 190' ' ' GLN . 7.4 tt0 -86.54 -0.52 56.28 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.596 1.185 . . . . 62.299999999999997 110.295 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 191' ' ' THR . . . . . 0.506 HG23 ' O ' ' A' ' 187' ' ' PHE . 69.1 p -130.21 18.59 5.43 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.453 1.095 . . . . 75.0 110.39 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.812 HD13 ' O ' ' A' ' 161' ' ' VAL . 3.1 mt -127.79 154.63 38.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.483 1.114 . . . . 73.099999999999994 109.269 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 193' ' ' ASN . . . . . 0.455 ' ND2' HD11 ' A' ' 209' ' ' ILE . 29.8 t30 -51.52 92.38 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.433 1.083 . . . . 71.319999999999993 109.266 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . 0.723 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -90.79 143.54 26.62 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.546 1.153 . . . . 54.229999999999997 109.343 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 195' ' ' LEU . . . . . 0.61 ' HB2' HG22 ' A' ' 171' ' ' ILE . 0.2 OUTLIER -76.56 150.0 36.57 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 65.299999999999997 109.331 -179.971 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . 0.454 ' H ' HD13 ' A' ' 195' ' ' LEU . 64.1 mt-10 -143.42 132.98 23.58 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.499 1.124 . . . . 65.319999999999993 110.271 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.944 ' HG3' HD21 ' A' ' 176' ' ' LEU . 0.6 OUTLIER -113.86 -16.81 12.17 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 124.487 1.117 . . . . 62.299999999999997 110.248 -179.998 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . 0.834 ' HB3' HD22 ' A' ' 176' ' ' LEU . 0.3 OUTLIER -95.71 5.07 52.3 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.436 1.085 . . . . 73.099999999999994 110.266 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.92 172.91 6.93 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.523 1.139 . . . . 72.109999999999999 110.034 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -85.4 -18.39 33.82 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.468 1.105 . . . . 51.439999999999998 110.279 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -104.42 24.05 29.94 Favored Glycine 0 CA--C 1.53 1.024 0 O-C-N 124.464 1.102 . . . . 63.409999999999997 111.088 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 202' ' ' PHE . . . . . 0.849 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.2 OUTLIER -59.2 -43.01 96.26 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.521 0.777 . . . . 71.510000000000005 110.987 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 203' ' ' PRO . . . . . 0.623 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.2 Cg_endo -75.04 -35.55 3.04 Favored 'Trans proline' 0 C--N 1.36 1.158 0 O-C-N 124.566 1.824 . . . . 71.510000000000005 111.018 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.92 -57.03 12.48 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.527 1.142 . . . . 71.439999999999998 110.433 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 205' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' A' ' 209' ' ' ILE . 3.0 mt-30 -61.92 -48.73 79.15 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.543 1.152 . . . . 73.310000000000002 110.357 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 206' ' ' VAL . . . . . 0.849 HG23 ' O ' ' A' ' 202' ' ' PHE . 92.7 t -57.25 -29.97 33.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 124.473 1.108 . . . . 65.120000000000005 109.284 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -79.42 -41.12 28.37 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.457 1.098 . . . . 74.439999999999998 110.266 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -75.45 -68.09 0.6 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.514 1.134 . . . . 71.140000000000001 110.311 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 209' ' ' ILE . . . . . 0.752 HG22 ' CD1' ' A' ' 210' ' ' PHE . 98.0 mt -40.42 -48.03 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.447 1.092 . . . . 74.109999999999999 109.261 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 210' ' ' PHE . . . . . 0.752 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.9 m-85 -105.71 75.7 1.15 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.492 1.12 . . . . 65.120000000000005 110.981 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 211' ' ' GLN . . . . . 0.486 ' CG ' ' HB ' ' A' ' 214' ' ' VAL . 10.3 pt20 -111.32 141.7 44.52 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.512 1.132 . . . . 70.230000000000004 110.277 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . 0.565 ' HA ' ' CD2' ' A' ' 215' ' ' TYR . 16.1 tt0 -53.08 -48.38 67.79 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.448 1.093 . . . . 62.25 110.265 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.4 t -52.58 -18.61 1.82 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.421 1.076 . . . . 64.239999999999995 109.969 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.486 ' HB ' ' CG ' ' A' ' 211' ' ' GLN . 2.3 t -97.66 -44.52 12.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 124.534 1.146 . . . . 74.439999999999998 109.276 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 215' ' ' TYR . . . . . 0.565 ' CD2' ' HA ' ' A' ' 212' ' ' GLU . 9.5 m-30 -37.39 -32.36 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.452 1.095 . . . . 75.299999999999997 110.964 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . 0.513 ' N ' ' CD ' ' A' ' 216' ' ' LYS . 5.6 mmtt -68.51 -54.59 15.87 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.482 1.113 . . . . 73.450000000000003 109.324 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 217' ' ' THR . . . . . 0.446 ' N ' ' O ' ' A' ' 214' ' ' VAL . 1.5 m -40.24 -66.41 0.31 Allowed 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.559 1.162 . . . . 70.209999999999994 110.46 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 218' ' ' GLN . . . . . 0.582 ' HA ' HD12 ' A' ' 221' ' ' ILE . 2.8 mp0 -46.76 -59.94 2.72 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.492 1.12 . . . . 74.200000000000003 110.272 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 219' ' ' GLN . . . . . 0.471 ' O ' ' N ' ' A' ' 223' ' ' LYS . 28.9 tp60 -41.34 -61.12 1.09 Allowed 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.556 1.16 . . . . 74.239999999999995 110.357 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.1 m -46.22 -45.94 17.32 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.528 1.142 . . . . 72.25 110.369 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 221' ' ' ILE . . . . . 0.582 HD12 ' HA ' ' A' ' 218' ' ' GLN . 6.5 mt -66.95 -29.59 46.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.46 1.1 . . . . 74.540000000000006 109.334 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 222' ' ' TRP . . . . . 0.471 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 14.3 t90 -81.63 -19.44 41.78 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.574 1.171 . . . . 74.340000000000003 108.07 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.471 ' N ' ' O ' ' A' ' 219' ' ' GLN . 0.0 OUTLIER -91.86 -20.06 21.85 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.486 1.116 . . . . 63.329999999999998 109.386 179.93 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 . . . . . 0 C--N 1.325 -0.482 0 O-C-N 124.526 1.141 . . . . 72.230000000000004 110.276 -179.959 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.468 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 6.3 p . . . . . 0 N--CA 1.453 -0.314 0 N-CA-C 109.32 -0.622 . . . . 71.129999999999995 109.32 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.558 ' CG ' ' O ' ' A' ' 78' ' ' PHE . 28.7 t80 -86.63 22.02 2.02 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.492 1.12 . . . . 73.430000000000007 110.937 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.406 ' C ' ' O ' ' A' ' 78' ' ' PHE . 6.6 tp -39.91 151.55 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.519 1.137 . . . . 74.239999999999995 109.198 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.433 ' HD3' HG23 ' A' ' 106' ' ' ILE . 8.3 ttmt -91.04 -60.65 1.85 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.535 1.147 . . . . 75.010000000000005 109.307 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.676 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.3 OUTLIER -161.44 136.46 7.42 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.424 1.078 . . . . 70.310000000000002 110.974 179.966 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.551 HG11 ' HA ' ' A' ' 128' ' ' ALA . 4.0 p -89.36 167.71 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 O-C-N 124.515 1.135 . . . . 70.420000000000002 109.35 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.792 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.2 mp -131.35 96.76 2.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.466 1.104 . . . . 62.039999999999999 109.308 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.437 ' HG ' ' CB ' ' A' ' 128' ' ' ALA . 3.1 mt -72.92 118.9 16.43 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.505 1.128 . . . . 70.120000000000005 109.296 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.742 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -141.18 174.46 10.51 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.425 1.078 . . . . 62.039999999999999 109.529 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.612 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -105.14 156.46 18.07 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.493 1.12 . . . . 71.510000000000005 109.254 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.71 -14.54 21.62 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.517 1.135 . . . . 75.530000000000001 110.317 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -84.52 -46.3 11.74 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.499 1.124 . . . . 75.450000000000003 109.316 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.728 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.5 OUTLIER -112.1 43.72 1.54 Allowed 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.519 1.137 . . . . 74.219999999999999 109.311 179.976 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.601 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -80.09 -22.25 42.41 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.55 1.156 . . . . 72.129999999999995 110.418 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -83.36 -27.21 29.83 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.425 1.078 . . . . 70.299999999999997 109.241 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -70.78 -55.56 8.3 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.529 1.143 . . . . 74.219999999999999 110.363 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.742 ' HB3' ' HD2' ' A' ' 85' ' ' HIS . . . -58.79 -34.74 71.82 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.483 1.114 . . . . 75.409999999999997 109.261 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.983 ' HB2' HD13 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -73.57 -41.6 62.69 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.532 1.145 . . . . 73.120000000000005 109.315 -179.994 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.644 ' N ' HD13 ' A' ' 94' ' ' LEU . 27.0 tpt180 -51.03 -31.17 17.54 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.479 1.112 . . . . 50.039999999999999 110.314 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.813 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.0 t -82.88 -63.69 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.437 1.085 . . . . 65.349999999999994 109.221 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.584 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -41.49 -26.27 0.06 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.473 1.108 . . . . 71.430000000000007 110.34 -180.0 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.447 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.5 t-20 -71.68 -49.69 37.4 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.496 1.123 . . . . 63.340000000000003 109.347 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.845 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -73.79 -22.88 59.67 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.463 1.102 . . . . 73.219999999999999 109.267 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.845 ' N ' HD23 ' A' ' 99' ' ' LEU . 37.2 mt -63.27 -55.26 26.25 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.528 1.143 . . . . 75.129999999999995 109.291 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.67 59.35 1.16 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.459 1.099 . . . . 71.150000000000006 110.224 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.4 t70 175.87 -65.99 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.552 1.158 . . . . 60.43 109.254 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -42.77 -55.07 3.8 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.434 1.084 . . . . 60.030000000000001 109.25 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.592 ' CZ ' HG11 ' A' ' 206' ' ' VAL . 1.9 m-85 -111.92 -20.22 12.09 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.488 1.118 . . . . 71.140000000000001 110.976 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.54 45.92 3.6 Favored Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.512 1.133 . . . . 64.230000000000004 110.997 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.433 HG23 ' HD3' ' A' ' 80' ' ' LYS . 7.2 mm -88.0 90.45 3.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.517 0.775 . . . . 74.150000000000006 109.279 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.517 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -137.7 158.24 72.06 Favored Pre-proline 0 C--N 1.324 -0.507 0 O-C-N 124.496 1.122 . . . . 74.329999999999998 109.29 -179.969 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.517 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -74.96 150.3 95.24 Favored 'Cis proline' 0 C--N 1.36 1.14 0 C-N-CA 121.0 -2.5 . . . . 71.409999999999997 110.983 -0.046 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -119.69 132.38 9.44 Favored Glycine 0 CA--C 1.531 1.061 0 O-C-N 124.491 1.12 . . . . 74.519999999999996 110.885 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.453 ' CD1' ' HA ' ' A' ' 115' ' ' MET . 0.4 OUTLIER -151.41 144.09 16.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.581 0.812 . . . . 71.230000000000004 109.255 179.95 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . 0.983 HD13 ' HB2' ' A' ' 94' ' ' LEU . 38.6 pt -97.17 177.02 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 O-C-N 124.528 1.143 . . . . 74.329999999999998 109.273 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.459 ' CD1' ' SD ' ' A' ' 115' ' ' MET . 1.8 t80 -76.13 -18.7 59.03 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.555 1.159 . . . . 75.310000000000002 110.975 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -95.97 -2.32 47.26 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.556 1.16 . . . . 63.210000000000001 109.303 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.427 ' HB2' ' CG1' ' A' ' 111' ' ' ILE . 5.5 mt-10 -111.35 -26.56 9.06 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.458 1.099 . . . . 65.310000000000002 110.234 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.459 ' SD ' ' CD1' ' A' ' 112' ' ' PHE . 1.2 ptp -70.88 134.89 85.6 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.532 1.145 . . . . 75.129999999999995 110.977 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo . . . . . 0 C--N 1.36 1.149 0 O-C-N 124.498 1.788 . . . . 72.150000000000006 111.034 179.919 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.774 HD22 ' ND2' ' A' ' 150' ' ' ASN . 0.9 OUTLIER . . . . . 0 N--CA 1.453 -0.28 0 N-CA-C 109.363 -0.606 . . . . 55.25 109.363 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.404 ' O ' ' N ' ' A' ' 129' ' ' VAL . 0.7 OUTLIER -41.23 -30.01 0.15 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.502 1.126 . . . . 74.409999999999997 109.345 179.928 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.414 ' N ' ' C ' ' A' ' 125' ' ' LEU . 3.8 t0 -44.35 -51.66 8.32 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.484 1.115 . . . . 55.109999999999999 109.266 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.551 ' HA ' HG11 ' A' ' 82' ' ' VAL . . . -66.12 -34.42 78.01 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.514 1.134 . . . . 75.030000000000001 109.288 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.745 ' O ' HG12 ' A' ' 129' ' ' VAL . 70.2 t -92.99 30.64 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.501 1.126 . . . . 71.299999999999997 109.382 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -131.75 130.47 41.93 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.479 1.112 . . . . 73.099999999999994 109.36 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 48.5 72.62 0.43 Allowed Glycine 0 CA--C 1.531 1.063 0 O-C-N 124.488 1.118 . . . . 43.530000000000001 110.985 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.3 m -160.71 167.82 26.11 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.578 0.811 . . . . 74.530000000000001 110.047 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.809 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -100.07 -33.89 10.29 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.428 1.08 . . . . 61.130000000000003 109.317 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.809 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.0 OUTLIER -161.87 151.74 16.66 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.608 1.192 . . . . 71.439999999999998 107.965 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 47.2 p -120.22 145.37 47.08 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.466 1.104 . . . . 73.25 110.419 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.831 ' O ' HD13 ' A' ' 137' ' ' LEU . 20.6 mm -99.25 131.01 47.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.495 1.122 . . . . 62.539999999999999 109.351 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.831 HD13 ' O ' ' A' ' 136' ' ' ILE . 0.4 OUTLIER -124.74 99.65 6.26 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.493 1.121 . . . . 64.319999999999993 109.328 -179.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.728 HD23 ' HB2' ' A' ' 89' ' ' ASP . 0.1 OUTLIER -62.22 90.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.425 1.078 . . . . 73.140000000000001 109.243 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.53 HD11 HD13 ' A' ' 189' ' ' LEU . 0.9 OUTLIER -60.34 103.01 0.2 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.527 1.142 . . . . 71.549999999999997 109.312 179.976 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . 0.604 HG22 ' H ' ' A' ' 141' ' ' GLU . 6.7 m -130.49 179.95 5.63 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.426 1.079 . . . . 52.009999999999998 110.427 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . 0.604 ' H ' HG22 ' A' ' 140' ' ' THR . 33.9 mt-10 -75.54 -39.55 58.11 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.466 1.104 . . . . 75.230000000000004 110.313 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -89.46 -50.85 5.86 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.556 1.16 . . . . 73.200000000000003 109.352 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.612 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 52.9 t80 -50.26 -21.24 1.29 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 71.239999999999995 110.94 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.706 HD13 ' C ' ' A' ' 144' ' ' LEU . 1.8 tm? -64.45 -67.84 0.4 Allowed 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.53 1.143 . . . . 71.140000000000001 109.253 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.619 ' N ' HD13 ' A' ' 144' ' ' LEU . 0.0 OUTLIER -60.18 -15.29 22.81 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.521 1.138 . . . . 74.340000000000003 110.247 -179.957 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -67.5 -64.57 0.83 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.467 1.104 . . . . 72.099999999999994 109.277 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.515 HG23 ' CE2' ' A' ' 151' ' ' PHE . 1.0 OUTLIER -85.43 -48.18 9.25 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.502 1.126 . . . . 34.420000000000002 110.41 179.961 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.622 ' HB2' HD22 ' A' ' 144' ' ' LEU . 26.0 t-105 -42.51 -48.34 5.26 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.577 1.173 . . . . 65.310000000000002 108.022 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' CYS . . . . . 0.445 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 27.0 t -65.14 -44.98 86.87 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.495 1.122 . . . . 53.409999999999997 108.242 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' ASN . . . . . 0.774 ' ND2' HD22 ' A' ' 125' ' ' LEU . 0.3 OUTLIER -48.13 -41.28 26.12 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.589 1.18 . . . . 75.329999999999998 109.331 -179.978 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.685 ' HE1' HD11 ' A' ' 125' ' ' LEU . 14.4 m-30 -66.99 -35.85 80.86 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.482 1.114 . . . . 64.299999999999997 111.01 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -49.25 -46.44 46.13 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.486 1.116 . . . . 61.329999999999998 110.332 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -85.33 -15.19 44.09 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.532 1.145 . . . . 61.310000000000002 111.04 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -132.9 85.66 2.24 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.501 1.125 . . . . 74.310000000000002 111.036 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.58 -14.25 40.47 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 124.526 1.141 . . . . 75.239999999999995 110.402 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 23.2 m -53.68 -22.89 9.84 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.471 1.107 . . . . 61.100000000000001 109.978 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.562 HD12 ' CE1' ' A' ' 151' ' ' PHE . 0.6 OUTLIER -82.89 -45.89 13.66 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.467 1.105 . . . . 72.409999999999997 109.251 -179.95 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' MET . . . . . 0.544 ' CE ' HG21 ' A' ' 161' ' ' VAL . 26.6 mmt -42.34 -32.74 0.55 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.507 1.129 . . . . 71.510000000000005 111.026 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -65.27 -49.77 68.29 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.524 1.14 . . . . 73.209999999999994 109.313 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 160' ' ' SER . . . . . 0.718 ' HB2' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -68.66 -29.04 67.43 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.527 1.142 . . . . 61.450000000000003 109.994 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . 0.544 HG21 ' CE ' ' A' ' 158' ' ' MET . 6.2 t -55.06 -19.49 4.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.543 1.152 . . . . 71.209999999999994 109.344 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 162' ' ' ASN . . . . . 0.468 ' O ' ' N ' ' A' ' 164' ' ' GLN . 6.6 t-20 -91.05 20.84 4.62 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.539 1.149 . . . . 74.450000000000003 109.321 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.43 ' C ' ' O ' ' A' ' 162' ' ' ASN . 0.5 OUTLIER 35.6 33.55 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.514 1.133 . . . . 75.530000000000001 110.297 -179.956 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . 0.468 ' N ' ' O ' ' A' ' 162' ' ' ASN . 2.6 mt-30 -48.22 176.74 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.49 1.118 . . . . 54.210000000000001 110.291 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 165' ' ' HIS . . . . . 0.428 ' CD2' ' H ' ' A' ' 165' ' ' HIS . 2.9 p80 -93.42 71.96 4.41 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.425 1.078 . . . . 62.140000000000001 109.586 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.554 ' HG3' ' CD2' ' A' ' 167' ' ' TYR . 2.2 tppt? -123.13 157.12 33.61 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.551 1.157 . . . . 72.439999999999998 109.306 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 167' ' ' TYR . . . . . 0.62 ' CD1' ' N ' ' A' ' 168' ' ' ASN . 45.0 p90 -38.75 -45.94 1.19 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.501 1.126 . . . . 74.420000000000002 110.99 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . 0.666 ' ND2' HG13 ' A' ' 129' ' ' VAL . 1.7 p-10 -99.34 129.92 45.59 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.482 1.114 . . . . 75.319999999999993 109.237 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.483 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 14.0 m -110.73 158.35 18.75 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.457 1.098 . . . . 61.439999999999998 109.968 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.718 HG21 ' HB2' ' A' ' 160' ' ' SER . 42.9 t -116.56 111.35 34.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.481 1.113 . . . . 63.329999999999998 109.323 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.502 HG22 ' HB2' ' A' ' 195' ' ' LEU . 21.9 mm -122.86 93.75 48.06 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.514 1.134 . . . . 60.210000000000001 109.325 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . 0.953 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 17.9 Cg_endo -75.01 107.65 2.53 Favored 'Trans proline' 0 C--N 1.36 1.142 0 O-C-N 124.566 1.824 . . . . 72.310000000000002 110.976 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . 0.813 ' HE1' HG21 ' A' ' 96' ' ' VAL . 4.1 ttt -83.65 152.8 24.59 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.475 1.109 . . . . 65.540000000000006 110.996 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . 0.414 ' N ' ' HG2' ' A' ' 173' ' ' MET . 25.5 mmm-85 -110.88 118.21 48.77 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.453 1.096 . . . . 71.340000000000003 110.32 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 175' ' ' PRO . . . . . 0.644 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -75.0 154.96 42.86 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.508 1.794 . . . . 71.349999999999994 111.012 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . 0.866 HD21 ' CG ' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -95.58 -38.09 10.56 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 124.53 1.144 . . . . 70.430000000000007 109.372 179.951 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . 0.452 HD22 ' N ' ' A' ' 177' ' ' ASN . 1.4 m-80 -72.8 -22.38 60.83 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.461 1.101 . . . . 75.109999999999999 109.35 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -110.42 108.35 58.44 Favored Pre-proline 0 C--N 1.326 -0.441 0 O-C-N 124.44 1.087 . . . . 51.210000000000001 109.275 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.96 124.06 8.37 Favored 'Trans proline' 0 C--N 1.36 1.149 0 O-C-N 124.5 1.789 . . . . 74.340000000000003 110.987 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -139.94 96.98 8.09 Favored Pre-proline 0 C--N 1.324 -0.525 0 O-C-N 124.49 1.119 . . . . 72.450000000000003 109.354 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.02 155.43 42.82 Favored 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.474 1.776 . . . . 75.340000000000003 111.012 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.2 -28.3 39.9 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 124.541 1.151 . . . . 71.230000000000004 110.232 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -53.55 -29.33 36.5 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.496 1.122 . . . . 74.319999999999993 110.346 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 27.4 mmt180 -99.42 -16.72 18.28 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.492 1.12 . . . . 64.230000000000004 110.282 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 185' ' ' THR . . . . . 0.485 HG22 ' HD2' ' A' ' 186' ' ' PRO . 20.8 m -80.08 144.02 58.12 Favored Pre-proline 0 C--N 1.325 -0.458 0 O-C-N 124.534 1.146 . . . . 72.200000000000003 110.382 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 186' ' ' PRO . . . . . 0.788 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -74.96 155.58 43.12 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.466 1.771 . . . . 75.439999999999998 110.974 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 187' ' ' PHE . . . . . 0.509 ' O ' ' CG2' ' A' ' 191' ' ' THR . 7.7 p90 -69.44 -7.09 34.71 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.462 1.101 . . . . 72.439999999999998 110.972 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . 0.453 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -94.08 -52.88 4.19 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.484 1.115 . . . . 73.430000000000007 109.314 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.788 HD12 ' CG ' ' A' ' 186' ' ' PRO . 48.3 mt -68.48 -42.28 78.93 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.494 1.121 . . . . 72.329999999999998 109.365 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 190' ' ' GLN . . . . . 0.411 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.2 pt20 -64.04 -10.46 22.15 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 124.45 1.094 . . . . 72.329999999999998 110.306 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 191' ' ' THR . . . . . 0.509 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 33.5 p -113.4 17.74 18.24 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 124.525 1.141 . . . . 72.299999999999997 110.396 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.476 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 4.8 mt -117.57 157.87 18.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.54 1.15 . . . . 52.310000000000002 109.334 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 193' ' ' ASN . . . . . 0.407 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 28.7 t30 -78.58 70.33 4.91 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.551 1.157 . . . . 63.32 109.305 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . 0.953 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -61.76 178.21 0.35 Allowed 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.494 1.121 . . . . 72.299999999999997 109.267 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 195' ' ' LEU . . . . . 0.642 HD23 HD12 ' A' ' 209' ' ' ILE . 0.8 OUTLIER -105.88 122.99 47.25 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.465 1.103 . . . . 74.299999999999997 109.314 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -102.27 141.82 34.5 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.423 1.077 . . . . 74.230000000000004 110.332 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.866 ' CG ' HD21 ' A' ' 176' ' ' LEU . 15.5 tp10 -111.67 -22.27 11.27 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.488 1.118 . . . . 63.130000000000003 110.292 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . 0.403 ' HB3' HD12 ' A' ' 176' ' ' LEU . 2.4 pp20? -106.2 11.24 31.45 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.548 1.155 . . . . 74.439999999999998 110.268 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 32.8 t -94.68 171.5 8.75 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.523 1.139 . . . . 41.130000000000003 110.028 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -77.74 -42.16 35.2 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.511 1.132 . . . . 65.540000000000006 110.34 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -90.33 16.74 56.81 Favored Glycine 0 CA--C 1.53 1.009 0 O-C-N 124.442 1.089 . . . . 63.340000000000003 111.018 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 202' ' ' PHE . . . . . 0.619 ' C ' ' CD1' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -48.75 -47.58 71.89 Favored Pre-proline 0 C--N 1.326 -0.454 0 O-C-N 124.532 0.784 . . . . 61.240000000000002 111.013 -179.991 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 203' ' ' PRO . . . . . 0.642 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.0 Cg_endo -75.04 -28.11 9.38 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.533 1.807 . . . . 74.230000000000004 110.969 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.88 -48.01 80.85 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.412 1.07 . . . . 74.150000000000006 110.439 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 205' ' ' GLN . . . . . 0.473 ' HB2' ' CD2' ' A' ' 195' ' ' LEU . 9.3 mt-30 -60.89 -61.91 2.24 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.477 1.111 . . . . 72.430000000000007 110.299 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 206' ' ' VAL . . . . . 0.693 HG21 ' CD2' ' A' ' 100' ' ' LEU . 2.7 p -39.58 -34.05 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 124.547 1.154 . . . . 74.450000000000003 109.298 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 207' ' ' GLU . . . . . 0.404 ' N ' ' C ' ' A' ' 205' ' ' GLN . 3.2 mm-40 -75.06 -65.06 0.92 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.486 1.116 . . . . 75.140000000000001 110.265 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -49.62 -59.58 3.65 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.567 1.167 . . . . 74.239999999999995 110.337 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 209' ' ' ILE . . . . . 0.731 HG22 ' CD1' ' A' ' 210' ' ' PHE . 64.5 mt -50.04 -68.82 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.436 1.085 . . . . 53.149999999999999 109.335 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 210' ' ' PHE . . . . . 0.731 ' CD1' HG22 ' A' ' 209' ' ' ILE . 0.4 OUTLIER -89.42 66.92 7.57 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.491 1.12 . . . . 73.200000000000003 110.999 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 211' ' ' GLN . . . . . 0.532 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.2 OUTLIER -110.48 148.19 32.58 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.539 1.149 . . . . 61.210000000000001 110.261 -179.992 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . 0.426 ' O ' ' HB3' ' A' ' 215' ' ' TYR . 5.8 tt0 -53.75 -52.38 60.38 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.566 1.166 . . . . 72.420000000000002 110.285 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . 0.405 ' N ' ' HG3' ' A' ' 211' ' ' GLN . 0.6 OUTLIER -50.42 -21.3 1.39 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.449 1.093 . . . . 74.430000000000007 109.97 -179.993 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.532 HG23 ' HG2' ' A' ' 211' ' ' GLN . 21.7 t -95.21 -37.5 7.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.533 1.145 . . . . 74.430000000000007 109.339 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 215' ' ' TYR . . . . . 0.469 ' HH ' ' HZ ' ' A' ' 78' ' ' PHE . 5.1 t80 -51.7 -47.55 63.87 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.43 1.081 . . . . 74.329999999999998 110.967 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 2.8 mtmt -43.17 -55.28 4.01 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.467 1.104 . . . . 65.230000000000004 109.259 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 217' ' ' THR . . . . . 1.09 HG22 HD11 ' A' ' 221' ' ' ILE . 33.9 m -56.11 -66.43 0.43 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.435 1.085 . . . . 73.150000000000006 110.392 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 218' ' ' GLN . . . . . 0.448 ' HA ' HD12 ' A' ' 221' ' ' ILE . 41.5 mm-40 -47.99 -23.53 0.82 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.438 1.086 . . . . 74.439999999999998 110.278 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 219' ' ' GLN . . . . . 0.443 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 19.9 tp60 -82.36 -37.76 25.19 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.51 1.131 . . . . 73.200000000000003 110.312 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 220' ' ' THR . . . . . 0.418 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 1.2 m -78.57 -21.42 48.67 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.493 1.121 . . . . 65.230000000000004 110.343 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 221' ' ' ILE . . . . . 1.09 HD11 HG22 ' A' ' 217' ' ' THR . 12.7 mt -83.81 -37.17 12.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.477 1.111 . . . . 75.150000000000006 109.346 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 222' ' ' TRP . . . . . 0.468 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 27.3 t90 -66.84 -44.44 81.06 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.548 1.155 . . . . 71.239999999999995 107.963 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.418 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -68.13 -23.01 64.84 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.516 1.135 . . . . 63.100000000000001 109.283 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 . . . . . 0 C--N 1.326 -0.422 0 O-C-N 124.399 1.062 . . . . 73.219999999999999 110.359 179.93 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.591 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 9.0 p . . . . . 0 N--CA 1.453 -0.295 0 N-CA-C 109.333 -0.617 . . . . 74.310000000000002 109.333 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.477 ' CE2' ' OH ' ' A' ' 215' ' ' TYR . 3.3 t80 -87.48 20.73 2.76 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.463 1.102 . . . . 73.329999999999998 111.038 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.407 ' C ' ' O ' ' A' ' 78' ' ' PHE . 6.3 tp -39.31 156.84 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.416 1.072 . . . . 74.409999999999997 109.286 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 1.099 ' NZ ' HG22 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -104.47 -57.28 2.05 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.516 1.135 . . . . 64.340000000000003 109.293 -179.973 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.807 ' CE1' HD11 ' A' ' 83' ' ' ILE . 0.1 OUTLIER -161.92 150.7 15.45 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.559 1.162 . . . . 55.030000000000001 110.945 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.417 ' CG1' HG22 ' A' ' 135' ' ' THR . 3.9 p -103.13 159.48 4.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.484 1.115 . . . . 75.329999999999998 109.331 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.832 HG23 ' HB ' ' A' ' 136' ' ' ILE . 4.2 mp -122.36 88.29 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.439 1.087 . . . . 65.109999999999999 109.336 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.055 HD11 ' HB1' ' A' ' 128' ' ' ALA . 5.1 mp -70.01 114.88 8.6 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.452 1.095 . . . . 64.010000000000005 109.245 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.726 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -131.52 174.79 9.74 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.466 1.104 . . . . 74.120000000000005 109.529 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -111.21 157.3 20.25 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.489 1.118 . . . . 75.329999999999998 109.322 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.17 -11.27 19.41 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.426 1.079 . . . . 64.540000000000006 110.225 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -84.25 -40.28 18.23 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.556 1.16 . . . . 64.430000000000007 109.288 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.704 ' HB2' HD12 ' A' ' 138' ' ' LEU . 1.3 p30 -127.25 41.0 3.6 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.409 1.068 . . . . 73.549999999999997 109.303 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.613 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -74.28 -53.61 9.37 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.578 1.174 . . . . 45.130000000000003 110.36 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.18 -17.85 21.68 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.476 1.11 . . . . 72.340000000000003 109.252 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -78.84 -55.84 4.85 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.521 1.138 . . . . 75.310000000000002 110.247 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 1.011 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -65.15 -20.24 66.36 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.597 1.185 . . . . 54.149999999999999 109.29 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.623 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -86.13 -52.9 5.38 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.482 1.114 . . . . 73.129999999999995 109.35 179.964 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.617 ' N ' HD13 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -43.47 -36.2 1.91 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.445 1.091 . . . . 65.340000000000003 110.249 179.986 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.59 HG13 ' N ' ' A' ' 97' ' ' GLN . 11.0 p -80.34 -55.84 7.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 124.526 1.141 . . . . 73.219999999999999 109.296 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.627 HE21 HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -47.77 -23.43 0.72 Allowed 'General case' 0 C--N 1.323 -0.547 0 O-C-N 124.493 1.12 . . . . 75.209999999999994 110.323 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.24 -38.91 55.69 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.494 1.121 . . . . 74.230000000000004 109.359 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.741 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -80.66 -23.13 39.86 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.503 1.127 . . . . 71.540000000000006 109.261 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.741 ' N ' HD23 ' A' ' 99' ' ' LEU . 32.5 mt -62.76 -44.38 96.36 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.475 1.11 . . . . 73.310000000000002 109.288 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . 0.522 ' HB2' ' CD ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -85.76 55.44 3.52 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.521 1.138 . . . . 73.420000000000002 110.302 -179.985 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -178.18 -63.46 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.513 1.133 . . . . 44.530000000000001 109.273 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -43.79 -56.04 4.09 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.481 1.113 . . . . 65.430000000000007 109.378 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -109.43 -28.12 9.1 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.496 1.122 . . . . 73.109999999999999 110.998 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 101.02 39.52 3.08 Favored Glycine 0 CA--C 1.53 0.982 0 O-C-N 124.561 1.163 . . . . 61.509999999999998 111.023 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 1.099 HG22 ' NZ ' ' A' ' 80' ' ' LYS . 8.2 mm -83.37 90.05 2.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 O-C-N 124.5 0.765 . . . . 74.420000000000002 109.33 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.522 ' CD ' ' HB2' ' A' ' 101' ' ' GLN . 0.0 OUTLIER -142.72 161.82 47.3 Favored Pre-proline 0 C--N 1.325 -0.484 0 O-C-N 124.48 1.112 . . . . 65.109999999999999 109.332 179.98 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.51 ' HA ' ' CB ' ' A' ' 107' ' ' LYS . 18.6 Cg_endo -74.98 149.43 93.83 Favored 'Cis proline' 0 C--N 1.36 1.177 0 C-N-CA 120.983 -2.507 . . . . 71.439999999999998 111.043 -0.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -121.95 131.07 8.29 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.456 1.098 . . . . 60.509999999999998 111.039 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -142.76 148.01 20.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 O-C-N 124.513 0.772 . . . . 71.549999999999997 109.327 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . 0.726 HD12 ' NE2' ' A' ' 85' ' ' HIS . 32.2 pt -102.09 -177.16 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.477 1.11 . . . . 65.299999999999997 109.259 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.517 ' CD1' ' HG ' ' A' ' 84' ' ' LEU . 2.6 t80 -81.81 -23.21 36.65 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.569 1.168 . . . . 53.409999999999997 110.973 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -86.71 -5.32 59.16 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.465 1.103 . . . . 50.520000000000003 109.329 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -109.44 -26.61 9.89 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.507 1.129 . . . . 74.209999999999994 110.273 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.412 ' CE ' HG21 ' A' ' 82' ' ' VAL . 13.0 ttm -41.84 110.69 0.81 Allowed Pre-proline 0 C--N 1.325 -0.482 0 O-C-N 124.456 1.098 . . . . 72.450000000000003 110.996 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo . . . . . 0 C--N 1.361 1.185 0 O-C-N 124.481 1.78 . . . . 75.420000000000002 110.985 179.994 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.648 ' O ' ' HB3' ' A' ' 128' ' ' ALA . 4.0 pp . . . . . 0 N--CA 1.452 -0.355 0 N-CA-C 109.25 -0.648 . . . . 73.310000000000002 109.25 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.443 ' O ' ' N ' ' A' ' 129' ' ' VAL . 1.7 t70 -42.22 -65.27 0.48 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.582 1.176 . . . . 72.239999999999995 109.298 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -46.49 -40.66 12.81 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.398 1.061 . . . . 72.400000000000006 109.326 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 1.055 ' HB1' HD11 ' A' ' 84' ' ' LEU . . . -58.47 -38.96 78.66 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.501 1.126 . . . . 72.430000000000007 109.294 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.699 ' O ' HG12 ' A' ' 129' ' ' VAL . 77.1 t -90.45 18.41 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.54 1.15 . . . . 74.439999999999998 109.35 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -127.55 152.11 48.03 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.535 1.147 . . . . 64.129999999999995 109.322 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 47.5 56.17 8.56 Favored Glycine 0 CA--C 1.529 0.954 0 O-C-N 124.522 1.139 . . . . 71.329999999999998 111.031 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.9 p -163.76 163.73 23.95 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.473 0.749 . . . . 72.140000000000001 109.979 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.607 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -103.58 -23.78 13.46 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.451 1.094 . . . . 60.329999999999998 109.327 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.607 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.6 m-90 -161.79 157.5 24.27 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.026 -1.102 . . . . 72.5 108.026 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . 0.512 ' HB ' HD13 ' A' ' 84' ' ' LEU . 33.8 p -131.15 127.02 37.17 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.464 1.103 . . . . 50.439999999999998 110.381 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.867 ' O ' HD23 ' A' ' 137' ' ' LEU . 4.3 mm -84.32 141.53 14.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.51 1.132 . . . . 73.329999999999998 109.301 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.867 HD23 ' O ' ' A' ' 136' ' ' ILE . 34.0 mt -134.97 110.66 9.24 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.457 1.098 . . . . 63.420000000000002 109.268 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 1.011 HD21 ' HB2' ' A' ' 93' ' ' ALA . 1.1 mm? -63.06 88.58 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.51 1.131 . . . . 61.219999999999999 109.27 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.51 HD12 ' HA ' ' A' ' 139' ' ' LEU . 6.7 tp -60.43 100.64 0.11 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.538 1.149 . . . . 71.010000000000005 109.304 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . 0.671 HG22 ' H ' ' A' ' 141' ' ' GLU . 11.0 m -129.68 -177.55 4.32 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 72.319999999999993 110.417 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . 0.671 ' H ' HG22 ' A' ' 140' ' ' THR . 59.4 mt-10 -79.24 -35.95 40.71 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.485 1.116 . . . . 75.219999999999999 110.31 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 17.6 p30 -89.51 -34.49 16.37 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.503 1.127 . . . . 71.439999999999998 109.295 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.578 ' CE1' HG21 ' A' ' 147' ' ' THR . 6.6 t80 -71.63 -39.34 70.48 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.566 1.166 . . . . 73.420000000000002 111.048 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.8 HD13 ' N ' ' A' ' 145' ' ' ARG . 1.1 tm? -51.32 -67.47 0.25 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.47 1.106 . . . . 73.319999999999993 109.336 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.8 ' N ' HD13 ' A' ' 144' ' ' LEU . 0.0 OUTLIER -54.6 -19.14 5.4 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.56 1.163 . . . . 72.400000000000006 110.321 179.946 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -74.66 -43.13 56.81 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.582 1.177 . . . . 74.530000000000001 109.311 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.578 HG21 ' CE1' ' A' ' 143' ' ' PHE . 9.4 p -93.69 -7.57 43.36 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.453 1.096 . . . . 71.430000000000007 110.445 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.436 ' N ' ' O ' ' A' ' 144' ' ' LEU . 2.7 t-105 -86.53 -27.08 24.2 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.554 1.159 . . . . 62.439999999999998 108.01 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 13.2 t -83.57 -45.16 13.84 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.494 1.121 . . . . 51.200000000000003 108.366 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' ASN . . . . . 0.535 ' ND2' HD21 ' A' ' 125' ' ' LEU . 0.1 OUTLIER -63.27 -42.49 99.15 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.53 1.144 . . . . 61.32 109.35 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.632 ' CE1' HD12 ' A' ' 157' ' ' LEU . 5.1 m-30 -62.9 -34.66 77.89 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.542 1.151 . . . . 70.329999999999998 111.027 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -55.34 -48.76 73.72 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.515 1.135 . . . . 64.310000000000002 110.268 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.485 ' CG ' ' O ' ' A' ' 153' ' ' PHE . 11.5 t80 -86.78 0.28 55.06 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.476 1.11 . . . . 74.219999999999999 110.978 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.524 ' CE1' ' HB3' ' A' ' 156' ' ' SER . 0.4 OUTLIER -134.13 86.69 2.3 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.512 1.132 . . . . 70.120000000000005 111.003 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -67.26 -16.12 64.09 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.467 1.105 . . . . 71.549999999999997 110.412 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . 0.524 ' HB3' ' CE1' ' A' ' 154' ' ' TYR . 1.8 t -61.85 -22.99 65.98 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.5 1.125 . . . . 63.009999999999998 110.004 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.632 HD12 ' CE1' ' A' ' 151' ' ' PHE . 2.4 mm? -87.93 -26.35 22.74 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.52 1.137 . . . . 52.210000000000001 109.274 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' MET . . . . . 0.509 ' O ' ' CG2' ' A' ' 161' ' ' VAL . 25.2 mmt -66.23 -22.25 66.33 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.563 1.164 . . . . 74.230000000000004 111.041 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' ASN . . . . . 0.454 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 9.9 m-20 -93.88 -17.79 22.66 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.486 1.116 . . . . 73.129999999999995 109.294 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 160' ' ' SER . . . . . 0.478 ' HB2' ' CG2' ' A' ' 170' ' ' VAL . 69.4 p -81.2 -34.6 32.17 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.485 1.116 . . . . 71.310000000000002 110.028 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . 0.638 ' O ' HD13 ' A' ' 192' ' ' ILE . 1.5 m -51.07 -21.51 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.601 1.188 . . . . 54.240000000000002 109.267 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 162' ' ' ASN . . . . . 0.415 ' O ' ' C ' ' A' ' 163' ' ' ARG . 75.1 m-20 -90.09 25.75 2.06 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.538 1.149 . . . . 64.010000000000005 109.297 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 160' ' ' SER . 0.1 OUTLIER 37.91 34.22 0.06 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.478 1.111 . . . . 74.340000000000003 110.313 -179.948 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . 0.454 ' NE2' ' O ' ' A' ' 159' ' ' ASN . 9.4 mt-30 -38.7 126.88 1.52 Allowed 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.495 1.122 . . . . 65.409999999999997 110.339 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 39.5 m-70 -72.03 68.52 0.69 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.56 1.163 . . . . 70.349999999999994 109.654 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.452 ' O ' ' NE2' ' A' ' 218' ' ' GLN . 0.1 OUTLIER -122.54 -174.39 2.9 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.486 1.116 . . . . 72.310000000000002 109.281 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 167' ' ' TYR . . . . . 0.749 ' CE1' ' CD1' ' A' ' 222' ' ' TRP . 8.2 t80 -45.56 -39.6 7.72 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.428 1.08 . . . . 74.010000000000005 110.992 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -128.17 149.02 50.62 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.569 1.168 . . . . 75.400000000000006 109.273 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.426 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 1.5 t -126.56 168.38 14.36 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.502 1.126 . . . . 65.219999999999999 110.034 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.478 ' CG2' ' HB2' ' A' ' 160' ' ' SER . 2.0 t -129.52 117.06 41.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 O-C-N 124.557 1.161 . . . . 73.310000000000002 109.285 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.563 HG22 ' HB2' ' A' ' 195' ' ' LEU . 17.1 mm -124.25 99.91 36.53 Favored Pre-proline 0 C--N 1.326 -0.441 0 O-C-N 124.446 1.091 . . . . 60.439999999999998 109.287 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . 0.877 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.95 106.95 2.37 Favored 'Trans proline' 0 C--N 1.361 1.199 0 O-C-N 124.446 1.761 . . . . 70.140000000000001 111.017 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . 0.529 ' HE1' ' HB2' ' A' ' 197' ' ' GLU . 3.5 ttt -87.77 152.44 22.12 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.442 1.088 . . . . 75.519999999999996 111.017 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . 0.428 ' N ' ' HG2' ' A' ' 173' ' ' MET . 60.0 mtp180 -106.43 123.9 37.39 Favored Pre-proline 0 C--N 1.325 -0.499 0 O-C-N 124.495 1.122 . . . . 74.450000000000003 110.293 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 175' ' ' PRO . . . . . 0.673 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.3 Cg_endo -74.94 155.0 43.19 Favored 'Trans proline' 0 C--N 1.36 1.175 0 O-C-N 124.528 1.804 . . . . 72.219999999999999 110.974 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . 0.975 HD21 ' HG2' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -96.0 -38.0 10.41 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.487 1.117 . . . . 72.530000000000001 109.304 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -72.9 -23.92 60.77 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.438 1.086 . . . . 71.040000000000006 109.336 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -110.38 110.24 58.12 Favored Pre-proline 0 C--N 1.325 -0.491 0 O-C-N 124.518 1.137 . . . . 65.349999999999994 109.313 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.93 115.5 4.31 Favored 'Trans proline' 0 C--N 1.359 1.094 0 O-C-N 124.525 1.802 . . . . 74.120000000000005 111.031 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.5 ' CD1' ' OG1' ' A' ' 185' ' ' THR . 0.7 OUTLIER -118.11 96.98 50.41 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.535 1.147 . . . . 71.549999999999997 109.331 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.02 169.38 22.76 Favored 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.479 1.778 . . . . 63.049999999999997 110.996 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 12.3 ptt180 -70.55 -16.06 62.84 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.49 1.119 . . . . 63.32 110.374 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -78.74 -2.41 39.28 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.556 1.16 . . . . 64.329999999999998 110.318 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -128.4 8.04 5.93 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.473 1.108 . . . . 70.319999999999993 110.289 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 185' ' ' THR . . . . . 0.5 ' OG1' ' CD1' ' A' ' 180' ' ' LEU . 19.6 m -110.03 143.69 28.49 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.585 1.178 . . . . 74.510000000000005 110.371 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 186' ' ' PRO . . . . . 0.709 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -74.95 155.87 43.18 Favored 'Trans proline' 0 C--N 1.36 1.146 0 O-C-N 124.545 1.813 . . . . 64.439999999999998 110.983 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 187' ' ' PHE . . . . . 0.503 ' O ' ' CG2' ' A' ' 191' ' ' THR . 28.9 p90 -69.34 -7.38 36.78 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.488 1.118 . . . . 71.310000000000002 111.008 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.76 -53.17 4.13 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.449 1.093 . . . . 64.430000000000007 109.29 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.76 HD22 ' HG3' ' A' ' 172' ' ' PRO . 61.1 mt -68.27 -42.33 79.75 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.484 1.115 . . . . 53.32 109.328 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 190' ' ' GLN . . . . . 0.413 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.3 pt20 -63.77 -11.04 23.15 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.563 1.164 . . . . 65.030000000000001 110.279 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 191' ' ' THR . . . . . 0.503 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 34.4 p -113.0 -3.9 13.97 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.518 1.136 . . . . 71.230000000000004 110.411 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.638 HD13 ' O ' ' A' ' 161' ' ' VAL . 7.9 mt -93.18 157.07 3.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 O-C-N 124.406 1.066 . . . . 64.439999999999998 109.301 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 193' ' ' ASN . . . . . 0.447 ' ND2' ' O ' ' A' ' 193' ' ' ASN . 25.4 t30 -76.97 56.95 1.27 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.417 1.073 . . . . 54.32 109.31 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . 0.877 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -50.99 163.18 0.21 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.58 1.175 . . . . 63.539999999999999 109.364 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 195' ' ' LEU . . . . . 0.638 HD23 ' CD1' ' A' ' 209' ' ' ILE . 0.2 OUTLIER -86.65 127.87 34.96 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 74.420000000000002 109.29 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -108.35 128.84 55.11 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.543 1.152 . . . . 62.299999999999997 110.345 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.975 ' HG2' HD21 ' A' ' 176' ' ' LEU . 5.6 tp10 -109.74 -22.09 12.08 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.482 1.114 . . . . 74.25 110.322 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . 0.537 ' HB3' HD12 ' A' ' 176' ' ' LEU . 2.2 pt-20 -94.82 19.12 10.59 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.495 1.122 . . . . 60.329999999999998 110.279 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -127.59 146.81 50.41 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.51 1.131 . . . . 61.310000000000002 110.001 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 12.6 tpp85 -63.18 -12.16 26.04 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.467 1.104 . . . . 72.439999999999998 110.298 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -93.76 16.43 60.82 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.545 1.153 . . . . 60.310000000000002 111.007 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 202' ' ' PHE . . . . . 0.802 ' O ' HG23 ' A' ' 206' ' ' VAL . 5.3 t80 -67.83 -38.35 14.37 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.533 0.784 . . . . 74.230000000000004 110.986 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 203' ' ' PRO . . . . . 0.701 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.5 Cg_endo -74.98 -30.13 7.52 Favored 'Trans proline' 0 C--N 1.361 1.187 0 O-C-N 124.5 1.789 . . . . 62.350000000000001 111.073 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -64.08 -65.46 0.68 Allowed 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.521 1.138 . . . . 61.030000000000001 110.392 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -51.1 -42.28 60.55 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.423 1.077 . . . . 74.319999999999993 110.244 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 206' ' ' VAL . . . . . 0.802 HG23 ' O ' ' A' ' 202' ' ' PHE . 55.2 t -58.85 -28.41 37.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.487 1.117 . . . . 65.109999999999999 109.331 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -82.88 -47.6 11.66 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.521 1.138 . . . . 64.299999999999997 110.27 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . 0.442 ' N ' ' HD2' ' A' ' 208' ' ' ARG . 1.9 mpt_? -64.25 -64.01 0.99 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.459 1.099 . . . . 71.439999999999998 110.278 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 209' ' ' ILE . . . . . 0.71 HG22 ' CD1' ' A' ' 210' ' ' PHE . 54.2 mt -48.35 -53.01 6.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.515 1.135 . . . . 63.439999999999998 109.297 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 210' ' ' PHE . . . . . 0.71 ' CD1' HG22 ' A' ' 209' ' ' ILE . 0.8 OUTLIER -101.84 66.15 1.03 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.526 1.142 . . . . 75.25 111.016 179.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 211' ' ' GLN . . . . . 0.443 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.1 OUTLIER -110.92 146.37 36.69 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.504 1.128 . . . . 75.420000000000002 110.271 179.974 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . 0.452 ' O ' ' N ' ' A' ' 215' ' ' TYR . 63.9 tt0 -48.86 -55.62 11.13 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.503 1.127 . . . . 51.119999999999997 110.275 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -48.24 -24.03 1.06 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.522 1.138 . . . . 73.430000000000007 110.011 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.443 HG23 ' HG2' ' A' ' 211' ' ' GLN . 22.6 t -95.86 -29.02 3.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.493 1.121 . . . . 71.430000000000007 109.281 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 215' ' ' TYR . . . . . 0.477 ' OH ' ' CE2' ' A' ' 78' ' ' PHE . 12.3 t80 -65.1 -20.26 66.39 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 124.535 1.147 . . . . 72.409999999999997 110.922 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . 0.46 ' O ' ' CB ' ' A' ' 220' ' ' THR . 5.9 mmpt? -69.23 -57.3 5.52 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.57 1.169 . . . . 62.43 109.372 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 1.2 m -47.87 -53.66 15.03 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.505 1.128 . . . . 73.349999999999994 110.41 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 218' ' ' GLN . . . . . 0.452 ' NE2' ' O ' ' A' ' 166' ' ' LYS . 94.5 mm-40 -55.78 -66.94 0.34 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.455 1.097 . . . . 73.150000000000006 110.325 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 219' ' ' GLN . . . . . 0.456 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 40.2 tp60 -54.57 -18.79 4.83 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.547 1.154 . . . . 71.450000000000003 110.304 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 220' ' ' THR . . . . . 0.46 ' CB ' ' O ' ' A' ' 216' ' ' LYS . 2.9 m -83.27 -28.41 29.16 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.565 1.165 . . . . 34.240000000000002 110.399 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 221' ' ' ILE . . . . . 0.442 HG22 ' HB2' ' A' ' 167' ' ' TYR . 14.0 mt -83.81 -17.66 10.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.453 1.096 . . . . 73.209999999999994 109.263 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 222' ' ' TRP . . . . . 0.749 ' CD1' ' CE1' ' A' ' 167' ' ' TYR . 7.9 t90 -89.09 -59.63 2.17 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.957 -1.127 . . . . 72.140000000000001 107.957 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.14 -20.45 6.7 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.496 1.123 . . . . 73.420000000000002 109.327 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 . . . . . 0 C--N 1.325 -0.49 0 O-C-N 124.48 1.113 . . . . 74.129999999999995 110.286 -179.928 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.554 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 5.9 p . . . . . 0 N--CA 1.455 -0.222 0 N-CA-C 109.272 -0.64 . . . . 73.239999999999995 109.272 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.479 ' N ' HG22 ' A' ' 77' ' ' VAL . 1.5 t80 -87.36 20.92 2.62 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.486 1.116 . . . . 74.209999999999994 110.985 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.469 ' HB2' HG13 ' A' ' 77' ' ' VAL . 6.5 tp -41.2 160.9 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.445 1.091 . . . . 63.340000000000003 109.341 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.616 ' O ' ' HB3' ' A' ' 133' ' ' ALA . 6.5 ptmt -111.08 -49.58 3.01 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 124.499 1.125 . . . . 75.209999999999994 109.308 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.925 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.2 OUTLIER -165.62 136.69 3.82 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.571 1.169 . . . . 74.010000000000005 111.04 -179.955 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.539 HG22 ' N ' ' A' ' 83' ' ' ILE . 8.0 p -91.09 169.25 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.509 1.131 . . . . 71.299999999999997 109.293 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.925 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 4.7 mp -133.04 96.97 2.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.478 1.111 . . . . 74.239999999999995 109.319 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.843 HD11 ' HB3' ' A' ' 128' ' ' ALA . 8.0 mt -69.59 124.15 23.19 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.468 1.105 . . . . 73.140000000000001 109.348 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.797 ' NE2' HD12 ' A' ' 111' ' ' ILE . 2.8 p80 -146.06 174.72 11.04 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.447 1.092 . . . . 74.049999999999997 109.658 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.467 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -131.8 164.65 25.56 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.442 1.089 . . . . 64.340000000000003 109.336 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -55.62 -17.29 5.33 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.47 1.106 . . . . 72.340000000000003 110.268 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -76.47 -46.53 26.46 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.529 1.143 . . . . 41.439999999999998 109.313 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.442 ' OD2' ' ND2' ' A' ' 178' ' ' ASN . 21.8 m-20 -125.35 45.14 2.64 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.492 1.12 . . . . 60.020000000000003 109.318 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.619 ' HG1' ' CE1' ' A' ' 85' ' ' HIS . 0.9 OUTLIER -75.05 -37.59 61.65 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 72.329999999999998 110.378 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.82 -19.99 43.45 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.467 1.104 . . . . 54.439999999999998 109.295 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.42 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -75.46 -59.97 2.51 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.436 1.085 . . . . 74.099999999999994 110.24 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.753 ' HB2' ' CD2' ' A' ' 138' ' ' LEU . . . -60.56 -23.17 64.42 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.581 1.176 . . . . 64.209999999999994 109.287 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.848 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -85.8 -41.42 15.07 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.498 1.123 . . . . 73.549999999999997 109.279 -179.992 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -53.19 -34.78 58.42 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.496 1.122 . . . . 74.420000000000002 110.347 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.589 HG13 ' N ' ' A' ' 97' ' ' GLN . 9.5 p -83.19 -56.08 6.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.49 1.119 . . . . 74.239999999999995 109.308 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.593 ' HA ' HD12 ' A' ' 100' ' ' LEU . 0.1 OUTLIER -47.67 -23.27 0.65 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.466 1.104 . . . . 62.399999999999999 110.273 -179.955 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -77.24 -43.33 33.91 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.472 1.108 . . . . 40.219999999999999 109.308 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.72 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -75.53 -22.28 57.22 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.519 1.137 . . . . 72.340000000000003 109.321 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.72 ' N ' HD23 ' A' ' 99' ' ' LEU . 73.4 mt -65.02 -49.67 69.25 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.483 1.114 . . . . 64.120000000000005 109.326 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -78.7 53.24 1.31 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.527 1.142 . . . . 71.230000000000004 110.321 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -176.91 -66.56 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.526 1.141 . . . . 74.329999999999998 109.336 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -41.54 -48.53 3.96 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.579 1.175 . . . . 74.310000000000002 109.276 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -115.8 -29.96 6.25 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.512 1.132 . . . . 75.409999999999997 110.993 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 106.61 35.92 2.73 Favored Glycine 0 CA--C 1.53 0.972 0 O-C-N 124.474 1.109 . . . . 73.439999999999998 111.011 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.56 HG22 ' HD3' ' A' ' 80' ' ' LYS . 23.5 mm -75.84 87.77 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.539 0.788 . . . . 74.219999999999999 109.3 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.514 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -137.75 158.32 71.87 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.529 1.143 . . . . 71.400000000000006 109.292 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.514 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.4 Cg_endo -74.94 158.25 99.1 Favored 'Cis proline' 0 C--N 1.36 1.177 0 C-N-CA 121.023 -2.49 . . . . 70.219999999999999 111.038 -0.071 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -114.97 134.25 11.52 Favored Glycine 0 CA--C 1.53 1.005 0 O-C-N 124.524 1.14 . . . . 54.25 111.02 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -154.09 128.26 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.531 0.783 . . . . 42.0 109.277 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . 0.797 HD12 ' NE2' ' A' ' 85' ' ' HIS . 44.6 pt -89.68 -171.63 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 124.469 1.105 . . . . 72.409999999999997 109.26 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -81.33 -40.01 24.26 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.522 1.139 . . . . 74.109999999999999 111.037 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.5 ' HB2' ' HE1' ' A' ' 85' ' ' HIS . . . -73.97 -4.45 35.27 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.539 1.15 . . . . 72.010000000000005 109.261 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -106.69 -26.57 11.27 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.515 1.135 . . . . 73.420000000000002 110.298 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 31.9 tpp -44.48 110.88 1.1 Allowed Pre-proline 0 C--N 1.326 -0.443 0 O-C-N 124.386 1.054 . . . . 65.519999999999996 110.996 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 C--N 1.359 1.118 0 O-C-N 124.515 1.797 . . . . 64.109999999999999 111.043 179.941 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.865 HD21 HD21 ' A' ' 150' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.279 0 N-CA-C 109.336 -0.616 . . . . 61.210000000000001 109.336 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.446 ' H ' HD12 ' A' ' 125' ' ' LEU . 7.7 p-10 -46.54 -25.96 0.79 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.55 1.156 . . . . 73.519999999999996 109.307 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.408 ' N ' ' C ' ' A' ' 125' ' ' LEU . 2.1 t70 -65.27 -55.46 18.27 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.506 1.129 . . . . 73.010000000000005 109.27 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.843 ' HB3' HD11 ' A' ' 84' ' ' LEU . . . -61.02 -15.24 29.74 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.479 1.112 . . . . 61.329999999999998 109.313 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.677 HG21 ' CD2' ' A' ' 157' ' ' LEU . 89.9 t -86.6 10.53 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.496 1.123 . . . . 70.140000000000001 109.258 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 14.5 t30 -127.61 158.97 36.08 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.494 1.121 . . . . 44.25 109.311 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 42.67 55.43 4.64 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 124.489 1.118 . . . . 65.230000000000004 111.028 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -162.53 165.54 25.94 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.532 0.784 . . . . 54.119999999999997 110.036 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.616 ' HB3' ' O ' ' A' ' 80' ' ' LYS . . . -110.08 -25.49 10.19 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.493 1.121 . . . . 74.129999999999995 109.355 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.598 ' CD1' ' O ' ' A' ' 133' ' ' ALA . 4.0 m-90 -158.45 150.61 21.66 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.477 1.111 . . . . 72.230000000000004 108.062 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . 0.845 HG23 ' O ' ' A' ' 169' ' ' SER . 7.0 p -125.94 154.8 42.32 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.529 1.143 . . . . 75.150000000000006 110.411 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.663 ' HB ' HG23 ' A' ' 83' ' ' ILE . 15.7 mm -105.42 91.65 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.461 1.1 . . . . 65.549999999999997 109.263 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.405 ' CB ' ' HA ' ' A' ' 172' ' ' PRO . 0.6 OUTLIER -73.59 87.08 1.63 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.534 1.146 . . . . 70.439999999999998 109.3 179.959 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.753 ' CD2' ' HB2' ' A' ' 93' ' ' ALA . 1.4 tp -62.1 96.2 0.07 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.495 1.122 . . . . 71.140000000000001 109.324 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.504 HD11 HD13 ' A' ' 189' ' ' LEU . 0.1 OUTLIER -71.98 121.46 19.16 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.496 1.122 . . . . 74.430000000000007 109.303 -179.984 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . 0.719 HG22 ' H ' ' A' ' 141' ' ' GLU . 7.0 m -137.9 -173.64 3.56 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.49 1.119 . . . . 63.43 110.394 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . 0.719 ' H ' HG22 ' A' ' 140' ' ' THR . 4.0 mt-10 -84.93 -40.62 16.77 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 72.230000000000004 110.317 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . 0.409 ' ND2' ' N ' ' A' ' 143' ' ' PHE . 3.8 p-10 -89.67 -49.67 6.52 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.506 1.129 . . . . 60.140000000000001 109.32 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.749 ' O ' HG23 ' A' ' 147' ' ' THR . 43.1 t80 -50.39 -28.04 7.42 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.473 1.108 . . . . 64.530000000000001 111.008 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.444 HD13 ' C ' ' A' ' 144' ' ' LEU . 3.0 tm? -63.68 -67.85 0.39 Allowed 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.488 1.118 . . . . 62.149999999999999 109.263 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -48.59 -28.75 3.65 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.535 1.147 . . . . 75.239999999999995 110.389 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . 0.541 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 5.3 m-20 -71.48 -71.63 0.26 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.491 1.119 . . . . 71.519999999999996 109.35 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.749 HG23 ' O ' ' A' ' 143' ' ' PHE . 65.7 p -49.08 -55.87 10.83 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.49 1.119 . . . . 72.430000000000007 110.404 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.561 ' CZ2' ' HB3' ' A' ' 186' ' ' PRO . 0.0 OUTLIER -46.39 -31.77 2.82 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.545 1.153 . . . . 74.120000000000005 108.009 -179.963 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' CYS . . . . . 0.541 ' CB ' ' O ' ' A' ' 146' ' ' ASP . 1.8 t -57.86 -46.21 85.17 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.546 1.154 . . . . 52.049999999999997 108.288 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' ASN . . . . . 0.865 HD21 HD21 ' A' ' 125' ' ' LEU . 0.8 OUTLIER -67.05 -41.6 86.22 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.525 1.14 . . . . 73.409999999999997 109.288 -179.996 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.879 ' CZ ' HD12 ' A' ' 157' ' ' LEU . 13.1 m-85 -55.34 -21.75 16.43 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.61 1.194 . . . . 75.430000000000007 111.064 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -85.49 -33.01 21.93 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.549 1.156 . . . . 72.519999999999996 110.366 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.525 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 2.5 t80 -110.25 21.19 17.02 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.513 1.133 . . . . 63.43 111.035 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.452 ' N ' ' O ' ' A' ' 150' ' ' ASN . 2.3 t80 -163.75 106.0 0.95 Allowed 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.52 1.137 . . . . 74.340000000000003 111.011 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 6.3 t -85.92 -10.75 54.72 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.478 1.111 . . . . 72.540000000000006 110.456 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 3.1 t -62.55 -23.11 66.82 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.536 1.148 . . . . 75.120000000000005 110.007 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.879 HD12 ' CZ ' ' A' ' 151' ' ' PHE . 0.2 OUTLIER -77.11 -37.86 53.33 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.526 1.141 . . . . 65.319999999999993 109.302 -179.993 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 158' ' ' MET . . . . . 0.47 ' CE ' ' HA ' ' A' ' 158' ' ' MET . 17.0 mmt -57.0 -35.83 69.67 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.439 1.087 . . . . 70.420000000000002 111.0 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' ASN . . . . . 0.448 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 33.9 m-80 -71.23 -38.01 72.0 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.527 1.142 . . . . 52.340000000000003 109.342 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 160' ' ' SER . . . . . 0.633 ' OG ' HG11 ' A' ' 170' ' ' VAL . 1.3 p -67.19 -35.34 79.43 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.496 1.122 . . . . 71.319999999999993 109.995 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . 0.882 ' O ' HD13 ' A' ' 192' ' ' ILE . 64.7 t -58.56 -22.92 21.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.474 1.108 . . . . 73.540000000000006 109.302 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 68.9 m-20 -83.18 -22.71 33.16 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.459 1.1 . . . . 75.129999999999995 109.306 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 54.47 35.16 22.63 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.571 1.169 . . . . 74.409999999999997 110.271 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . 0.448 ' NE2' ' O ' ' A' ' 159' ' ' ASN . 0.8 OUTLIER -52.56 -173.5 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.488 1.117 . . . . 72.340000000000003 110.316 179.944 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 12.2 p-80 -73.21 66.79 0.9 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.49 1.119 . . . . 73.239999999999995 109.622 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.32 160.39 26.8 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.485 1.116 . . . . 75.150000000000006 109.308 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 167' ' ' TYR . . . . . 0.74 ' HB3' HG22 ' A' ' 221' ' ' ILE . 4.6 p90 -70.0 -6.12 31.13 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.456 1.098 . . . . 72.239999999999995 110.89 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . 0.516 ' ND2' ' CZ ' ' A' ' 167' ' ' TYR . 0.3 OUTLIER -122.81 137.44 54.93 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 124.493 1.12 . . . . 54.399999999999999 109.31 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.845 ' O ' HG23 ' A' ' 135' ' ' THR . 0.7 OUTLIER -143.01 150.79 40.09 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.552 1.158 . . . . 45.409999999999997 110.024 179.997 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.633 HG11 ' OG ' ' A' ' 160' ' ' SER . 1.0 OUTLIER -126.18 150.5 31.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.474 1.109 . . . . 70.310000000000002 109.287 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.643 HG22 ' HB2' ' A' ' 195' ' ' LEU . 12.1 mm -139.65 112.51 7.71 Favored Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 124.532 1.145 . . . . 75.409999999999997 109.27 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . 0.813 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -75.0 106.9 2.37 Favored 'Trans proline' 0 C--N 1.36 1.183 0 O-C-N 124.548 1.815 . . . . 70.299999999999997 111.034 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . 0.575 ' CE ' HD12 ' A' ' 195' ' ' LEU . 3.9 ttt -96.39 154.0 17.51 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.501 1.126 . . . . 70.129999999999995 110.974 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . 0.442 ' N ' ' HG2' ' A' ' 173' ' ' MET . 57.8 mtm180 -110.66 121.53 40.86 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.476 1.11 . . . . 54.020000000000003 110.319 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 175' ' ' PRO . . . . . 0.473 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.2 Cg_endo -74.97 151.66 39.96 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.458 1.767 . . . . 72.299999999999997 111.037 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . 0.913 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -85.15 -43.54 13.75 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.458 1.099 . . . . 72.010000000000005 109.318 -179.996 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -71.82 -28.34 63.52 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.496 1.123 . . . . 53.25 109.28 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 178' ' ' ASN . . . . . 0.67 ' OD1' HG23 ' A' ' 140' ' ' THR . 2.6 m-80 -110.44 99.63 41.57 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.547 1.155 . . . . 73.120000000000005 109.242 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.98 115.09 4.18 Favored 'Trans proline' 0 C--N 1.359 1.122 0 O-C-N 124.512 1.796 . . . . 73.400000000000006 110.99 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.608 HD13 ' HB2' ' A' ' 184' ' ' ARG . 0.6 OUTLIER -122.81 96.91 44.71 Favored Pre-proline 0 C--N 1.324 -0.518 0 O-C-N 124.528 1.143 . . . . 74.519999999999996 109.325 179.964 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 181' ' ' PRO . . . . . 0.444 ' HG2' ' CG ' ' A' ' 183' ' ' GLU . 18.4 Cg_endo -74.99 169.13 23.31 Favored 'Trans proline' 0 C--N 1.36 1.159 0 O-C-N 124.502 1.79 . . . . 62.039999999999999 111.013 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . 0.428 ' CG ' ' N ' ' A' ' 183' ' ' GLU . 23.1 ptt180 -53.1 -39.34 63.32 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.518 1.136 . . . . 63.130000000000003 110.3 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . 0.444 ' CG ' ' HG2' ' A' ' 181' ' ' PRO . 5.4 pt-20 -52.01 -36.09 48.9 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.439 1.087 . . . . 73.299999999999997 110.375 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 184' ' ' ARG . . . . . 0.608 ' HB2' HD13 ' A' ' 180' ' ' LEU . 35.3 mmt180 -89.58 -18.43 26.58 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.427 1.079 . . . . 75.109999999999999 110.278 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 185' ' ' THR . . . . . 0.493 HG22 ' HD2' ' A' ' 186' ' ' PRO . 20.7 m -82.2 143.91 49.61 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.494 1.121 . . . . 60.210000000000001 110.361 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 186' ' ' PRO . . . . . 0.751 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -74.96 155.15 43.12 Favored 'Trans proline' 0 C--N 1.36 1.134 0 O-C-N 124.5 1.79 . . . . 70.409999999999997 111.022 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 187' ' ' PHE . . . . . 0.505 ' O ' ' CG2' ' A' ' 191' ' ' THR . 23.3 p90 -68.93 -7.09 31.76 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.582 1.176 . . . . 73.140000000000001 111.006 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . 0.567 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -93.92 -53.11 4.12 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.592 1.182 . . . . 62.32 109.283 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.751 HD12 ' CG ' ' A' ' 186' ' ' PRO . 51.7 mt -68.54 -42.36 78.55 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.542 1.151 . . . . 73.209999999999994 109.326 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 190' ' ' GLN . . . . . 0.41 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.2 pt20 -63.62 -11.36 24.46 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.518 1.136 . . . . 72.340000000000003 110.316 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 191' ' ' THR . . . . . 0.505 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 29.1 p -111.81 19.55 17.87 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.48 1.113 . . . . 55.310000000000002 110.396 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.882 HD13 ' O ' ' A' ' 161' ' ' VAL . 5.3 mt -138.21 139.33 42.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 O-C-N 124.5 1.125 . . . . 73.140000000000001 109.306 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 193' ' ' ASN . . . . . 0.505 ' ND2' HD11 ' A' ' 209' ' ' ILE . 12.5 t30 -47.26 97.06 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.525 1.141 . . . . 73.099999999999994 109.315 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . 0.813 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -88.83 141.29 28.62 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.52 1.137 . . . . 45.119999999999997 109.31 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 195' ' ' LEU . . . . . 0.643 ' HB2' HG22 ' A' ' 171' ' ' ILE . 0.2 OUTLIER -61.47 136.09 57.91 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.51 1.131 . . . . 71.200000000000003 109.297 179.991 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -116.54 129.7 56.33 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.459 1.1 . . . . 63.450000000000003 110.349 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.913 ' HG3' HD21 ' A' ' 176' ' ' LEU . 41.6 tp10 -113.16 -29.12 7.4 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.493 1.12 . . . . 71.099999999999994 110.335 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.1 21.24 6.01 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.521 1.138 . . . . 55.32 110.317 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 1.2 t -128.63 145.4 51.16 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.555 1.16 . . . . 62.219999999999999 109.997 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.17 -14.05 44.28 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.475 1.11 . . . . 73.219999999999999 110.258 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -92.82 16.22 60.82 Favored Glycine 0 CA--C 1.531 1.04 0 O-C-N 124.542 1.151 . . . . 51.32 111.004 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 202' ' ' PHE . . . . . 0.81 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.5 OUTLIER -61.15 -41.67 81.97 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.447 0.733 . . . . 74.019999999999996 110.997 -179.996 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 203' ' ' PRO . . . . . 0.642 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.05 -34.71 3.57 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.445 1.76 . . . . 52.100000000000001 111.013 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.09 -55.43 31.12 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.495 1.122 . . . . 61.0 110.407 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -65.51 -40.05 92.55 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.495 1.122 . . . . 73.310000000000002 110.34 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 206' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 202' ' ' PHE . 72.9 t -64.45 -28.83 45.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.544 1.153 . . . . 73.120000000000005 109.239 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -83.07 -38.74 22.1 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.5 1.125 . . . . 72.430000000000007 110.305 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 79.3 mtt-85 -74.05 -65.49 0.83 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.545 1.153 . . . . 75.530000000000001 110.354 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 209' ' ' ILE . . . . . 0.645 HG22 ' CD1' ' A' ' 210' ' ' PHE . 90.8 mt -46.26 -50.03 5.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 124.447 1.092 . . . . 71.230000000000004 109.358 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 210' ' ' PHE . . . . . 0.645 ' CD1' HG22 ' A' ' 209' ' ' ILE . 0.9 OUTLIER -100.98 71.82 1.44 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.483 1.114 . . . . 72.140000000000001 111.006 179.943 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 211' ' ' GLN . . . . . 0.477 ' CG ' ' HB ' ' A' ' 214' ' ' VAL . 11.1 pt20 -110.9 138.64 47.05 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.49 1.119 . . . . 73.310000000000002 110.261 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . 0.422 ' C ' ' N ' ' A' ' 214' ' ' VAL . 6.8 tt0 -51.49 -50.97 58.87 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 63.049999999999997 110.339 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.4 t -47.26 -21.55 0.29 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.554 1.159 . . . . 74.0 110.009 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.477 ' HB ' ' CG ' ' A' ' 211' ' ' GLN . 2.0 t -96.95 -43.07 12.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.544 1.153 . . . . 63.119999999999997 109.269 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 215' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -46.0 -40.05 9.95 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.526 1.141 . . . . 64.109999999999999 111.026 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -54.13 -66.31 0.42 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.491 1.119 . . . . 72.310000000000002 109.249 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 217' ' ' THR . . . . . 0.548 HG22 HD11 ' A' ' 221' ' ' ILE . 2.0 m -46.1 -66.54 0.39 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.51 1.131 . . . . 73.120000000000005 110.367 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 218' ' ' GLN . . . . . 0.89 ' HA ' HD12 ' A' ' 221' ' ' ILE . 18.5 mm-40 -39.55 -64.47 0.47 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.561 1.163 . . . . 74.439999999999998 110.284 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 219' ' ' GLN . . . . . 0.416 ' NE2' ' HB2' ' A' ' 223' ' ' LYS . 25.6 tp60 -44.14 -52.42 7.3 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.501 1.126 . . . . 64.030000000000001 110.304 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.83 -33.03 47.47 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.549 1.156 . . . . 55.340000000000003 110.42 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 221' ' ' ILE . . . . . 0.89 HD12 ' HA ' ' A' ' 218' ' ' GLN . 12.5 mt -74.67 -48.32 34.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.519 1.137 . . . . 71.129999999999995 109.299 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 222' ' ' TRP . . . . . 0.554 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 78.3 t90 -67.32 -17.96 64.98 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.032 -1.099 . . . . 73.010000000000005 108.032 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.416 ' HB2' ' NE2' ' A' ' 219' ' ' GLN . 0.0 OUTLIER -84.63 -49.42 8.56 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.453 1.096 . . . . 61.549999999999997 109.284 -179.994 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 . . . . . 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 75.530000000000001 110.372 179.983 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.595 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 2.7 p . . . . . 0 N--CA 1.453 -0.324 0 N-CA-C 109.291 -0.633 . . . . 75.310000000000002 109.291 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.407 ' CE2' ' HG3' ' A' ' 108' ' ' PRO . 51.3 p90 -89.61 31.33 0.94 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.481 1.113 . . . . 73.409999999999997 111.035 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.488 HD11 HG22 ' A' ' 110' ' ' ILE . 9.3 tp -40.23 139.1 0.77 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.506 1.129 . . . . 71.400000000000006 109.338 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.657 ' HZ1' HD12 ' A' ' 106' ' ' ILE . 2.4 mtpt -76.54 -63.43 1.34 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.492 1.12 . . . . 64.109999999999999 109.29 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.975 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.8 OUTLIER -160.81 127.9 4.21 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.562 1.164 . . . . 71.319999999999993 110.918 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.657 ' CG1' HG22 ' A' ' 135' ' ' THR . 12.3 p -84.55 169.59 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.549 1.155 . . . . 55.340000000000003 109.281 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.975 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 1.7 mp -129.65 94.41 2.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.514 1.134 . . . . 74.120000000000005 109.246 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.831 HD11 ' HB3' ' A' ' 128' ' ' ALA . 3.0 mt -71.71 93.64 1.29 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.473 1.108 . . . . 70.439999999999998 109.299 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.695 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -115.05 174.51 5.94 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.487 1.117 . . . . 74.409999999999997 109.602 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -100.68 164.09 12.03 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.564 1.165 . . . . 54.299999999999997 109.316 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.47 ' CG ' ' O ' ' A' ' 87' ' ' GLU . 13.4 tt0 -71.23 -5.6 33.28 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.496 1.123 . . . . 71.319999999999993 110.3 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -91.06 -45.46 8.68 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.466 1.103 . . . . 63.32 109.296 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.722 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -114.7 44.23 1.79 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.48 1.113 . . . . 63.520000000000003 109.31 179.954 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.607 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -76.91 -34.69 57.7 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.515 1.134 . . . . 61.229999999999997 110.396 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.52 -19.54 59.29 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.493 1.121 . . . . 72.340000000000003 109.33 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -78.53 -57.07 3.96 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.444 1.09 . . . . 71.120000000000005 110.336 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.775 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -63.13 -16.46 60.11 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 73.140000000000001 109.3 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.715 HD13 ' N ' ' A' ' 95' ' ' ARG . 0.1 OUTLIER -89.51 -53.75 4.39 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.486 1.116 . . . . 74.230000000000004 109.345 179.976 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.715 ' N ' HD13 ' A' ' 94' ' ' LEU . 20.3 tpp180 -44.1 -29.62 0.64 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.5 1.125 . . . . 72.140000000000001 110.306 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.594 HG13 ' N ' ' A' ' 97' ' ' GLN . 10.6 p -86.13 -56.23 5.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 O-C-N 124.403 1.064 . . . . 71.010000000000005 109.286 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.67 HE21 HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -47.44 -23.74 0.67 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.454 1.096 . . . . 71.349999999999994 110.309 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.75 -39.19 57.58 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.515 1.135 . . . . 74.230000000000004 109.318 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.751 ' C ' HD23 ' A' ' 99' ' ' LEU . 0.0 OUTLIER -83.73 -19.52 35.03 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.505 1.128 . . . . 72.109999999999999 109.344 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.907 HD22 HG11 ' A' ' 206' ' ' VAL . 87.7 mt -79.33 -20.17 48.52 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.477 1.111 . . . . 51.509999999999998 109.234 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . 0.512 ' O ' ' CD ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -89.47 -11.98 41.45 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.475 1.109 . . . . 64.510000000000005 110.247 -179.96 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . 0.468 ' O ' ' C ' ' A' ' 103' ' ' ASP . 29.2 t70 -116.07 -57.21 2.24 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.434 1.084 . . . . 73.150000000000006 109.342 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.542 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 7.2 t0 -34.41 -65.68 0.19 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.516 1.135 . . . . 70.129999999999995 109.347 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.455 ' HE1' HD23 ' A' ' 100' ' ' LEU . 4.3 m-85 -102.63 -31.88 10.16 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.475 1.109 . . . . 64.439999999999998 111.02 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.473 ' O ' ' N ' ' A' ' 107' ' ' LYS . . . 108.57 28.47 4.55 Favored Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.488 1.118 . . . . 62.119999999999997 110.987 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.657 HD12 ' HZ1' ' A' ' 80' ' ' LYS . 24.1 mm -65.29 73.89 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.479 0.752 . . . . 70.299999999999997 109.325 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.539 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.8 OUTLIER -127.45 156.34 75.26 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.504 1.127 . . . . 73.420000000000002 109.295 -179.936 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.1 Cg_endo -75.05 132.14 26.57 Favored 'Cis proline' 0 C--N 1.361 1.192 0 C-N-CA 120.98 -2.508 . . . . 74.409999999999997 110.991 0.091 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . 0.434 ' N ' ' HA ' ' A' ' 107' ' ' LYS . . . -107.02 117.19 5.23 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.444 1.09 . . . . 74.230000000000004 110.959 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.488 HG22 HD11 ' A' ' 79' ' ' LEU . 1.0 OUTLIER -131.38 150.3 34.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 O-C-N 124.484 0.756 . . . . 71.319999999999993 109.307 179.957 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . 0.695 HD12 ' NE2' ' A' ' 85' ' ' HIS . 45.3 pt -99.2 -175.56 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.499 1.125 . . . . 72.109999999999999 109.322 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.839 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 0.4 OUTLIER -81.82 -18.7 43.08 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.542 1.151 . . . . 71.319999999999993 111.059 179.994 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.87 -3.61 51.51 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.481 1.113 . . . . 74.129999999999995 109.266 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.422 ' CB ' HG12 ' A' ' 110' ' ' ILE . 3.6 mt-10 -106.82 -24.85 11.93 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.532 1.145 . . . . 63.210000000000001 110.321 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 15.0 ttm -55.9 110.97 2.64 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.509 1.13 . . . . 71.439999999999998 110.993 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo . . . . . 0 C--N 1.361 1.188 0 O-C-N 124.497 1.788 . . . . 64.239999999999995 110.935 -179.927 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.788 HD12 ' N ' ' A' ' 126' ' ' ASP . 0.9 OUTLIER . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 109.26 -0.644 . . . . 64.109999999999999 109.26 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.788 ' N ' HD12 ' A' ' 125' ' ' LEU . 7.4 p-10 -78.85 -14.55 59.18 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.486 1.116 . . . . 73.230000000000004 109.322 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -58.15 -52.59 64.91 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.51 1.131 . . . . 54.0 109.309 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.839 ' HB2' ' CE1' ' A' ' 112' ' ' PHE . . . -67.4 -14.52 63.0 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.48 1.112 . . . . 44.149999999999999 109.304 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.647 HG12 ' O ' ' A' ' 129' ' ' VAL . 52.0 t -87.46 11.67 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.539 1.149 . . . . 61.399999999999999 109.25 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -141.09 124.51 16.67 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.556 1.16 . . . . 63.299999999999997 109.288 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 90.84 41.57 5.29 Favored Glycine 0 CA--C 1.53 0.987 0 O-C-N 124.608 1.193 . . . . 74.010000000000005 111.003 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.77 166.23 24.5 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.491 0.759 . . . . 51.439999999999998 110.021 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.77 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -87.58 -56.46 3.34 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.464 1.102 . . . . 73.209999999999994 109.296 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.77 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.8 m-90 -131.21 177.23 7.62 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.973 -1.121 . . . . 71.140000000000001 107.973 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . 0.657 HG22 ' CG1' ' A' ' 82' ' ' VAL . 25.9 p -152.4 132.62 13.58 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.462 1.101 . . . . 62.130000000000003 110.454 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.647 ' O ' HD22 ' A' ' 137' ' ' LEU . 1.3 mp -84.32 140.78 15.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.464 1.102 . . . . 75.129999999999995 109.274 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.647 HD22 ' O ' ' A' ' 136' ' ' ILE . 2.8 mm? -126.73 96.71 4.74 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.609 1.193 . . . . 44.219999999999999 109.283 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.775 HD21 ' HB2' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.65 97.85 0.11 Allowed 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.47 1.106 . . . . 74.150000000000006 109.302 179.988 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.609 HD21 HG23 ' A' ' 185' ' ' THR . 3.2 tp -66.84 103.72 1.19 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.577 1.173 . . . . 65.540000000000006 109.321 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . 0.598 ' C ' HD23 ' A' ' 180' ' ' LEU . 2.7 m -121.39 177.85 5.03 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.482 1.114 . . . . 62.420000000000002 110.409 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . 0.483 ' H ' HG22 ' A' ' 140' ' ' THR . 2.2 mp0 -83.83 -35.9 23.88 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.431 1.082 . . . . 75.519999999999996 110.298 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . 0.44 ' OD1' ' N ' ' A' ' 143' ' ' PHE . 15.3 p30 -85.79 -41.92 14.64 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.47 1.106 . . . . 74.340000000000003 109.286 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.52 ' CE1' HG21 ' A' ' 147' ' ' THR . 61.3 t80 -63.67 -21.39 66.36 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.462 1.102 . . . . 70.010000000000005 110.974 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.699 ' C ' HD13 ' A' ' 144' ' ' LEU . 2.0 tm? -63.88 -67.52 0.42 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.504 1.127 . . . . 65.420000000000002 109.337 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 52.6 mmm-85 -56.71 -17.41 8.84 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.558 1.161 . . . . 72.150000000000006 110.292 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.19 -66.5 0.72 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.482 1.113 . . . . 74.129999999999995 109.296 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.562 ' HB ' ' CZ ' ' A' ' 151' ' ' PHE . 2.5 p -68.29 -53.94 20.93 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.494 1.121 . . . . 73.099999999999994 110.376 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 3.6 t-105 -43.31 -41.99 4.28 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.482 1.114 . . . . 64.329999999999998 108.025 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' CYS . . . . . 0.453 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 41.7 t -71.94 -45.43 61.13 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.53 1.144 . . . . 72.329999999999998 108.244 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' ASN . . . . . 0.434 ' HB3' HD21 ' A' ' 125' ' ' LEU . 27.9 m120 -52.42 -30.83 31.4 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.427 1.079 . . . . 64.329999999999998 109.299 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 1.09 ' CE1' HD12 ' A' ' 157' ' ' LEU . 7.7 m-30 -73.14 -36.11 66.62 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.546 1.153 . . . . 74.099999999999994 110.969 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -65.05 -29.95 70.88 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.519 1.137 . . . . 61.439999999999998 110.317 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -93.64 -32.05 14.23 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.452 1.095 . . . . 73.200000000000003 111.029 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.42 ' CD2' ' HB3' ' A' ' 156' ' ' SER . 1.6 t80 -132.76 97.92 4.18 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.537 1.148 . . . . 75.25 111.037 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 2.9 t -65.64 -10.99 40.86 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.468 1.105 . . . . 73.530000000000001 110.409 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . 0.42 ' HB3' ' CD2' ' A' ' 154' ' ' TYR . 3.4 t -52.02 -36.01 48.67 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.46 1.1 . . . . 74.439999999999998 110.042 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 1.09 HD12 ' CE1' ' A' ' 151' ' ' PHE . 1.7 tm? -87.66 -28.92 21.54 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.467 1.105 . . . . 70.5 109.21 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 158' ' ' MET . . . . . 0.769 ' HE2' HG21 ' A' ' 161' ' ' VAL . 1.6 tpt -62.85 -16.52 58.93 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.498 1.124 . . . . 74.530000000000001 110.992 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -90.63 -10.8 41.96 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.546 1.154 . . . . 74.430000000000007 109.311 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 160' ' ' SER . . . . . 0.641 ' CB ' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -81.46 -38.57 26.18 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.529 1.143 . . . . 74.129999999999995 110.008 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . 0.769 HG21 ' HE2' ' A' ' 158' ' ' MET . 4.1 m -59.85 -18.28 15.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.485 1.116 . . . . 71.019999999999996 109.317 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 162' ' ' ASN . . . . . 0.526 ' N ' HD22 ' A' ' 162' ' ' ASN . 1.0 OUTLIER -63.91 -13.16 43.28 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.521 1.138 . . . . 70.030000000000001 109.258 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.64 ' HG3' HG23 ' A' ' 192' ' ' ILE . 4.8 mmm180 63.02 39.79 9.81 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.467 1.104 . . . . 54.520000000000003 110.344 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -52.51 -174.1 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.553 1.158 . . . . 72.540000000000006 110.333 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -127.34 50.7 1.97 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.49 1.119 . . . . 74.040000000000006 109.618 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.424 ' HA ' HG21 ' A' ' 221' ' ' ILE . 0.7 OUTLIER -98.43 -174.37 2.8 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.55 1.156 . . . . 70.019999999999996 109.344 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 167' ' ' TYR . . . . . 0.603 ' CD1' ' N ' ' A' ' 168' ' ' ASN . 26.4 p90 -54.81 -42.68 72.15 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.543 1.152 . . . . 70.299999999999997 111.024 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . 0.603 ' N ' ' CD1' ' A' ' 167' ' ' TYR . 1.2 p-10 -98.05 134.94 40.44 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.411 1.07 . . . . 73.450000000000003 109.272 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.445 ' N ' ' O ' ' A' ' 133' ' ' ALA . 16.1 m -123.55 146.76 47.87 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.459 1.099 . . . . 63.130000000000003 109.968 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.641 HG21 ' CB ' ' A' ' 160' ' ' SER . 43.5 t -103.33 137.94 29.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 O-C-N 124.44 1.088 . . . . 61.140000000000001 109.314 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.612 HD13 ' O ' ' A' ' 170' ' ' VAL . 15.9 mm -141.86 104.99 5.76 Favored Pre-proline 0 C--N 1.325 -0.463 0 O-C-N 124.542 1.151 . . . . 53.43 109.283 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . 0.755 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.3 Cg_endo -74.96 106.2 2.23 Favored 'Trans proline' 0 C--N 1.36 1.167 0 O-C-N 124.478 1.778 . . . . 72.329999999999998 111.015 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . 0.477 ' HE3' HD12 ' A' ' 195' ' ' LEU . 4.4 ttt -94.06 154.27 17.71 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.437 1.086 . . . . 62.039999999999999 111.034 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . 0.442 ' N ' ' HG2' ' A' ' 173' ' ' MET . 0.5 OUTLIER -113.66 116.46 45.68 Favored Pre-proline 0 C--N 1.325 -0.475 0 O-C-N 124.533 1.145 . . . . 73.420000000000002 110.265 -179.952 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 175' ' ' PRO . . . . . 0.572 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.4 Cg_endo -74.98 153.65 42.0 Favored 'Trans proline' 0 C--N 1.359 1.129 0 O-C-N 124.476 1.777 . . . . 64.019999999999996 110.948 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . 0.837 ' N ' HD13 ' A' ' 176' ' ' LEU . 0.0 OUTLIER -91.25 -39.32 12.15 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.508 1.13 . . . . 72.430000000000007 109.293 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -72.61 -23.38 60.93 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.509 1.13 . . . . 65.140000000000001 109.258 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 178' ' ' ASN . . . . . 0.491 ' OD1' HG23 ' A' ' 140' ' ' THR . 1.1 m-80 -110.75 108.21 57.95 Favored Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.493 1.121 . . . . 73.319999999999993 109.339 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.96 125.23 9.21 Favored 'Trans proline' 0 C--N 1.36 1.134 0 O-C-N 124.511 1.795 . . . . 63.329999999999998 110.971 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.598 HD23 ' C ' ' A' ' 140' ' ' THR . 1.2 tm? -140.68 97.02 7.41 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.455 1.097 . . . . 72.430000000000007 109.327 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.02 153.77 41.94 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.567 1.825 . . . . 51.340000000000003 111.004 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.44 -29.06 61.19 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.577 1.173 . . . . 74.030000000000001 110.323 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -58.71 -31.62 68.42 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.555 1.159 . . . . 73.049999999999997 110.306 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 -99.41 13.24 33.95 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.463 1.102 . . . . 64.25 110.298 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 185' ' ' THR . . . . . 0.609 HG23 HD21 ' A' ' 139' ' ' LEU . 46.5 m -106.53 144.13 28.39 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.537 1.148 . . . . 70.040000000000006 110.384 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 186' ' ' PRO . . . . . 0.683 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -75.04 146.04 32.04 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.527 1.804 . . . . 74.230000000000004 111.012 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 187' ' ' PHE . . . . . 0.433 ' O ' HG23 ' A' ' 191' ' ' THR . 14.0 p90 -62.4 -11.94 18.64 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.475 1.109 . . . . 72.409999999999997 110.994 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . 0.474 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -87.2 -53.79 4.66 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.586 1.179 . . . . 64.349999999999994 109.23 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.683 HD12 ' CG ' ' A' ' 186' ' ' PRO . 22.4 mt -74.19 -17.67 60.87 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.496 1.123 . . . . 73.329999999999998 109.267 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 190' ' ' GLN . . . . . 0.48 ' CG ' ' O ' ' A' ' 190' ' ' GLN . 6.8 tt0 -86.41 0.69 53.54 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.443 1.089 . . . . 60.350000000000001 110.331 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 191' ' ' THR . . . . . 0.433 HG23 ' O ' ' A' ' 187' ' ' PHE . 34.1 p -127.87 16.18 6.86 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.488 1.117 . . . . 71.409999999999997 110.383 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.64 HG23 ' HG3' ' A' ' 163' ' ' ARG . 19.1 mt -117.08 152.12 18.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.481 1.113 . . . . 64.010000000000005 109.335 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 21.9 t30 -61.73 97.86 0.08 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.478 1.111 . . . . 73.310000000000002 109.343 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . 0.755 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -89.39 164.85 14.7 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.465 1.103 . . . . 45.329999999999998 109.28 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 195' ' ' LEU . . . . . 0.756 HD23 HD12 ' A' ' 209' ' ' ILE . 0.3 OUTLIER -103.09 126.4 50.25 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.429 1.081 . . . . 63.530000000000001 109.368 179.952 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -103.54 128.98 50.67 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.503 1.127 . . . . 73.239999999999995 110.289 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.754 ' HG2' HD21 ' A' ' 176' ' ' LEU . 4.2 tt0 -106.75 -30.48 8.92 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.499 1.124 . . . . 63.509999999999998 110.256 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . 0.613 ' HG2' HD12 ' A' ' 176' ' ' LEU . 4.0 pt-20 -92.51 25.24 3.1 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.511 1.132 . . . . 73.209999999999994 110.342 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.24 151.28 51.64 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.561 1.163 . . . . 63.409999999999997 109.987 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 9.9 tpt85 -67.62 -11.88 59.19 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.461 1.101 . . . . 72.219999999999999 110.312 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -93.62 15.37 63.2 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.503 1.127 . . . . 73.109999999999999 110.966 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 202' ' ' PHE . . . . . 0.791 ' CZ ' HD21 ' A' ' 100' ' ' LEU . 8.5 t80 -66.29 -38.84 23.27 Favored Pre-proline 0 C--N 1.325 -0.463 0 O-C-N 124.443 0.731 . . . . 64.400000000000006 111.046 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 203' ' ' PRO . . . . . 0.683 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -74.95 -42.04 0.58 Allowed 'Trans proline' 0 C--N 1.36 1.162 0 O-C-N 124.556 1.819 . . . . 74.140000000000001 110.944 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -48.38 -63.13 1.16 Allowed 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.529 1.143 . . . . 74.400000000000006 110.406 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 205' ' ' GLN . . . . . 0.448 ' O ' ' N ' ' A' ' 209' ' ' ILE . 7.7 mt-30 -55.46 -55.48 31.22 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.468 1.105 . . . . 64.040000000000006 110.312 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 206' ' ' VAL . . . . . 0.907 HG11 HD22 ' A' ' 100' ' ' LEU . 75.4 t -47.24 -31.07 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.541 1.151 . . . . 70.129999999999995 109.256 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -81.15 -39.05 26.15 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.515 1.134 . . . . 51.119999999999997 110.266 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -77.03 -66.64 0.8 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.475 1.11 . . . . 72.319999999999993 110.34 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 209' ' ' ILE . . . . . 0.756 HD12 HD23 ' A' ' 195' ' ' LEU . 92.9 mt -44.53 -47.23 2.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.487 1.117 . . . . 74.329999999999998 109.301 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 210' ' ' PHE . . . . . 0.713 ' CD1' HG22 ' A' ' 209' ' ' ILE . 0.7 OUTLIER -107.66 66.87 0.67 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.466 1.104 . . . . 75.439999999999998 110.985 179.99 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 211' ' ' GLN . . . . . 0.541 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.4 OUTLIER -110.8 146.3 36.64 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.547 1.154 . . . . 65.349999999999994 110.318 179.953 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . 0.441 ' O ' ' N ' ' A' ' 215' ' ' TYR . 29.6 tt0 -48.85 -55.18 12.4 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.552 1.157 . . . . 52.229999999999997 110.351 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.04 -24.6 1.63 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.449 1.093 . . . . 52.340000000000003 109.995 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.541 HG23 ' HG2' ' A' ' 211' ' ' GLN . 40.3 t -96.22 -26.45 4.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.585 1.178 . . . . 75.310000000000002 109.29 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 215' ' ' TYR . . . . . 0.441 ' N ' ' O ' ' A' ' 212' ' ' GLU . 4.2 t80 -67.46 -34.18 76.66 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.549 1.155 . . . . 73.340000000000003 111.021 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . 0.419 ' O ' ' CB ' ' A' ' 220' ' ' THR . 41.3 mmtt -54.32 -59.45 4.66 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.493 1.121 . . . . 74.319999999999993 109.255 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 217' ' ' THR . . . . . 0.868 HG22 HD11 ' A' ' 221' ' ' ILE . 7.6 m -52.78 -66.51 0.37 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.444 1.09 . . . . 73.549999999999997 110.406 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 218' ' ' GLN . . . . . 0.406 ' HA ' HD12 ' A' ' 221' ' ' ILE . 2.0 mp0 -39.74 -65.33 0.4 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.508 1.13 . . . . 73.319999999999993 110.271 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -55.51 -30.44 60.69 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.491 1.12 . . . . 65.329999999999998 110.249 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 220' ' ' THR . . . . . 0.432 ' N ' ' O ' ' A' ' 217' ' ' THR . 2.1 m -76.63 -20.59 56.54 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.49 1.119 . . . . 71.530000000000001 110.393 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 221' ' ' ILE . . . . . 0.868 HD11 HG22 ' A' ' 217' ' ' THR . 15.2 mt -90.15 -28.46 5.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.523 1.14 . . . . 61.299999999999997 109.317 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 222' ' ' TRP . . . . . 0.595 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 23.9 t90 -69.62 -29.22 66.66 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.514 1.134 . . . . 75.430000000000007 107.972 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.446 ' HG3' ' N ' ' A' ' 224' ' ' GLU . 0.5 OUTLIER -86.85 -27.91 23.2 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.473 1.108 . . . . 71.329999999999998 109.302 -179.976 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . 0.446 ' N ' ' HG3' ' A' ' 223' ' ' LYS . 1.6 mm-40 . . . . . 0 C--N 1.326 -0.443 0 O-C-N 124.5 1.125 . . . . 54.539999999999999 110.273 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.587 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.2 p . . . . . 0 N--CA 1.454 -0.234 0 N-CA-C 109.249 -0.648 . . . . 73.409999999999997 109.249 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.482 ' CE2' ' OH ' ' A' ' 215' ' ' TYR . 13.7 t80 -88.71 25.41 1.75 Allowed 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.47 1.106 . . . . 72.019999999999996 111.019 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.676 HD11 HG22 ' A' ' 110' ' ' ILE . 4.7 tp -39.79 158.33 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.474 1.109 . . . . 75.0 109.298 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.633 ' NZ ' HG23 ' A' ' 106' ' ' ILE . 6.9 ttpt -104.97 -51.86 2.96 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.597 1.185 . . . . 70.349999999999994 109.261 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.621 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.4 OUTLIER -165.46 132.69 2.91 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.461 1.101 . . . . 75.109999999999999 111.039 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.533 HG22 ' N ' ' A' ' 83' ' ' ILE . 2.7 p -86.25 166.8 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.489 1.118 . . . . 71.319999999999993 109.324 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.766 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.0 mp -129.64 93.18 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.51 1.132 . . . . 71.519999999999996 109.27 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.913 HD11 ' HB3' ' A' ' 128' ' ' ALA . 5.0 mt -70.16 116.19 10.23 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.513 1.133 . . . . 73.5 109.396 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.596 ' CE1' ' OG1' ' A' ' 90' ' ' THR . 0.0 OUTLIER -134.15 174.36 10.59 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.492 1.12 . . . . 74.450000000000003 109.578 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.454 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -113.22 164.4 13.58 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.609 1.193 . . . . 75.129999999999995 109.263 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.451 ' CG ' ' O ' ' A' ' 87' ' ' GLU . 16.7 tt0 -68.41 -7.64 33.38 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.584 1.177 . . . . 72.549999999999997 110.318 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -89.54 -26.74 20.7 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.522 1.139 . . . . 73.219999999999999 109.286 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.502 ' O ' ' CD2' ' A' ' 138' ' ' LEU . 1.3 m-20 -142.56 44.25 1.62 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.526 1.142 . . . . 74.030000000000001 109.314 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.596 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -76.82 -33.69 57.95 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.435 1.085 . . . . 73.040000000000006 110.385 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -73.89 -41.33 62.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.479 1.112 . . . . 54.439999999999998 109.31 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.405 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 4.8 tp10 -58.65 -52.36 66.03 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.566 1.167 . . . . 73.409999999999997 110.355 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.953 ' HB2' ' CD2' ' A' ' 138' ' ' LEU . . . -59.25 -25.79 64.35 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.527 1.142 . . . . 73.129999999999995 109.296 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.952 HD22 ' O ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -82.26 -34.57 28.7 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.533 1.145 . . . . 71.209999999999994 109.321 179.919 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.614 ' N ' HD13 ' A' ' 94' ' ' LEU . 6.0 tpt180 -55.58 -29.6 59.34 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.486 1.116 . . . . 70.5 110.294 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.885 HG21 ' HE1' ' A' ' 173' ' ' MET . 1.7 t -83.1 -65.1 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.547 1.155 . . . . 51.329999999999998 109.33 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.73 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -40.27 -27.69 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.47 1.106 . . . . 64.030000000000001 110.29 179.995 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.449 ' N ' ' C ' ' A' ' 96' ' ' VAL . 2.0 t-20 -70.53 -54.57 11.65 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.469 1.106 . . . . 72.239999999999995 109.253 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.846 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -67.74 -22.88 65.21 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.464 1.102 . . . . 64.329999999999998 109.334 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.846 ' N ' HD23 ' A' ' 99' ' ' LEU . 28.5 mt -61.43 -57.96 10.09 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.539 1.149 . . . . 73.140000000000001 109.305 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -75.27 59.97 1.06 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.489 1.118 . . . . 74.109999999999999 110.341 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.4 t70 177.99 -65.46 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.528 1.143 . . . . 73.409999999999997 109.298 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.565 ' OD1' ' CE1' ' A' ' 104' ' ' PHE . 9.2 t70 -47.24 -50.26 21.56 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.484 1.115 . . . . 73.120000000000005 109.312 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.566 ' CZ ' HG11 ' A' ' 206' ' ' VAL . 2.0 m-85 -114.55 -26.51 7.88 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.416 1.073 . . . . 64.239999999999995 111.069 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.47 45.92 2.65 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.523 1.139 . . . . 33.140000000000001 110.99 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.633 HG23 ' NZ ' ' A' ' 80' ' ' LYS . 4.9 mm -86.91 84.13 2.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.436 0.727 . . . . 72.239999999999995 109.379 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.538 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -132.71 156.7 79.79 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.444 1.09 . . . . 74.040000000000006 109.271 179.999 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.538 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.95 152.45 98.23 Favored 'Cis proline' 0 C--N 1.36 1.152 0 C-N-CA 120.948 -2.522 . . . . 70.329999999999998 111.006 -0.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.82 138.34 10.23 Favored Glycine 0 CA--C 1.529 0.921 0 O-C-N 124.531 1.145 . . . . 73.439999999999998 111.038 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.676 HG22 HD11 ' A' ' 79' ' ' LEU . 1.8 tt -156.01 150.54 10.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.415 0.715 . . . . 73.129999999999995 109.338 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . 0.923 HD13 ' HB2' ' A' ' 94' ' ' LEU . 9.8 pt -101.35 168.7 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.525 1.141 . . . . 64.319999999999993 109.293 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.505 ' HE1' ' HB2' ' A' ' 128' ' ' ALA . 1.8 t80 -67.18 -19.8 65.63 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.513 1.133 . . . . 74.439999999999998 111.073 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.626 ' HB3' HD12 ' A' ' 111' ' ' ILE . . . -87.2 -14.29 41.54 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.519 1.137 . . . . 64.129999999999995 109.292 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -102.85 -19.11 14.79 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.446 1.091 . . . . 71.040000000000006 110.287 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.461 ' CG ' ' HD2' ' A' ' 116' ' ' PRO . 6.5 ttm -46.56 144.05 3.67 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.512 1.132 . . . . 54.409999999999997 111.042 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.461 ' HD2' ' CG ' ' A' ' 115' ' ' MET . 18.4 Cg_endo . . . . . 0 C--N 1.359 1.119 0 O-C-N 124.462 1.77 . . . . 62.039999999999999 111.0 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.773 HD11 ' CD2' ' A' ' 157' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.453 -0.305 0 N-CA-C 109.349 -0.612 . . . . 73.310000000000002 109.349 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.423 ' OD2' ' N ' ' A' ' 127' ' ' ASP . 6.9 p-10 -55.99 -21.57 21.92 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.46 1.1 . . . . 71.420000000000002 109.321 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.423 ' N ' ' OD2' ' A' ' 126' ' ' ASP . 1.0 OUTLIER -53.97 -52.89 59.28 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.455 1.097 . . . . 72.349999999999994 109.275 179.984 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.913 ' HB3' HD11 ' A' ' 84' ' ' LEU . . . -62.94 -26.77 68.98 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.438 1.086 . . . . 74.430000000000007 109.323 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.757 ' HA ' HG21 ' A' ' 135' ' ' THR . 3.0 t -78.26 -0.56 3.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.51 1.131 . . . . 71.430000000000007 109.263 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -126.27 126.02 43.3 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.535 1.147 . . . . 64.329999999999998 109.282 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 87.29 49.65 3.89 Favored Glycine 0 CA--C 1.53 0.978 0 O-C-N 124.489 1.118 . . . . 52.229999999999997 111.002 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . 0.403 ' O ' ' O ' ' A' ' 167' ' ' TYR . 0.3 OUTLIER -163.71 177.39 8.73 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.498 0.763 . . . . 70.209999999999994 109.988 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.81 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -104.42 -25.58 12.76 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.519 1.137 . . . . 71.209999999999994 109.268 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.81 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 4.1 m-90 -160.68 153.67 21.39 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.548 1.155 . . . . 70.140000000000001 107.995 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . 0.757 HG21 ' HA ' ' A' ' 129' ' ' VAL . 2.0 p -123.03 128.13 49.74 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.484 1.115 . . . . 72.150000000000006 110.338 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.766 ' HB ' HG23 ' A' ' 83' ' ' ILE . 23.9 mm -84.19 134.2 27.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.528 1.143 . . . . 74.409999999999997 109.296 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.51 HD23 ' O ' ' A' ' 136' ' ' ILE . 20.0 mt -127.91 97.69 4.89 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.49 1.119 . . . . 75.439999999999998 109.307 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.953 ' CD2' ' HB2' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -62.33 99.3 0.13 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.465 1.103 . . . . 65.219999999999999 109.329 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.647 HD11 HD13 ' A' ' 189' ' ' LEU . 0.2 OUTLIER -70.76 105.05 3.06 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.405 1.066 . . . . 74.219999999999999 109.311 -179.977 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . 0.691 HG22 ' H ' ' A' ' 141' ' ' GLU . 13.6 m -132.01 -177.58 4.51 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.498 1.124 . . . . 73.329999999999998 110.357 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . 0.691 ' H ' HG22 ' A' ' 140' ' ' THR . 3.8 mp0 -81.67 -44.44 17.15 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.511 1.132 . . . . 75.129999999999995 110.323 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -82.87 -16.8 46.19 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.536 1.147 . . . . 51.439999999999998 109.327 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.454 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 16.2 t80 -90.06 -19.74 24.02 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.491 1.119 . . . . 71.439999999999998 110.978 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.7 ' C ' HD13 ' A' ' 144' ' ' LEU . 2.0 tm? -61.33 -67.87 0.37 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.537 1.148 . . . . 62.109999999999999 109.298 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.45 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 10.9 mmt85 -62.87 -13.29 32.25 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.5 1.125 . . . . 72.209999999999994 110.253 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -68.84 -53.98 18.36 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.497 1.123 . . . . 71.140000000000001 109.252 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.471 ' HB ' ' CE1' ' A' ' 151' ' ' PHE . 2.7 p -88.66 -50.57 6.17 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.508 1.13 . . . . 65.109999999999999 110.348 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.62 ' CH2' ' CB ' ' A' ' 186' ' ' PRO . 3.4 t-105 -44.02 -32.39 1.15 Allowed 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.496 1.122 . . . . 73.439999999999998 108.004 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' CYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 42.2 t -81.48 -45.48 15.93 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.535 1.147 . . . . 71.450000000000003 108.32 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' ASN . . . . . 0.601 ' O ' ' CD2' ' A' ' 154' ' ' TYR . 50.5 m-20 -62.99 -14.17 44.41 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.559 1.162 . . . . 73.010000000000005 109.304 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.561 ' CZ ' ' HG ' ' A' ' 157' ' ' LEU . 3.6 m-30 -80.16 -57.21 3.73 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.461 1.1 . . . . 74.450000000000003 110.934 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -47.8 -32.39 5.99 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.466 1.104 . . . . 70.530000000000001 110.253 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.446 ' HB3' ' CD1' ' A' ' 154' ' ' TYR . 0.4 OUTLIER -83.97 -37.08 22.71 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.456 1.097 . . . . 71.340000000000003 110.994 179.973 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.601 ' CD2' ' O ' ' A' ' 150' ' ' ASN . 1.0 OUTLIER -119.16 70.78 0.84 Allowed 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.44 1.088 . . . . 75.019999999999996 111.022 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 11.7 t -43.85 -26.5 0.27 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.544 1.152 . . . . 74.140000000000001 110.4 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . 0.415 ' N ' ' C ' ' A' ' 154' ' ' TYR . 3.0 t -45.07 -44.42 10.27 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.507 1.129 . . . . 70.430000000000007 109.99 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.773 ' CD2' HD11 ' A' ' 125' ' ' LEU . 2.2 tp -69.04 -38.62 79.26 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.55 1.156 . . . . 61.329999999999998 109.31 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 158' ' ' MET . . . . . 0.593 ' O ' HG22 ' A' ' 161' ' ' VAL . 0.0 OUTLIER -62.57 -16.6 57.03 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.455 1.097 . . . . 74.409999999999997 110.991 -179.978 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' ASN . . . . . 0.46 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 82.6 m-20 -93.54 -9.66 37.48 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.425 1.078 . . . . 41.32 109.357 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 160' ' ' SER . . . . . 0.948 ' OG ' HG21 ' A' ' 170' ' ' VAL . 1.2 p -82.49 -24.11 34.34 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.5 1.125 . . . . 71.430000000000007 109.965 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . 0.798 ' O ' HD11 ' A' ' 192' ' ' ILE . 3.6 m -69.38 -15.7 19.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.497 1.123 . . . . 73.239999999999995 109.249 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 162' ' ' ASN . . . . . 0.45 ' CB ' ' OE1' ' A' ' 164' ' ' GLN . 4.6 m120 -65.87 -9.8 32.45 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 75.519999999999996 109.326 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.476 ' HD3' HG23 ' A' ' 192' ' ' ILE . 5.3 mmm180 67.87 53.88 0.65 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.471 1.107 . . . . 74.450000000000003 110.313 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . 0.693 ' H ' ' NE2' ' A' ' 164' ' ' GLN . 1.8 mp0 -51.26 -176.55 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.503 1.127 . . . . 51.130000000000003 110.371 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -134.76 19.69 3.54 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.424 1.078 . . . . 74.109999999999999 109.603 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.411 ' HA ' HG21 ' A' ' 221' ' ' ILE . 0.0 OUTLIER -78.71 -155.94 0.09 Allowed 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.488 1.117 . . . . 64.400000000000006 109.274 -179.944 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 167' ' ' TYR . . . . . 0.53 ' CD2' ' OD1' ' A' ' 168' ' ' ASN . 55.3 p90 -88.86 37.41 0.84 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.527 1.142 . . . . 75.299999999999997 110.944 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . 0.53 ' OD1' ' CD2' ' A' ' 167' ' ' TYR . 9.7 m120 -170.09 122.19 0.67 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.495 1.122 . . . . 73.310000000000002 109.333 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.522 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 2.9 m -114.84 173.84 6.27 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.508 1.13 . . . . 61.140000000000001 110.057 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.948 HG21 ' OG ' ' A' ' 160' ' ' SER . 51.1 t -128.53 119.94 51.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.516 1.135 . . . . 64.439999999999998 109.343 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.671 HD13 ' O ' ' A' ' 170' ' ' VAL . 35.2 mm -134.18 93.44 19.62 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.485 1.116 . . . . 63.25 109.271 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . 0.818 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.07 107.93 2.6 Favored 'Trans proline' 0 C--N 1.361 1.209 0 O-C-N 124.468 1.773 . . . . 64.099999999999994 110.967 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . 0.885 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.0 ttt -80.66 160.09 25.13 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.534 1.146 . . . . 64.030000000000001 110.985 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . 0.417 ' N ' ' HG2' ' A' ' 173' ' ' MET . 69.4 mtt180 -116.68 128.44 26.01 Favored Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.513 1.133 . . . . 73.150000000000006 110.292 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 175' ' ' PRO . . . . . 0.646 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.4 Cg_endo -74.98 152.25 40.63 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.566 1.824 . . . . 74.239999999999995 111.013 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . 0.822 ' N ' HD13 ' A' ' 176' ' ' LEU . 0.0 OUTLIER -93.93 -44.54 8.03 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.482 1.114 . . . . 74.409999999999997 109.34 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -72.78 -26.8 61.66 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.479 1.112 . . . . 74.219999999999999 109.361 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -107.12 103.45 48.06 Favored Pre-proline 0 C--N 1.325 -0.474 0 O-C-N 124.462 1.101 . . . . 74.230000000000004 109.311 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 121.33 6.52 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.468 1.772 . . . . 43.229999999999997 110.997 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.478 HD22 ' HA ' ' A' ' 180' ' ' LEU . 0.8 OUTLIER -131.22 98.68 18.39 Favored Pre-proline 0 C--N 1.325 -0.481 0 O-C-N 124.532 1.145 . . . . 52.43 109.35 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 181' ' ' PRO . . . . . 0.447 ' HG2' ' CG ' ' A' ' 183' ' ' GLU . 18.2 Cg_endo -75.01 163.41 35.36 Favored 'Trans proline' 0 C--N 1.359 1.129 0 O-C-N 124.46 1.769 . . . . 60.509999999999998 110.983 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.47 -33.95 66.43 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.528 1.142 . . . . 71.510000000000005 110.278 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . 0.447 ' CG ' ' HG2' ' A' ' 181' ' ' PRO . 2.5 pt-20 -50.0 -23.23 1.91 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.529 1.143 . . . . 73.5 110.306 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 184' ' ' ARG . . . . . 0.458 ' HD3' ' N ' ' A' ' 184' ' ' ARG . 1.9 mpt_? -105.22 -28.75 10.77 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.526 1.141 . . . . 74.239999999999995 110.309 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 185' ' ' THR . . . . . 0.573 HG23 ' CD2' ' A' ' 139' ' ' LEU . 17.7 m -71.2 143.84 88.92 Favored Pre-proline 0 C--N 1.325 -0.481 0 O-C-N 124.522 1.139 . . . . 60.210000000000001 110.44 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 186' ' ' PRO . . . . . 0.835 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.2 Cg_endo -75.03 155.88 42.83 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.446 1.761 . . . . 44.229999999999997 110.994 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 187' ' ' PHE . . . . . 0.512 ' O ' ' CG2' ' A' ' 191' ' ' THR . 36.3 p90 -69.79 -6.62 33.49 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.509 1.131 . . . . 45.32 111.038 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . 0.755 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -94.61 -53.09 4.02 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.592 1.182 . . . . 52.130000000000003 109.263 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.835 HD12 ' CG ' ' A' ' 186' ' ' PRO . 40.3 mt -68.49 -42.29 78.84 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.496 1.123 . . . . 70.109999999999999 109.278 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 190' ' ' GLN . . . . . 0.402 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.2 pt20 -64.38 -10.12 22.56 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.498 1.124 . . . . 73.340000000000003 110.321 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 191' ' ' THR . . . . . 0.512 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 25.5 p -112.64 12.49 19.78 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.435 1.084 . . . . 71.349999999999994 110.44 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.798 HD11 ' O ' ' A' ' 161' ' ' VAL . 3.1 mt -115.92 154.11 17.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.491 1.12 . . . . 71.120000000000005 109.309 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -65.39 76.28 0.06 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.508 1.13 . . . . 72.439999999999998 109.303 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . 0.818 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -70.78 161.91 30.08 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.533 1.145 . . . . 64.439999999999998 109.336 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 195' ' ' LEU . . . . . 0.677 HD12 ' CE ' ' A' ' 173' ' ' MET . 0.2 OUTLIER -96.57 128.91 43.95 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.561 1.163 . . . . 72.109999999999999 109.271 -179.981 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . 0.433 ' CB ' ' HB2' ' A' ' 199' ' ' SER . 0.7 OUTLIER -118.28 136.71 53.53 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.449 1.093 . . . . 74.010000000000005 110.313 179.994 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.819 ' OE2' HD21 ' A' ' 176' ' ' LEU . 0.7 OUTLIER -103.22 -37.34 7.73 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.434 1.084 . . . . 75.420000000000002 110.308 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . 0.644 ' HG3' HD12 ' A' ' 176' ' ' LEU . 3.4 mt-10 -80.19 -15.2 57.56 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 124.48 1.112 . . . . 73.349999999999994 110.313 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . 0.433 ' HB2' ' CB ' ' A' ' 196' ' ' GLU . 7.5 t -68.21 159.57 30.9 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.527 1.142 . . . . 71.140000000000001 109.941 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -66.67 -48.37 69.55 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.477 1.11 . . . . 74.019999999999996 110.289 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -89.62 29.49 6.23 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.547 1.155 . . . . 65.129999999999995 110.994 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 202' ' ' PHE . . . . . 0.615 ' CD1' ' C ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -52.33 -47.36 93.01 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.487 0.757 . . . . 73.209999999999994 111.032 179.968 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 203' ' ' PRO . . . . . 0.658 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.2 Cg_endo -75.06 -27.48 9.88 Favored 'Trans proline' 0 C--N 1.36 1.143 0 O-C-N 124.432 1.754 . . . . 74.420000000000002 110.955 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -59.26 -53.9 52.99 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.49 1.118 . . . . 75.409999999999997 110.412 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 205' ' ' GLN . . . . . 0.407 ' O ' ' C ' ' A' ' 206' ' ' VAL . 13.3 mt-30 -56.02 -64.03 0.99 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.512 1.132 . . . . 70.5 110.274 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 206' ' ' VAL . . . . . 0.693 HG21 ' CD2' ' A' ' 100' ' ' LEU . 3.0 p -39.75 -40.43 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.442 1.089 . . . . 74.200000000000003 109.255 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.83 -63.96 0.96 Allowed 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.521 1.138 . . . . 74.140000000000001 110.227 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -54.68 -64.09 0.95 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.498 1.124 . . . . 72.239999999999995 110.305 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 209' ' ' ILE . . . . . 0.674 HD12 HD23 ' A' ' 195' ' ' LEU . 3.7 mt -42.44 -60.64 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.506 1.128 . . . . 71.340000000000003 109.336 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 210' ' ' PHE . . . . . 0.617 ' CD2' HG23 ' A' ' 206' ' ' VAL . 0.4 OUTLIER -101.05 70.09 1.33 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.524 1.14 . . . . 61.409999999999997 110.989 179.981 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.71 143.53 41.06 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.492 1.12 . . . . 74.239999999999995 110.331 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 215' ' ' TYR . 19.1 tt0 -49.03 -55.15 12.89 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.513 1.133 . . . . 74.239999999999995 110.322 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -46.38 -25.19 0.6 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.411 1.069 . . . . 71.409999999999997 109.966 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 8.6 t -94.81 -32.92 4.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.484 1.115 . . . . 70.219999999999999 109.341 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 215' ' ' TYR . . . . . 0.556 ' CE1' ' HG3' ' A' ' 80' ' ' LYS . 29.9 t80 -61.25 -19.65 61.94 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.552 1.158 . . . . 73.439999999999998 110.975 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . 0.423 ' N ' ' HD2' ' A' ' 216' ' ' LYS . 3.7 mmmt -62.5 -66.13 0.59 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.523 1.139 . . . . 62.130000000000003 109.33 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 217' ' ' THR . . . . . 0.84 HG22 HD11 ' A' ' 221' ' ' ILE . 1.9 m -48.93 -64.31 0.84 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.501 1.126 . . . . 70.239999999999995 110.379 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 218' ' ' GLN . . . . . 0.658 ' HA ' HD12 ' A' ' 221' ' ' ILE . 7.8 mp0 -43.02 -63.64 0.77 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.478 1.111 . . . . 70.540000000000006 110.279 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 219' ' ' GLN . . . . . 0.446 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 25.2 tp60 -50.41 -29.92 11.27 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.467 1.104 . . . . 61.210000000000001 110.29 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 220' ' ' THR . . . . . 0.406 ' HB ' ' O ' ' A' ' 217' ' ' THR . 0.9 OUTLIER -79.27 -29.77 42.71 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.531 1.144 . . . . 72.420000000000002 110.417 179.971 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 221' ' ' ILE . . . . . 0.84 HD11 HG22 ' A' ' 217' ' ' THR . 14.1 mt -76.83 -27.66 16.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.593 1.183 . . . . 71.209999999999994 109.301 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 222' ' ' TRP . . . . . 0.587 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 23.0 t90 -77.94 -55.3 5.42 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.564 1.165 . . . . 72.549999999999997 108.002 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -20.91 22.86 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.518 1.136 . . . . 71.400000000000006 109.34 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 81.5 mt-10 . . . . . 0 C--N 1.325 -0.463 0 O-C-N 124.559 1.162 . . . . 70.239999999999995 110.352 179.988 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 2.8 p . . . . . 0 N--CA 1.453 -0.287 0 N-CA-C 109.321 -0.622 . . . . 55.329999999999998 109.321 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -89.19 31.09 0.9 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.563 1.164 . . . . 73.200000000000003 111.032 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 24.6 tp -39.73 147.12 0.09 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.488 1.117 . . . . 52.210000000000001 109.28 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.44 ' CD ' ' O ' ' A' ' 107' ' ' LYS . 0.5 OUTLIER -89.82 -62.74 1.4 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.555 1.16 . . . . 75.109999999999999 109.321 179.945 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 1.076 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.9 OUTLIER -165.5 129.94 2.37 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.568 1.168 . . . . 51.539999999999999 110.992 179.953 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.676 ' CG1' HG22 ' A' ' 135' ' ' THR . 11.0 p -85.37 166.9 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.48 1.112 . . . . 75.049999999999997 109.298 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 1.076 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 1.7 mp -128.26 92.76 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.482 1.114 . . . . 65.430000000000007 109.311 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.899 HD11 ' HB3' ' A' ' 128' ' ' ALA . 3.3 mt -70.53 98.93 1.54 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.556 1.16 . . . . 72.340000000000003 109.216 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.631 ' CD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -120.32 174.4 6.54 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.448 1.093 . . . . 73.209999999999994 109.639 179.895 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.714 ' HB2' ' CD1' ' A' ' 143' ' ' PHE . . . -111.84 164.22 13.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.473 1.108 . . . . 62.43 109.263 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.442 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 14.4 tt0 -68.27 -8.78 42.36 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.488 1.118 . . . . 65.040000000000006 110.267 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -80.37 -38.45 30.39 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.516 1.135 . . . . 72.510000000000005 109.344 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.564 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -137.7 44.23 2.22 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.482 1.114 . . . . 44.109999999999999 109.349 -179.961 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.596 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -77.62 -30.09 52.15 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.465 1.103 . . . . 75.219999999999999 110.403 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.78 -25.53 61.2 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.555 1.159 . . . . 63.310000000000002 109.291 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.484 ' CG ' ' ND2' ' A' ' 177' ' ' ASN . 0.2 OUTLIER -76.62 -58.4 3.31 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.476 1.11 . . . . 73.040000000000006 110.277 -179.976 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.99 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -54.88 -19.56 6.87 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.479 1.112 . . . . 43.439999999999998 109.353 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.818 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -89.8 -50.07 6.26 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.501 1.125 . . . . 73.299999999999997 109.234 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.695 ' N ' HD13 ' A' ' 94' ' ' LEU . 38.4 tpt85 -46.8 -31.48 3.05 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.53 1.144 . . . . 75.129999999999995 110.326 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.588 HG13 ' N ' ' A' ' 97' ' ' GLN . 10.9 p -83.16 -55.85 6.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.525 1.141 . . . . 75.310000000000002 109.284 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.769 HE21 HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -47.61 -24.08 0.81 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.497 1.123 . . . . 72.200000000000003 110.315 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.402 ' O ' ' HG3' ' A' ' 101' ' ' GLN . 0.9 OUTLIER -75.48 -38.56 59.47 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.464 1.102 . . . . 63.140000000000001 109.345 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.737 HD23 ' C ' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -84.63 -19.3 33.16 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.418 1.074 . . . . 74.510000000000005 109.353 179.951 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.873 HD22 HG11 ' A' ' 206' ' ' VAL . 90.3 mt -79.76 -20.22 46.84 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.465 1.103 . . . . 52.119999999999997 109.243 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . 0.535 ' O ' ' HD3' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -88.98 -11.93 42.92 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.523 1.14 . . . . 73.150000000000006 110.324 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . 0.467 ' O ' ' C ' ' A' ' 103' ' ' ASP . 30.6 t70 -116.2 -57.15 2.24 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.426 1.078 . . . . 74.140000000000001 109.304 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.537 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 51.5 t0 -34.78 -64.78 0.24 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.528 1.142 . . . . 71.329999999999998 109.321 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.534 ' CZ ' ' OD1' ' A' ' 103' ' ' ASP . 4.4 m-85 -104.08 -32.31 9.25 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.508 1.13 . . . . 70.5 110.959 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.482 ' O ' ' N ' ' A' ' 107' ' ' LYS . . . 109.51 27.08 4.85 Favored Glycine 0 CA--C 1.529 0.939 0 O-C-N 124.581 1.175 . . . . 61.350000000000001 110.974 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.521 HG22 ' CE1' ' A' ' 81' ' ' PHE . 28.4 mm -63.98 75.63 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.408 0.711 . . . . 74.109999999999999 109.358 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.535 ' HD3' ' O ' ' A' ' 101' ' ' GLN . 0.3 OUTLIER -129.07 157.14 76.84 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.493 1.121 . . . . 74.319999999999993 109.317 -179.927 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.532 ' HA ' ' HB3' ' A' ' 107' ' ' LYS . 18.4 Cg_endo -75.04 132.0 26.11 Favored 'Cis proline' 0 C--N 1.36 1.166 0 C-N-CA 120.953 -2.52 . . . . 72.150000000000006 110.983 0.02 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . 0.442 ' N ' ' HA ' ' A' ' 107' ' ' LYS . . . -105.17 116.67 5.33 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.54 1.15 . . . . 75.010000000000005 111.009 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -129.69 148.26 33.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.503 0.766 . . . . 75.349999999999994 109.332 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . 0.769 HG23 HE21 ' A' ' 97' ' ' GLN . 41.8 pt -98.73 -175.76 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.515 1.134 . . . . 62.030000000000001 109.328 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.709 ' HE1' ' HB2' ' A' ' 128' ' ' ALA . 0.6 OUTLIER -82.14 -18.55 42.49 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.526 1.141 . . . . 74.040000000000006 110.93 -179.986 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -94.49 -3.08 50.62 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.559 1.162 . . . . 52.439999999999998 109.352 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -104.65 -26.63 12.24 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.501 1.126 . . . . 55.25 110.317 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 4.8 ttm -48.28 141.14 9.09 Favored Pre-proline 0 C--N 1.326 -0.444 0 O-C-N 124.511 1.132 . . . . 72.129999999999995 110.984 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo . . . . . 0 C--N 1.361 1.191 0 O-C-N 124.562 1.822 . . . . 72.430000000000007 111.071 179.996 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.734 HD21 ' ND2' ' A' ' 150' ' ' ASN . 1.6 mm? . . . . . 0 N--CA 1.454 -0.257 0 N-CA-C 109.318 -0.623 . . . . 75.340000000000003 109.318 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.478 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 7.6 t70 -54.96 -19.74 7.43 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.537 1.148 . . . . 75.450000000000003 109.271 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -59.25 -70.32 0.16 Allowed 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.517 1.136 . . . . 73.209999999999994 109.308 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.899 ' HB3' HD11 ' A' ' 84' ' ' LEU . . . -74.66 -17.48 60.68 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.534 1.147 . . . . 50.539999999999999 109.304 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.783 HG21 HD11 ' A' ' 157' ' ' LEU . 86.9 t -93.07 30.8 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.456 1.098 . . . . 74.310000000000002 109.302 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . 0.478 ' CB ' ' O ' ' A' ' 126' ' ' ASP . 23.5 t30 -147.47 133.37 19.1 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.445 1.091 . . . . 72.409999999999997 109.244 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 71.82 55.51 7.27 Favored Glycine 0 CA--C 1.53 1.005 0 O-C-N 124.474 1.109 . . . . 64.120000000000005 111.018 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.46 173.8 12.68 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.444 0.732 . . . . 45.149999999999999 109.992 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.79 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -101.73 -30.76 11.13 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.487 1.117 . . . . 72.439999999999998 109.287 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.79 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 2.5 m-90 -158.86 177.15 11.47 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.953 -1.129 . . . . 75.150000000000006 107.953 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . 0.676 HG22 ' CG1' ' A' ' 82' ' ' VAL . 25.3 p -151.45 124.02 8.43 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.479 1.112 . . . . 54.420000000000002 110.435 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 1.01 ' O ' HD23 ' A' ' 137' ' ' LEU . 1.1 mp -84.09 140.66 15.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 O-C-N 124.533 1.146 . . . . 64.409999999999997 109.304 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 1.01 HD23 ' O ' ' A' ' 136' ' ' ILE . 9.0 mt -131.17 100.66 5.28 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.577 1.173 . . . . 71.019999999999996 109.26 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.99 HD21 ' HB2' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -62.67 107.21 0.91 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.533 1.145 . . . . 74.230000000000004 109.31 179.985 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.53 HD13 ' HA ' ' A' ' 139' ' ' LEU . 0.5 OUTLIER -68.91 108.63 3.56 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.495 1.122 . . . . 73.329999999999998 109.241 -179.977 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . 0.756 HG23 ' OD1' ' A' ' 178' ' ' ASN . 2.8 m -123.87 162.06 24.06 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.431 1.082 . . . . 70.340000000000003 110.395 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -62.37 -37.81 87.13 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.534 1.146 . . . . 72.140000000000001 110.248 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . 0.445 ' ND2' ' N ' ' A' ' 143' ' ' PHE . 2.3 p-10 -89.67 -52.9 4.77 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.519 1.137 . . . . 73.400000000000006 109.279 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.714 ' CD1' ' HB2' ' A' ' 86' ' ' ALA . 49.7 t80 -49.13 -24.5 1.68 Allowed 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.534 1.147 . . . . 74.430000000000007 111.02 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.646 HD13 ' C ' ' A' ' 144' ' ' LEU . 2.2 tm? -58.16 -68.37 0.26 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.514 1.134 . . . . 61.140000000000001 109.26 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.602 ' N ' HD13 ' A' ' 144' ' ' LEU . 0.6 OUTLIER -57.64 -16.67 11.24 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.46 1.1 . . . . 74.349999999999994 110.298 -179.984 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -75.17 -38.12 60.98 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.485 1.115 . . . . 74.120000000000005 109.324 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.541 ' O ' ' CG ' ' A' ' 151' ' ' PHE . 2.3 p -101.14 -7.61 23.0 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.437 1.086 . . . . 72.310000000000002 110.449 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.425 ' HA ' ' CE3' ' A' ' 148' ' ' TRP . 1.0 OUTLIER -94.68 -25.14 16.85 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.959 -1.126 . . . . 74.150000000000006 107.959 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 42.7 t -88.57 -45.46 9.87 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.502 1.126 . . . . 62.420000000000002 108.253 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' ASN . . . . . 0.734 ' ND2' HD21 ' A' ' 125' ' ' LEU . 0.1 OUTLIER -61.83 -54.2 45.46 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.441 1.088 . . . . 62.109999999999999 109.316 -179.954 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.541 ' CG ' ' O ' ' A' ' 147' ' ' THR . 4.9 m-30 -53.41 -52.88 57.95 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.507 1.129 . . . . 64.5 110.95 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -39.39 -48.69 1.95 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.518 1.137 . . . . 62.219999999999999 110.334 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -81.33 -28.23 34.62 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.372 1.045 . . . . 70.030000000000001 111.03 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.431 ' N ' ' O ' ' A' ' 151' ' ' PHE . 4.5 m-85 -113.6 86.57 2.42 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 124.464 1.103 . . . . 73.340000000000003 111.035 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . 0.413 ' O ' ' N ' ' A' ' 158' ' ' MET . 1.1 t -61.25 -14.14 23.85 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.481 1.113 . . . . 72.049999999999997 110.36 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 12.5 t -46.64 -34.56 5.15 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.464 1.103 . . . . 72.040000000000006 109.993 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.783 HD11 HG21 ' A' ' 129' ' ' VAL . 0.4 OUTLIER -88.44 -29.32 20.27 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.403 1.064 . . . . 72.329999999999998 109.267 -179.992 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 158' ' ' MET . . . . . 0.456 ' CE ' ' HA ' ' A' ' 158' ' ' MET . 23.1 mmt -62.07 -24.25 66.99 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.491 1.12 . . . . 75.319999999999993 110.984 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' ASN . . . . . 0.45 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 24.8 p30 -92.92 -19.37 21.71 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.466 1.104 . . . . 64.230000000000004 109.289 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 160' ' ' SER . . . . . 0.601 ' HB2' HG21 ' A' ' 170' ' ' VAL . 1.4 m -81.29 -34.31 32.07 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.522 1.139 . . . . 72.310000000000002 110.017 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . 0.585 ' O ' HD11 ' A' ' 192' ' ' ILE . 7.6 m -60.65 -17.98 16.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.584 1.177 . . . . 75.340000000000003 109.346 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 162' ' ' ASN . . . . . 0.429 ' CB ' ' HG3' ' A' ' 164' ' ' GLN . 49.3 m-20 -66.94 -10.37 48.39 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.53 1.144 . . . . 75.430000000000007 109.299 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.477 ' CD ' HG12 ' A' ' 192' ' ' ILE . 21.6 mtp180 65.06 18.67 11.58 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.442 1.089 . . . . 75.150000000000006 110.285 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 159' ' ' ASN . 28.4 mt-30 -45.94 171.82 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.511 1.132 . . . . 74.439999999999998 110.291 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 15.7 p80 -86.14 59.24 5.52 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.467 1.104 . . . . 72.299999999999997 109.579 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.551 ' HG3' ' CD1' ' A' ' 167' ' ' TYR . 0.8 OUTLIER -107.96 144.06 35.77 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.493 1.121 . . . . 71.439999999999998 109.284 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 167' ' ' TYR . . . . . 0.593 ' CE2' ' OD1' ' A' ' 168' ' ' ASN . 16.2 p90 -38.42 -47.59 1.27 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.462 1.101 . . . . 70.319999999999993 110.932 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . 0.593 ' OD1' ' CE2' ' A' ' 167' ' ' TYR . 2.0 p-10 -92.67 132.09 37.2 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.533 1.146 . . . . 74.120000000000005 109.235 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.485 ' HB3' ' CD1' ' A' ' 134' ' ' TRP . 13.9 t -124.04 145.13 49.43 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.45 1.093 . . . . 63.520000000000003 110.003 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.831 ' O ' HD12 ' A' ' 171' ' ' ILE . 4.8 t -106.21 123.72 61.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.518 1.136 . . . . 64.340000000000003 109.292 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.831 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.6 mp -131.37 109.61 14.95 Favored Pre-proline 0 C--N 1.325 -0.474 0 O-C-N 124.452 1.095 . . . . 63.539999999999999 109.309 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . 0.645 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.99 110.68 3.16 Favored 'Trans proline' 0 C--N 1.36 1.16 0 O-C-N 124.49 1.784 . . . . 63.329999999999998 111.035 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . 0.683 ' CE ' HD12 ' A' ' 195' ' ' LEU . 4.0 ttt -94.83 156.66 16.27 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.455 1.097 . . . . 54.450000000000003 110.973 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . 0.441 ' N ' ' HG2' ' A' ' 173' ' ' MET . 17.0 mmt85 -111.9 118.85 45.72 Favored Pre-proline 0 C--N 1.325 -0.458 0 O-C-N 124.528 1.142 . . . . 71.540000000000006 110.256 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 175' ' ' PRO . . . . . 0.478 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.3 Cg_endo -74.95 152.03 40.5 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.502 1.791 . . . . 73.319999999999993 110.997 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . 0.609 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.1 OUTLIER -85.26 -44.13 13.14 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.536 1.147 . . . . 71.150000000000006 109.353 179.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . 0.484 ' ND2' ' CG ' ' A' ' 92' ' ' GLU . 4.9 p30 -71.14 -28.05 64.0 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.524 1.14 . . . . 54.329999999999998 109.259 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 178' ' ' ASN . . . . . 0.756 ' OD1' HG23 ' A' ' 140' ' ' THR . 1.4 m-80 -110.79 98.58 38.51 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.48 1.113 . . . . 60.140000000000001 109.27 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.97 116.36 4.57 Favored 'Trans proline' 0 C--N 1.36 1.133 0 O-C-N 124.556 1.819 . . . . 74.209999999999994 111.012 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.544 HD13 ' HB2' ' A' ' 184' ' ' ARG . 0.5 OUTLIER -127.57 96.45 32.92 Favored Pre-proline 0 C--N 1.325 -0.48 0 O-C-N 124.5 1.125 . . . . 72.109999999999999 109.312 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.97 171.67 17.87 Favored 'Trans proline' 0 C--N 1.36 1.162 0 O-C-N 124.509 1.794 . . . . 73.109999999999999 111.031 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 -60.04 -23.69 63.94 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.48 1.113 . . . . 71.230000000000004 110.346 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -68.85 -15.49 63.51 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.443 1.089 . . . . 72.439999999999998 110.31 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 184' ' ' ARG . . . . . 0.544 ' HB2' HD13 ' A' ' 180' ' ' LEU . 35.0 mmt180 -111.1 -28.45 8.29 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.462 1.101 . . . . 72.209999999999994 110.36 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 185' ' ' THR . . . . . 0.497 HG23 ' HD2' ' A' ' 186' ' ' PRO . 54.1 m -72.86 143.72 84.68 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.407 1.067 . . . . 74.010000000000005 110.413 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 186' ' ' PRO . . . . . 0.563 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -75.01 148.39 35.18 Favored 'Trans proline' 0 C--N 1.36 1.17 0 O-C-N 124.503 1.791 . . . . 72.040000000000006 110.977 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 187' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -60.85 -12.4 10.83 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.453 1.096 . . . . 74.299999999999997 111.05 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . 0.701 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -88.56 -53.93 4.41 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.474 1.109 . . . . 53.450000000000003 109.391 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.563 HD12 ' CG ' ' A' ' 186' ' ' PRO . 37.1 mt -74.4 -14.91 60.92 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.51 1.131 . . . . 64.430000000000007 109.321 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -85.66 -11.4 53.91 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.56 1.163 . . . . 75.329999999999998 110.31 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 191' ' ' THR . . . . . . . . . . . . . 21.9 p -113.87 1.47 14.77 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.556 1.16 . . . . 64.109999999999999 110.385 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.701 HD12 ' O ' ' A' ' 188' ' ' ALA . 3.1 mt -99.37 163.74 2.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.465 1.103 . . . . 73.319999999999993 109.299 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 193' ' ' ASN . . . . . 0.49 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 13.5 t-20 -66.65 73.41 0.09 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.539 1.149 . . . . 61.25 109.306 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . 0.645 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -66.69 143.66 56.83 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.592 1.182 . . . . 63.409999999999997 109.293 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 195' ' ' LEU . . . . . 0.683 HD12 ' CE ' ' A' ' 173' ' ' MET . 0.2 OUTLIER -84.66 129.98 34.77 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.529 1.143 . . . . 71.420000000000002 109.266 179.995 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -104.88 117.4 33.95 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.531 1.145 . . . . 71.200000000000003 110.336 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.482 ' HG2' ' CD2' ' A' ' 176' ' ' LEU . 1.3 tt0 -101.82 -33.23 9.89 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.533 1.146 . . . . 72.340000000000003 110.285 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . 0.469 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -90.0 23.04 2.93 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.527 1.142 . . . . 63.539999999999999 110.303 -179.979 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -128.57 147.34 50.7 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.492 1.12 . . . . 73.219999999999999 110.009 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.81 -19.5 65.88 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.459 1.099 . . . . 63.039999999999999 110.264 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -89.13 21.27 28.71 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 124.448 1.093 . . . . 64.5 110.988 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 202' ' ' PHE . . . . . 0.826 ' O ' HG23 ' A' ' 206' ' ' VAL . 5.6 t80 -65.21 -39.32 34.75 Favored Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.509 0.77 . . . . 75.439999999999998 110.977 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 203' ' ' PRO . . . . . 0.686 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.05 -38.71 1.45 Allowed 'Trans proline' 0 C--N 1.359 1.116 0 O-C-N 124.505 1.792 . . . . 72.530000000000001 110.956 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -50.9 -59.9 3.65 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.483 1.114 . . . . 75.200000000000003 110.387 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -59.02 -47.55 84.8 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.484 1.115 . . . . 73.129999999999995 110.313 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 206' ' ' VAL . . . . . 0.873 HG11 HD22 ' A' ' 100' ' ' LEU . 82.6 t -57.27 -29.69 33.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.463 1.102 . . . . 71.409999999999997 109.257 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.08 -35.75 49.02 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.521 1.138 . . . . 74.420000000000002 110.365 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 64.8 mtt-85 -81.26 -68.23 0.71 Allowed 'General case' 0 C--N 1.327 -0.412 0 O-C-N 124.459 1.1 . . . . 50.200000000000003 110.299 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 209' ' ' ILE . . . . . 0.827 HG22 ' CE1' ' A' ' 210' ' ' PHE . 73.3 mt -41.47 -43.32 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.527 1.142 . . . . 64.439999999999998 109.313 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 210' ' ' PHE . . . . . 0.827 ' CE1' HG22 ' A' ' 209' ' ' ILE . 1.5 m-85 -112.02 66.89 0.64 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.538 1.148 . . . . 71.329999999999998 110.962 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -110.65 147.39 34.39 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.537 1.148 . . . . 75.219999999999999 110.286 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . 0.449 ' O ' ' N ' ' A' ' 215' ' ' TYR . 27.9 tt0 -49.14 -55.52 12.07 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.537 1.148 . . . . 72.420000000000002 110.274 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -48.38 -23.93 1.08 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.437 1.086 . . . . 61.409999999999997 109.976 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 13.4 t -95.9 -29.31 3.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.449 1.093 . . . . 63.119999999999997 109.28 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 215' ' ' TYR . . . . . 0.449 ' N ' ' O ' ' A' ' 212' ' ' GLU . 17.2 t80 -63.78 -33.89 76.67 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.619 1.199 . . . . 74.129999999999995 111.059 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 51.3 mmtt -57.33 -66.32 0.48 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.548 1.155 . . . . 72.430000000000007 109.253 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 217' ' ' THR . . . . . 1.084 HG22 HD11 ' A' ' 221' ' ' ILE . 17.3 m -45.3 -66.56 0.38 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.497 1.123 . . . . 63.009999999999998 110.378 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 218' ' ' GLN . . . . . 0.638 ' HA ' HD12 ' A' ' 221' ' ' ILE . 2.1 mp0 -42.01 -45.7 3.94 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.473 1.108 . . . . 74.329999999999998 110.32 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 219' ' ' GLN . . . . . 0.444 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 18.9 tp60 -62.85 -39.41 94.31 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.504 1.127 . . . . 75.420000000000002 110.315 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 220' ' ' THR . . . . . 0.46 ' O ' ' CG ' ' A' ' 224' ' ' GLU . 1.0 OUTLIER -77.66 -17.71 57.44 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.57 1.169 . . . . 71.129999999999995 110.418 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 221' ' ' ILE . . . . . 1.084 HD11 HG22 ' A' ' 217' ' ' THR . 35.2 mt -83.64 -40.28 15.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.477 1.111 . . . . 61.340000000000003 109.301 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 222' ' ' TRP . . . . . . . . . . . . . 27.7 t90 -64.11 -54.98 25.35 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.546 1.153 . . . . 75.120000000000005 108.042 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -20.23 52.64 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.485 1.116 . . . . 71.540000000000006 109.318 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . 0.46 ' CG ' ' O ' ' A' ' 220' ' ' THR . 79.6 mt-10 . . . . . 0 C--N 1.325 -0.474 0 O-C-N 124.543 1.152 . . . . 74.310000000000002 110.302 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.516 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 6.4 p . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.312 -0.625 . . . . 71.329999999999998 109.312 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.413 ' O ' ' C ' ' A' ' 79' ' ' LEU . 26.8 m-85 -87.95 23.5 2.04 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.531 1.144 . . . . 74.25 111.034 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.667 HD11 HG22 ' A' ' 110' ' ' ILE . 12.5 tp -39.63 155.26 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.52 1.137 . . . . 70.510000000000005 109.278 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.756 ' NZ ' ' H ' ' A' ' 107' ' ' LYS . 27.4 ttpt -100.49 -60.61 1.49 Allowed 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.497 1.123 . . . . 64.109999999999999 109.312 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 1.228 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.2 OUTLIER -156.99 132.83 9.48 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.487 1.117 . . . . 65.319999999999993 111.038 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.886 ' CG1' HG22 ' A' ' 135' ' ' THR . 7.2 p -96.8 168.47 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.528 1.142 . . . . 55.229999999999997 109.368 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 1.228 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 4.2 mp -130.67 101.32 5.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.529 1.143 . . . . 64.140000000000001 109.326 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.115 HD11 ' HB1' ' A' ' 128' ' ' ALA . 3.7 mp -75.73 124.28 27.01 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.504 1.127 . . . . 75.25 109.317 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.824 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -146.27 174.4 11.37 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.455 1.097 . . . . 72.299999999999997 109.614 -179.99 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.44 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -115.82 164.3 14.59 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.508 1.13 . . . . 71.430000000000007 109.338 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -57.45 -17.28 12.41 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.532 1.145 . . . . 71.530000000000001 110.255 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -78.56 -45.56 21.51 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.536 1.148 . . . . 74.409999999999997 109.31 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.877 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.9 OUTLIER -121.63 44.14 2.64 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.452 1.095 . . . . 73.420000000000002 109.269 -179.973 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.596 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -77.63 -48.24 17.32 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.493 1.12 . . . . 73.420000000000002 110.371 -179.958 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -67.84 -19.45 65.05 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.471 1.107 . . . . 62.310000000000002 109.332 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.03 -56.93 5.67 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.458 1.099 . . . . 72.430000000000007 110.298 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 1.038 ' HB1' ' CG2' ' A' ' 83' ' ' ILE . . . -68.4 -22.77 64.61 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.527 1.142 . . . . 61.229999999999997 109.268 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.672 HD23 ' O ' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -82.68 -34.06 27.51 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.552 1.157 . . . . 71.439999999999998 109.378 179.927 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -67.3 -34.56 77.63 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.466 1.104 . . . . 73.239999999999995 110.274 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.578 HG13 ' N ' ' A' ' 97' ' ' GLN . 8.5 p -81.44 -55.29 8.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.554 1.159 . . . . 75.430000000000007 109.267 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.578 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -49.5 -20.95 0.82 Allowed 'General case' 0 C--N 1.326 -0.419 0 O-C-N 124.476 1.11 . . . . 74.140000000000001 110.35 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.493 ' O ' ' CG ' ' A' ' 101' ' ' GLN . 0.8 OUTLIER -78.94 -36.08 42.24 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.481 1.113 . . . . 70.340000000000003 109.287 -179.93 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.735 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -85.82 -20.0 29.82 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.52 1.137 . . . . 74.450000000000003 109.326 179.965 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.833 HD22 HG11 ' A' ' 206' ' ' VAL . 56.7 mt -78.98 -21.99 46.26 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.509 1.131 . . . . 70.219999999999999 109.323 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . 0.621 ' HB2' ' CG ' ' A' ' 107' ' ' LYS . 0.2 OUTLIER -82.58 -15.15 53.3 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.497 1.123 . . . . 75.319999999999993 110.302 -179.99 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . 0.494 ' O ' ' C ' ' A' ' 103' ' ' ASP . 13.3 t70 -116.09 -58.01 2.15 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.548 1.155 . . . . 60.219999999999999 109.284 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.551 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 28.1 t0 -32.31 -66.81 0.12 Allowed 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.478 1.111 . . . . 63.409999999999997 109.265 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.509 ' HE1' HD23 ' A' ' 100' ' ' LEU . 5.2 m-85 -102.12 -29.66 11.61 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.448 1.093 . . . . 65.010000000000005 110.98 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 107' ' ' LYS . . . 109.59 16.67 10.64 Favored Glycine 0 CA--C 1.531 1.054 0 O-C-N 124.526 1.141 . . . . 4.1200000000000001 110.982 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.667 ' HA ' ' HZ1' ' A' ' 80' ' ' LYS . 36.8 mm -54.45 85.78 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.488 0.757 . . . . 62.340000000000003 109.259 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.756 ' H ' ' NZ ' ' A' ' 80' ' ' LYS . 4.5 mtmp? -138.57 154.91 73.72 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.48 1.113 . . . . 71.099999999999994 109.292 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.5 Cg_endo -74.99 128.87 17.23 Favored 'Cis proline' 0 C--N 1.36 1.155 0 C-N-CA 121.041 -2.483 . . . . 73.030000000000001 111.034 -0.053 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . 0.507 ' N ' ' HA ' ' A' ' 107' ' ' LYS . . . -105.93 122.91 7.29 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.597 1.186 . . . . 44.329999999999998 111.023 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.667 HG22 HD11 ' A' ' 79' ' ' LEU . 8.0 tt -144.74 157.38 14.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 O-C-N 124.469 0.746 . . . . 75.030000000000001 109.282 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . 0.824 HD12 ' NE2' ' A' ' 85' ' ' HIS . 28.7 pt -93.66 -178.54 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.533 1.145 . . . . 72.109999999999999 109.373 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 1.228 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 0.9 OUTLIER -82.03 -22.76 36.28 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.458 1.099 . . . . 71.400000000000006 110.993 179.988 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -88.07 -3.36 58.9 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.499 1.124 . . . . 54.43 109.311 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.408 ' C ' HD11 ' A' ' 110' ' ' ILE . 19.8 mm-40 -107.45 -26.03 11.14 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.53 1.144 . . . . 73.140000000000001 110.335 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 3.8 ttm -45.64 138.54 5.22 Favored Pre-proline 0 C--N 1.325 -0.457 0 O-C-N 124.496 1.123 . . . . 64.239999999999995 111.046 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo . . . . . 0 C--N 1.359 1.116 0 O-C-N 124.515 1.797 . . . . 74.109999999999999 111.046 -179.981 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.581 ' O ' HG23 ' A' ' 129' ' ' VAL . 1.0 OUTLIER . . . . . 0 N--CA 1.454 -0.271 0 N-CA-C 109.298 -0.631 . . . . 74.329999999999998 109.298 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -42.67 -61.47 1.23 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.515 1.135 . . . . 72.219999999999999 109.32 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.443 ' O ' ' N ' ' A' ' 130' ' ' ASN . 6.5 m-20 -45.89 -63.23 1.02 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.5 1.125 . . . . 55.340000000000003 109.246 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 1.228 ' HB2' ' CE1' ' A' ' 112' ' ' PHE . . . -50.86 -26.79 6.24 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.498 1.124 . . . . 62.219999999999999 109.299 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.706 HG12 ' O ' ' A' ' 129' ' ' VAL . 99.1 t -94.08 30.87 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.525 1.141 . . . . 65.010000000000005 109.253 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . 0.443 ' N ' ' O ' ' A' ' 127' ' ' ASP . 11.2 t-20 -152.55 145.28 24.3 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.547 1.154 . . . . 51.229999999999997 109.306 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 64.99 38.51 95.56 Favored Glycine 0 CA--C 1.53 0.997 0 O-C-N 124.423 1.077 . . . . 64.5 111.05 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 50.7 m -151.36 178.79 8.92 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.549 0.793 . . . . 74.340000000000003 110.02 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 80' ' ' LYS . . . -112.45 -42.09 3.74 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.573 1.171 . . . . 60.25 109.291 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.57 ' CZ2' ' HA ' ' A' ' 210' ' ' PHE . 14.6 m-90 -141.14 160.76 39.4 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.543 1.152 . . . . 65.219999999999999 107.933 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . 0.886 HG22 ' CG1' ' A' ' 82' ' ' VAL . 1.7 p -145.28 125.54 13.84 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.456 1.098 . . . . 74.239999999999995 110.317 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.565 HD13 ' HE2' ' A' ' 81' ' ' PHE . 0.8 OUTLIER -84.42 134.89 25.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.488 1.117 . . . . 61.130000000000003 109.28 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.478 HD22 ' O ' ' A' ' 136' ' ' ILE . 2.2 mm? -117.92 96.81 5.52 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.502 1.127 . . . . 72.109999999999999 109.334 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.877 HD23 ' HB2' ' A' ' 89' ' ' ASP . 0.2 OUTLIER -62.64 104.84 0.57 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.498 1.124 . . . . 74.129999999999995 109.274 179.999 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.417 HD21 HD13 ' A' ' 189' ' ' LEU . 18.9 mt -78.22 111.56 14.29 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.54 1.15 . . . . 72.299999999999997 109.33 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . 0.484 ' O ' ' CB ' ' A' ' 144' ' ' LEU . 9.6 m -139.67 159.46 42.11 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.505 1.128 . . . . 73.040000000000006 110.444 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -56.08 -36.51 68.19 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.47 1.106 . . . . 64.129999999999995 110.264 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -88.4 -52.04 5.41 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.501 1.126 . . . . 71.549999999999997 109.294 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.6 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 10.9 t80 -57.46 -19.8 26.42 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.521 1.138 . . . . 75.140000000000001 110.983 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.619 HD12 ' NH1' ' A' ' 145' ' ' ARG . 3.0 tm? -84.93 -52.64 5.86 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.582 1.176 . . . . 71.209999999999994 109.333 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.619 ' NH1' HD12 ' A' ' 144' ' ' LEU . 0.0 OUTLIER -55.85 -27.09 49.96 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.436 1.085 . . . . 63.229999999999997 110.32 179.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -79.13 -63.0 1.52 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.494 1.121 . . . . 73.230000000000004 109.279 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.565 HG21 ' CE1' ' A' ' 143' ' ' PHE . 25.5 p -56.9 -61.59 2.34 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.531 1.144 . . . . 72.219999999999999 110.33 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.471 ' HB2' HD22 ' A' ' 144' ' ' LEU . 1.4 t-105 -44.52 -41.95 6.82 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.009 -1.108 . . . . 70.349999999999994 108.009 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' CYS . . . . . 0.423 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 7.1 t -63.48 -45.55 90.23 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.484 1.115 . . . . 73.450000000000003 108.278 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' A' ' 147' ' ' THR . 0.8 OUTLIER -57.32 -61.68 2.31 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.539 1.149 . . . . 62.439999999999998 109.274 -179.915 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.956 ' CE1' HD12 ' A' ' 157' ' ' LEU . 8.5 m-30 -39.65 -39.24 0.72 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.524 1.14 . . . . 74.5 110.935 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -56.75 -46.77 81.21 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.511 1.132 . . . . 54.539999999999999 110.278 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.491 ' O ' ' CG ' ' A' ' 153' ' ' PHE . 66.8 t80 -99.9 7.55 44.8 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.459 1.1 . . . . 52.210000000000001 111.015 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.449 ' N ' ' O ' ' A' ' 150' ' ' ASN . 0.3 OUTLIER -145.92 81.63 1.6 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.509 1.13 . . . . 73.329999999999998 111.023 179.953 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 3.9 t -72.1 -5.31 34.45 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.407 1.067 . . . . 51.32 110.409 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . 0.438 ' HB3' ' CE1' ' A' ' 154' ' ' TYR . 1.1 t -67.42 -31.56 71.85 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.53 1.143 . . . . 64.439999999999998 110.022 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.956 HD12 ' CE1' ' A' ' 151' ' ' PHE . 3.4 tm? -79.31 -41.82 27.14 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.539 1.149 . . . . 74.299999999999997 109.333 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 158' ' ' MET . . . . . . . . . . . . . 13.8 tpp -51.63 -21.98 3.02 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.526 1.141 . . . . 75.230000000000004 111.05 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' ASN . . . . . 0.444 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 1.9 m-80 -67.18 -37.39 83.63 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.467 1.105 . . . . 74.030000000000001 109.293 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 160' ' ' SER . . . . . 0.784 ' HB2' HG21 ' A' ' 170' ' ' VAL . 0.8 OUTLIER -77.28 -27.56 53.14 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.523 1.139 . . . . 72.430000000000007 109.986 179.975 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . 0.552 HG13 HH21 ' A' ' 163' ' ' ARG . 3.5 t -62.44 -18.1 19.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.56 1.163 . . . . 62.530000000000001 109.364 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -74.42 -4.39 36.29 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 124.552 1.158 . . . . 62.329999999999998 109.296 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.734 ' HE ' HD13 ' A' ' 192' ' ' ILE . 5.2 mmt180 58.51 30.97 20.48 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.494 1.121 . . . . 72.219999999999999 110.208 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 164' ' ' GLN . . . . . 0.444 ' NE2' ' O ' ' A' ' 159' ' ' ASN . 22.6 mt-30 -52.45 -174.64 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.483 1.114 . . . . 73.340000000000003 110.264 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -110.53 73.13 0.81 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.536 1.147 . . . . 72.400000000000006 109.58 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.409 ' C ' ' N ' ' A' ' 168' ' ' ASN . 0.0 OUTLIER -111.8 163.75 13.83 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.496 1.123 . . . . 72.030000000000001 109.329 -179.993 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 167' ' ' TYR . . . . . 0.574 ' N ' HG21 ' A' ' 221' ' ' ILE . 1.1 p90 -42.62 -25.91 0.1 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.467 1.105 . . . . 74.409999999999997 111.033 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 168' ' ' ASN . . . . . 0.527 ' ND2' HG13 ' A' ' 129' ' ' VAL . 1.5 p-10 -119.3 156.17 30.49 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.54 1.15 . . . . 53.32 109.318 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.493 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 1.2 m -131.54 143.5 50.42 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.577 1.173 . . . . 72.230000000000004 109.97 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 1.0 ' O ' HD12 ' A' ' 171' ' ' ILE . 5.1 t -102.91 131.63 50.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.467 1.104 . . . . 73.239999999999995 109.333 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 1.0 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.2 mp -140.03 111.09 7.25 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.561 1.163 . . . . 72.209999999999994 109.287 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 172' ' ' PRO . . . . . 0.759 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.08 106.74 2.33 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.45 1.763 . . . . 64.310000000000002 110.983 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . 0.539 ' HB3' HG23 ' A' ' 136' ' ' ILE . 3.1 ttt -90.47 151.83 21.21 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.467 1.105 . . . . 64.319999999999993 111.048 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . 0.422 ' N ' ' HG2' ' A' ' 173' ' ' MET . 4.7 tpp85 -110.18 122.04 39.92 Favored Pre-proline 0 C--N 1.324 -0.512 0 O-C-N 124.509 1.131 . . . . 73.040000000000006 110.279 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 175' ' ' PRO . . . . . 0.744 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.3 Cg_endo -75.04 160.91 39.47 Favored 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.477 1.777 . . . . 73.340000000000003 110.992 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 176' ' ' LEU . . . . . 0.975 HD21 ' CG ' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -100.62 -40.55 7.34 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.579 1.175 . . . . 72.430000000000007 109.316 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -73.0 -23.6 60.66 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.466 1.104 . . . . 70.439999999999998 109.275 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 178' ' ' ASN . . . . . 0.447 ' ND2' ' OD2' ' A' ' 89' ' ' ASP . 2.1 m-80 -110.41 106.7 58.13 Favored Pre-proline 0 C--N 1.325 -0.467 0 O-C-N 124.534 1.146 . . . . 74.319999999999993 109.273 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.97 115.12 4.19 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.497 1.788 . . . . 74.409999999999997 111.013 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.49 ' CD1' ' OG1' ' A' ' 185' ' ' THR . 1.1 tm? -126.94 96.97 33.45 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 124.454 1.096 . . . . 75.200000000000003 109.306 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 165.37 31.42 Favored 'Trans proline' 0 C--N 1.36 1.14 0 O-C-N 124.548 1.815 . . . . 61.409999999999997 110.969 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 3.7 ptt180 -55.8 -39.35 71.18 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.474 1.109 . . . . 72.340000000000003 110.308 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -55.72 -18.22 7.68 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.481 1.113 . . . . 75.150000000000006 110.277 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 184' ' ' ARG . . . . . 0.401 ' HB3' HD21 ' A' ' 180' ' ' LEU . 14.2 mmt180 -104.14 -18.06 14.66 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.488 1.118 . . . . 61.310000000000002 110.218 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 185' ' ' THR . . . . . 0.522 HG23 ' HD2' ' A' ' 186' ' ' PRO . 42.1 m -91.38 143.99 29.04 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.426 1.079 . . . . 75.510000000000005 110.381 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 186' ' ' PRO . . . . . 0.578 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -75.06 149.0 35.81 Favored 'Trans proline' 0 C--N 1.362 1.239 0 O-C-N 124.453 1.765 . . . . 61.549999999999997 110.993 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 187' ' ' PHE . . . . . 0.415 ' O ' HG23 ' A' ' 191' ' ' THR . 4.8 t80 -62.82 -11.51 18.48 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.492 1.12 . . . . 61.520000000000003 110.994 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . 0.434 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -88.57 -53.98 4.39 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.5 1.125 . . . . 72.109999999999999 109.36 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.578 HD12 ' CG ' ' A' ' 186' ' ' PRO . 40.4 mt -73.04 -18.17 61.36 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.538 1.149 . . . . 73.049999999999997 109.299 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 190' ' ' GLN . . . . . 0.473 ' CG ' ' O ' ' A' ' 190' ' ' GLN . 6.9 tt0 -86.0 -1.07 56.99 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.504 1.127 . . . . 62.119999999999997 110.289 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 191' ' ' THR . . . . . 0.415 HG23 ' O ' ' A' ' 187' ' ' PHE . 41.2 p -128.12 22.66 6.13 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.492 1.12 . . . . 72.439999999999998 110.411 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.734 HD13 ' HE ' ' A' ' 163' ' ' ARG . 4.2 mt -124.58 157.63 32.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.483 1.115 . . . . 63.32 109.296 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -61.79 82.8 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.513 1.133 . . . . 60.119999999999997 109.288 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 194' ' ' ALA . . . . . 0.759 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -82.5 152.05 26.22 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.59 1.181 . . . . 71.540000000000006 109.29 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 195' ' ' LEU . . . . . 0.51 HD23 ' CD1' ' A' ' 209' ' ' ILE . 0.2 OUTLIER -83.86 137.66 33.57 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.475 1.109 . . . . 65.010000000000005 109.3 179.979 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -121.47 123.2 41.48 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.514 1.134 . . . . 72.549999999999997 110.274 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.975 ' CG ' HD21 ' A' ' 176' ' ' LEU . 9.5 tp10 -97.27 -29.61 13.45 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.476 1.11 . . . . 71.409999999999997 110.33 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 198' ' ' GLU . . . . . 0.516 ' HG2' HD12 ' A' ' 176' ' ' LEU . 4.4 pt-20 -95.19 23.08 6.04 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.436 1.085 . . . . 73.219999999999999 110.305 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 2.0 t -122.91 134.37 54.36 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.581 1.176 . . . . 75.519999999999996 110.017 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 20.4 ttt180 -54.88 -18.56 5.06 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.497 1.123 . . . . 74.230000000000004 110.355 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -91.42 18.77 50.92 Favored Glycine 0 CA--C 1.529 0.964 0 O-C-N 124.504 1.128 . . . . 71.040000000000006 111.01 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 202' ' ' PHE . . . . . 0.803 ' O ' HG23 ' A' ' 206' ' ' VAL . 7.3 t80 -65.67 -39.43 32.13 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.429 0.723 . . . . 64.209999999999994 110.989 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 203' ' ' PRO . . . . . 0.685 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -74.98 -38.67 1.5 Allowed 'Trans proline' 0 C--N 1.361 1.209 0 O-C-N 124.509 1.794 . . . . 74.120000000000005 111.012 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -51.61 -62.66 1.49 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.511 1.132 . . . . 74.239999999999995 110.415 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 205' ' ' GLN . . . . . 0.454 ' O ' ' N ' ' A' ' 208' ' ' ARG . 7.2 mt-30 -55.63 -58.02 9.54 Favored 'General case' 0 C--N 1.323 -0.549 0 O-C-N 124.476 1.11 . . . . 54.5 110.298 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 206' ' ' VAL . . . . . 0.833 HG11 HD22 ' A' ' 100' ' ' LEU . 72.2 t -42.69 -31.2 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.44 1.088 . . . . 71.049999999999997 109.318 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -83.03 -41.32 18.8 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.491 1.119 . . . . 71.219999999999999 110.323 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 208' ' ' ARG . . . . . 0.454 ' N ' ' O ' ' A' ' 205' ' ' GLN . 51.1 mtt180 -71.43 -63.23 1.16 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.45 1.094 . . . . 73.109999999999999 110.269 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 209' ' ' ILE . . . . . 0.631 HG22 ' CD1' ' A' ' 210' ' ' PHE . 39.6 mt -48.33 -50.14 12.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.456 1.098 . . . . 75.049999999999997 109.287 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 210' ' ' PHE . . . . . 0.631 ' CD1' HG22 ' A' ' 209' ' ' ILE . 0.5 OUTLIER -102.77 65.06 0.89 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.515 1.134 . . . . 75.120000000000005 111.004 -179.977 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 211' ' ' GLN . . . . . 0.552 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.5 OUTLIER -110.9 144.8 39.39 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 124.519 1.137 . . . . 61.329999999999998 110.286 -179.982 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 212' ' ' GLU . . . . . 0.448 ' O ' ' N ' ' A' ' 215' ' ' TYR . 21.6 tt0 -48.84 -54.98 12.98 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.542 1.151 . . . . 74.450000000000003 110.286 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 3.4 t -48.34 -25.12 1.44 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.522 1.139 . . . . 72.239999999999995 109.983 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.552 HG23 ' HG2' ' A' ' 211' ' ' GLN . 43.2 t -96.28 -27.07 4.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.52 1.137 . . . . 72.040000000000006 109.298 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 215' ' ' TYR . . . . . 0.448 ' N ' ' O ' ' A' ' 212' ' ' GLU . 13.5 t80 -67.42 -36.62 81.61 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.484 1.115 . . . . 72.5 110.94 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 14.9 mmtt -52.03 -50.71 60.9 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.498 1.124 . . . . 62.200000000000003 109.321 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 217' ' ' THR . . . . . 0.738 HG22 HD11 ' A' ' 221' ' ' ILE . 18.8 m -58.17 -65.24 0.68 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.484 1.115 . . . . 73.209999999999994 110.407 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 218' ' ' GLN . . . . . 0.513 ' HA ' HD12 ' A' ' 221' ' ' ILE . 0.0 OUTLIER -54.12 -22.17 10.4 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.5 1.125 . . . . 73.120000000000005 110.316 179.975 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 219' ' ' GLN . . . . . 0.42 ' N ' ' O ' ' A' ' 215' ' ' TYR . 47.6 tp60 -84.35 -30.17 25.68 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.482 1.114 . . . . 72.239999999999995 110.236 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 220' ' ' THR . . . . . 0.491 ' O ' ' CG ' ' A' ' 224' ' ' GLU . 1.0 OUTLIER -86.64 -22.64 26.05 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.536 1.147 . . . . 73.450000000000003 110.379 -179.981 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 221' ' ' ILE . . . . . 0.738 HD11 HG22 ' A' ' 217' ' ' THR . 42.6 mt -74.22 -53.97 15.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 O-C-N 124.424 1.077 . . . . 74.340000000000003 109.303 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 222' ' ' TRP . . . . . 0.516 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 14.4 t90 -63.26 -52.03 63.73 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.937 -1.134 . . . . 73.329999999999998 107.937 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 223' ' ' LYS . . . . . 0.42 ' HB2' ' NE2' ' A' ' 219' ' ' GLN . 0.0 OUTLIER -54.98 -20.93 10.23 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.553 1.158 . . . . 74.340000000000003 109.335 -179.982 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 224' ' ' GLU . . . . . 0.491 ' CG ' ' O ' ' A' ' 220' ' ' THR . 8.2 mm-40 . . . . . 0 C--N 1.325 -0.463 0 O-C-N 124.49 1.119 . . . . 73.010000000000005 110.267 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.999 0 N-CA-C 110.993 -0.843 . . . . 35.0 110.993 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.96 -168.19 0.49 Allowed 'Trans proline' 0 C--N 1.359 1.125 0 O-C-N 124.495 1.787 . . . . 73.230000000000004 111.005 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.503 HD13 ' O ' ' A' ' 72' ' ' LEU . 0.5 OUTLIER -105.93 -56.16 2.22 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.527 1.142 . . . . 74.099999999999994 109.331 179.988 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -161.33 58.07 0.3 Allowed Glycine 0 CA--C 1.53 0.984 0 O-C-N 124.512 1.132 . . . . 74.420000000000002 111.026 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.414 ' OG ' ' N ' ' A' ' 75' ' ' GLU . 0.5 OUTLIER -75.37 173.34 11.04 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.47 0.747 . . . . 65.010000000000005 110.02 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.414 ' N ' ' OG ' ' A' ' 74' ' ' SER . 27.7 tt0 -42.43 121.35 1.91 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.516 1.135 . . . . 74.129999999999995 110.354 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -116.48 134.07 55.29 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.471 1.107 . . . . 73.140000000000001 110.265 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.3 p -138.68 150.18 23.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.551 1.157 . . . . 72.409999999999997 109.239 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.41 ' CD2' ' O ' ' A' ' 78' ' ' PHE . 52.1 p90 -89.23 34.63 0.8 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.547 1.154 . . . . 72.239999999999995 110.981 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.849 HD23 ' N ' ' A' ' 80' ' ' LYS . 4.4 tt -39.99 150.9 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.54 1.15 . . . . 74.329999999999998 109.322 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.849 ' N ' HD23 ' A' ' 79' ' ' LEU . 5.0 mtpt -72.2 -60.68 2.11 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.544 1.153 . . . . 74.310000000000002 109.257 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.66 ' CE1' HD11 ' A' ' 83' ' ' ILE . 0.1 OUTLIER -167.22 152.15 7.23 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.491 1.12 . . . . 73.230000000000004 111.011 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.711 HG11 ' HA ' ' A' ' 128' ' ' ALA . 4.5 p -100.86 163.39 3.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.487 1.117 . . . . 64.140000000000001 109.307 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.791 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.3 mp -125.63 98.6 5.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.515 1.134 . . . . 71.019999999999996 109.316 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 84' ' ' LEU . 4.8 mt -73.11 115.59 12.61 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.52 1.137 . . . . 74.230000000000004 109.304 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.724 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -138.87 174.48 10.48 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.535 1.147 . . . . 70.140000000000001 109.596 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.649 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -109.52 164.04 12.88 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.461 1.101 . . . . 60.450000000000003 109.248 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 87' ' ' GLU . 15.9 tt0 -67.53 -9.57 43.7 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.555 1.159 . . . . 74.109999999999999 110.343 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -84.02 -44.96 13.61 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.431 1.082 . . . . 65.299999999999997 109.254 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -120.85 43.67 2.71 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.473 1.108 . . . . 71.349999999999994 109.299 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.609 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -77.08 -22.6 52.58 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.478 1.111 . . . . 70.200000000000003 110.383 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -82.06 -28.08 32.61 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.568 1.168 . . . . 73.129999999999995 109.357 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -71.14 -56.32 6.34 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.494 1.121 . . . . 72.239999999999995 110.303 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.981 ' HB2' HD22 ' A' ' 138' ' ' LEU . . . -56.04 -33.83 65.33 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.499 1.124 . . . . 73.340000000000003 109.306 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.919 ' HB2' HD13 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -74.05 -45.63 48.32 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.491 1.12 . . . . 72.409999999999997 109.364 179.945 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.747 ' N ' HD13 ' A' ' 94' ' ' LEU . 10.3 tpt180 -48.29 -29.76 4.17 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.52 1.137 . . . . 74.099999999999994 110.308 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.814 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.2 t -81.87 -65.41 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.477 1.111 . . . . 60.399999999999999 109.339 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.476 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -40.11 -27.23 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.547 1.154 . . . . 64.25 110.379 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.452 ' N ' ' O ' ' A' ' 96' ' ' VAL . 1.3 t-20 -71.35 -53.06 15.45 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.483 1.114 . . . . 75.230000000000004 109.362 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.836 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -70.72 -21.73 62.51 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.539 1.149 . . . . 74.140000000000001 109.279 179.947 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.836 ' N ' HD23 ' A' ' 99' ' ' LEU . 22.8 mt -63.72 -51.32 65.51 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.483 1.114 . . . . 74.510000000000005 109.261 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -81.24 51.74 1.67 Allowed 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.494 1.122 . . . . 64.0 110.254 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -171.06 -66.28 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.492 1.12 . . . . 73.129999999999995 109.314 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -47.93 -47.88 32.16 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.417 1.073 . . . . 71.319999999999993 109.249 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 1.032 ' CE2' HG11 ' A' ' 206' ' ' VAL . 1.1 m-85 -115.94 -30.17 6.13 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.445 1.09 . . . . 62.539999999999999 110.982 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.67 45.18 2.75 Favored Glycine 0 CA--C 1.53 1.024 0 O-C-N 124.442 1.089 . . . . 72.25 111.029 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 9.8 mm -85.47 78.69 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.578 0.81 . . . . 70.340000000000003 109.311 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.531 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -124.16 156.02 67.03 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.519 1.137 . . . . 75.409999999999997 109.259 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.531 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.98 156.64 99.9 Favored 'Cis proline' 0 C--N 1.36 1.167 0 C-N-CA 120.945 -2.523 . . . . 74.209999999999994 111.023 -0.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -133.27 124.21 3.65 Favored Glycine 0 CA--C 1.531 1.047 0 O-C-N 124.452 1.095 . . . . 74.010000000000005 110.992 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.706 HG22 HD11 ' A' ' 79' ' ' LEU . 1.7 tt -142.32 149.57 19.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.492 0.76 . . . . 74.340000000000003 109.314 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.919 HD13 ' HB2' ' A' ' 94' ' ' LEU . 33.6 pt -99.61 163.49 2.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.472 1.107 . . . . 63.530000000000001 109.299 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -63.31 -19.09 64.29 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.508 1.13 . . . . 64.109999999999999 110.981 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -89.53 -8.13 53.44 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.519 1.137 . . . . 74.200000000000003 109.284 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -107.04 -20.09 13.42 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.571 1.169 . . . . 72.129999999999995 110.256 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.417 ' HE1' ' CG2' ' A' ' 82' ' ' VAL . 20.9 ttm -60.21 110.83 3.18 Favored Pre-proline 0 C--N 1.325 -0.5 0 O-C-N 124.441 1.088 . . . . 74.239999999999995 110.973 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 174.04 13.47 Favored 'Trans proline' 0 C--N 1.36 1.167 0 O-C-N 124.471 1.774 . . . . 42.399999999999999 111.03 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 10.1 p80 -174.65 168.84 3.69 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.514 1.134 . . . . 72.120000000000005 109.55 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -123.11 -94.92 1.18 Allowed Glycine 0 CA--C 1.529 0.923 0 O-C-N 124.478 1.111 . . . . 63.210000000000001 111.035 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 33.6 mtm180 -82.44 -26.65 32.51 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.439 0.729 . . . . 72.239999999999995 110.331 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -75.39 153.82 37.51 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.553 1.158 . . . . 71.329999999999998 110.341 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 6.6 m170 -83.67 173.14 11.61 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.508 1.13 . . . . 74.0 109.651 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.792 ' C ' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -108.71 -18.15 13.78 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.455 1.097 . . . . 74.219999999999999 109.337 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.431 ' N ' HD13 ' A' ' 122' ' ' LEU . 14.5 mt-30 -76.65 61.32 1.8 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.546 1.153 . . . . 63.32 110.214 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -129.46 86.01 2.37 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.551 1.157 . . . . 73.129999999999995 109.328 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.695 HD13 ' HG ' ' A' ' 157' ' ' LEU . 4.2 pp -58.02 -17.84 20.23 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.478 1.111 . . . . 61.43 109.268 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.403 ' O ' ' N ' ' A' ' 129' ' ' VAL . 6.1 p-10 -74.5 -41.2 61.1 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.521 1.138 . . . . 72.549999999999997 109.267 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -47.05 -48.41 22.36 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.439 1.087 . . . . 71.200000000000003 109.265 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.711 ' HA ' HG11 ' A' ' 82' ' ' VAL . . . -59.56 -34.48 72.74 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.484 1.115 . . . . 74.010000000000005 109.332 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.732 HG12 ' O ' ' A' ' 129' ' ' VAL . 68.8 t -92.84 30.8 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 O-C-N 124.507 1.129 . . . . 72.430000000000007 109.279 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -133.0 139.27 47.16 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.473 1.108 . . . . 73.540000000000006 109.286 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . 0.501 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 37.87 76.7 0.07 OUTLIER Glycine 0 CA--C 1.53 1.03 0 O-C-N 124.537 1.148 . . . . 52.030000000000001 110.982 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . 0.4 ' O ' ' O ' ' A' ' 167' ' ' TYR . 0.6 OUTLIER -163.64 -175.46 4.17 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.499 0.764 . . . . 64.099999999999994 109.98 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.744 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -110.46 -41.36 4.37 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.566 1.166 . . . . 55.009999999999998 109.292 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.744 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 0.4 OUTLIER -154.54 165.86 35.12 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 107.969 -1.123 . . . . 72.340000000000003 107.969 -179.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.622 HG22 HG12 ' A' ' 82' ' ' VAL . 3.2 p -133.35 129.21 37.16 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.542 1.151 . . . . 74.319999999999993 110.399 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.791 ' HB ' HG23 ' A' ' 83' ' ' ILE . 11.4 mm -84.56 121.87 37.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.506 1.129 . . . . 75.549999999999997 109.288 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.538 HD23 ' C ' ' A' ' 136' ' ' ILE . 6.7 mt -108.29 87.81 2.58 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.479 1.112 . . . . 75.329999999999998 109.311 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.981 HD22 ' HB2' ' A' ' 93' ' ' ALA . 3.5 tp -62.27 88.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.5 1.125 . . . . 44.409999999999997 109.268 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.529 HD13 HG23 ' A' ' 185' ' ' THR . 19.3 mt -61.48 113.7 2.82 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.441 1.088 . . . . 63.200000000000003 109.343 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.595 HG23 ' ND2' ' A' ' 178' ' ' ASN . 5.7 m -140.32 154.4 46.77 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.525 1.14 . . . . 44.299999999999997 110.412 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 11.2 mp0 -47.34 -39.95 16.11 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.478 1.111 . . . . 51.119999999999997 110.332 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . 0.412 ' ND2' ' N ' ' A' ' 143' ' ' PHE . 2.4 p-10 -89.89 -53.6 4.42 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.53 1.144 . . . . 74.209999999999994 109.294 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.649 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 37.3 t80 -48.95 -21.49 0.67 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.486 1.116 . . . . 74.109999999999999 111.038 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.511 ' O ' ' CB ' ' A' ' 148' ' ' TRP . 3.0 tm? -78.49 -67.64 0.72 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.547 1.154 . . . . 74.230000000000004 109.303 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.461 ' CD ' ' N ' ' A' ' 145' ' ' ARG . 0.1 OUTLIER -55.52 -17.48 5.44 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.457 1.098 . . . . 73.519999999999996 110.362 179.934 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -70.19 -73.15 0.17 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.5 1.125 . . . . 72.400000000000006 109.297 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.477 HG23 ' CZ ' ' A' ' 151' ' ' PHE . 0.9 OUTLIER -72.61 -48.11 42.38 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.503 1.127 . . . . 61.219999999999999 110.443 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.541 ' CE3' ' CD2' ' A' ' 151' ' ' PHE . 15.5 t-105 -44.39 -40.26 5.28 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.49 1.118 . . . . 71.409999999999997 108.001 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . 0.451 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 15.9 t -66.28 -45.74 79.41 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.483 1.114 . . . . 73.140000000000001 108.274 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.468 ' N ' ' O ' ' A' ' 147' ' ' THR . 0.6 OUTLIER -54.07 -53.92 46.54 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.47 1.106 . . . . 65.340000000000003 109.291 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 1.083 ' CE1' HD12 ' A' ' 157' ' ' LEU . 9.8 m-30 -38.2 -60.26 0.79 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.502 1.126 . . . . 71.209999999999994 111.029 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -45.75 -38.54 7.13 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.474 1.109 . . . . 72.510000000000005 110.291 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.45 ' N ' ' O ' ' A' ' 150' ' ' ASN . 51.8 t80 -82.26 -23.91 35.05 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.435 1.084 . . . . 71.299999999999997 110.989 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.555 ' CD2' ' HB2' ' A' ' 156' ' ' SER . 1.2 t80 -144.57 107.45 4.48 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.472 1.107 . . . . 74.209999999999994 110.949 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.1 t -73.18 -6.26 44.68 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.444 1.09 . . . . 64.109999999999999 110.431 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . 0.555 ' HB2' ' CD2' ' A' ' 154' ' ' TYR . 22.0 m -51.29 -52.55 44.15 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.434 1.083 . . . . 41.299999999999997 110.01 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 1.083 HD12 ' CE1' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -66.96 -40.26 87.45 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.49 1.119 . . . . 74.239999999999995 109.244 -179.96 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' MET . . . . . 0.632 ' CE ' HG21 ' A' ' 161' ' ' VAL . 2.1 mmt -53.24 -19.55 3.27 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.418 1.074 . . . . 61.130000000000003 110.994 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' ASN . . . . . 0.47 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 87.5 m-20 -75.18 -42.23 56.32 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.474 1.108 . . . . 74.230000000000004 109.326 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.775 ' O ' HG21 ' A' ' 170' ' ' VAL . 0.3 OUTLIER -64.54 -13.47 52.76 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.51 1.131 . . . . 73.510000000000005 110.023 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . 0.638 ' CG1' ' HB1' ' A' ' 188' ' ' ALA . 89.0 t -74.85 -15.96 16.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.508 1.13 . . . . 74.340000000000003 109.311 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.14 2.83 19.5 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.506 1.129 . . . . 73.340000000000003 109.286 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.452 ' HD3' ' CG2' ' A' ' 192' ' ' ILE . 14.8 mmm-85 60.37 64.97 1.13 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.42 1.075 . . . . 73.310000000000002 110.29 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . 0.505 ' N ' ' NE2' ' A' ' 164' ' ' GLN . 0.9 OUTLIER -65.68 129.15 38.75 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.478 1.112 . . . . 73.239999999999995 110.271 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.417 ' O ' ' O ' ' A' ' 166' ' ' LYS . 13.3 m-70 -74.03 -3.91 32.17 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.507 1.129 . . . . 74.209999999999994 109.624 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.417 ' O ' ' O ' ' A' ' 165' ' ' HIS . 5.6 mptt -49.64 178.79 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.501 1.125 . . . . 63.350000000000001 109.334 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' TYR . . . . . 0.593 ' CE2' ' OD1' ' A' ' 168' ' ' ASN . 29.6 p90 -48.22 -47.66 35.52 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.452 1.095 . . . . 72.329999999999998 111.014 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.593 ' OD1' ' CE2' ' A' ' 167' ' ' TYR . 3.2 p-10 -89.5 146.23 24.76 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.468 1.105 . . . . 70.409999999999997 109.345 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 8.3 t -128.11 169.02 14.56 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.505 1.128 . . . . 72.530000000000001 109.991 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.793 ' C ' HD12 ' A' ' 171' ' ' ILE . 12.7 t -123.0 111.59 30.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 O-C-N 124.463 1.102 . . . . 40.350000000000001 109.336 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.793 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -126.32 97.24 34.72 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.538 1.149 . . . . 73.439999999999998 109.269 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.804 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.3 Cg_endo -75.0 106.92 2.37 Favored 'Trans proline' 0 C--N 1.36 1.141 0 O-C-N 124.507 1.793 . . . . 65.420000000000002 110.986 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . 0.814 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.9 ttt -78.54 156.36 29.26 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.485 1.116 . . . . 73.319999999999993 110.997 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . 0.479 ' NH2' ' NH2' ' A' ' 182' ' ' ARG . 59.5 mtt85 -110.13 124.32 33.75 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.545 1.153 . . . . 70.519999999999996 110.327 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' PRO . . . . . 0.719 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -74.95 156.11 43.21 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.505 1.792 . . . . 64.310000000000002 111.008 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.892 HD21 ' CD ' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -104.17 -47.0 4.28 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.478 1.111 . . . . 75.319999999999993 109.248 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -72.77 -21.46 61.0 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.496 1.123 . . . . 72.230000000000004 109.314 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' ASN . . . . . 0.595 ' ND2' HG23 ' A' ' 140' ' ' THR . 5.5 t-20 -107.0 109.11 62.93 Favored Pre-proline 0 C--N 1.324 -0.528 0 O-C-N 124.576 1.173 . . . . 74.549999999999997 109.265 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.06 115.34 4.25 Favored 'Trans proline' 0 C--N 1.359 1.11 0 O-C-N 124.518 1.799 . . . . 63.409999999999997 111.007 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.505 HD22 ' HA ' ' A' ' 180' ' ' LEU . 0.6 OUTLIER -138.02 96.9 10.08 Favored Pre-proline 0 C--N 1.326 -0.453 0 O-C-N 124.491 1.119 . . . . 74.239999999999995 109.237 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.97 166.97 28.09 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.461 1.769 . . . . 74.230000000000004 110.969 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . 0.479 ' NH2' ' NH2' ' A' ' 174' ' ' ARG . 0.1 OUTLIER -56.98 -31.41 65.01 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.579 1.174 . . . . 74.010000000000005 110.34 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -57.15 -17.0 9.09 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.473 1.108 . . . . 70.530000000000001 110.317 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' ARG . . . . . 0.467 ' HB2' HD13 ' A' ' 180' ' ' LEU . 23.3 mmt85 -109.24 -14.18 14.52 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.49 1.119 . . . . 73.439999999999998 110.299 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' THR . . . . . 0.529 HG23 HD13 ' A' ' 139' ' ' LEU . 86.3 m -89.94 143.19 29.64 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.487 1.117 . . . . 71.239999999999995 110.395 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . 0.689 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.5 Cg_endo -74.95 144.54 30.57 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.52 1.8 . . . . 74.450000000000003 110.989 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 187' ' ' PHE . . . . . 0.629 ' O ' HG23 ' A' ' 191' ' ' THR . 22.5 p90 -60.84 -13.0 12.69 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.411 1.069 . . . . 62.109999999999999 110.981 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . 0.721 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -86.25 -54.6 4.35 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.553 1.158 . . . . 34.219999999999999 109.26 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.689 HD12 ' CG ' ' A' ' 186' ' ' PRO . 20.2 mt -74.14 -15.46 61.03 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.448 1.092 . . . . 63.210000000000001 109.299 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -84.75 -23.56 29.2 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.468 1.105 . . . . 72.120000000000005 110.248 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 191' ' ' THR . . . . . 0.629 HG23 ' O ' ' A' ' 187' ' ' PHE . 39.8 p -101.9 21.19 15.06 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 124.571 1.169 . . . . 64.319999999999993 110.403 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.721 HD12 ' O ' ' A' ' 188' ' ' ALA . 19.9 mt -124.64 154.69 32.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.492 1.12 . . . . 73.409999999999997 109.248 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -63.76 98.04 0.18 Allowed 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.517 1.136 . . . . 73.530000000000001 109.375 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . 0.804 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -92.39 151.77 20.08 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.585 1.178 . . . . 54.409999999999997 109.323 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 195' ' ' LEU . . . . . 0.734 HD23 ' CD1' ' A' ' 209' ' ' ILE . 0.3 OUTLIER -86.8 147.56 25.77 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.495 1.122 . . . . 71.530000000000001 109.316 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . 0.485 ' N ' HD13 ' A' ' 195' ' ' LEU . 25.0 mt-10 -143.77 141.02 30.22 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.478 1.111 . . . . 71.439999999999998 110.321 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.892 ' CD ' HD21 ' A' ' 176' ' ' LEU . 2.1 pt-20 -113.19 -17.47 12.35 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.494 1.121 . . . . 71.409999999999997 110.296 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . 0.561 ' HB3' HD12 ' A' ' 176' ' ' LEU . 0.0 OUTLIER -92.32 2.58 56.55 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 124.472 1.107 . . . . 62.43 110.363 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 36.3 t -99.16 165.32 11.77 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.499 1.124 . . . . 74.209999999999994 109.959 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 14.8 mtm180 -75.85 -27.48 57.85 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.525 1.141 . . . . 74.439999999999998 110.35 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -95.86 20.28 50.6 Favored Glycine 0 CA--C 1.528 0.892 0 O-C-N 124.537 1.148 . . . . 74.349999999999994 111.029 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 202' ' ' PHE . . . . . 0.781 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.1 OUTLIER -58.21 -43.22 98.1 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.45 0.736 . . . . 72.150000000000006 110.932 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 203' ' ' PRO . . . . . 0.627 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.5 Cg_endo -74.98 -30.32 7.32 Favored 'Trans proline' 0 C--N 1.359 1.108 0 O-C-N 124.529 1.805 . . . . 73.450000000000003 110.984 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.04 -65.56 0.67 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.53 1.144 . . . . 71.340000000000003 110.352 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -52.05 -39.4 59.58 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.481 1.113 . . . . 74.140000000000001 110.28 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 206' ' ' VAL . . . . . 1.032 HG11 ' CE2' ' A' ' 104' ' ' PHE . 47.3 t -60.84 -28.3 42.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.557 1.161 . . . . 52.329999999999998 109.308 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -83.06 -50.32 8.63 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.474 1.109 . . . . 70.310000000000002 110.241 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . 0.428 ' N ' ' HD2' ' A' ' 208' ' ' ARG . 9.5 mpt_? -61.18 -64.07 1.08 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.466 1.104 . . . . 70.439999999999998 110.261 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 209' ' ' ILE . . . . . 0.797 HG22 ' CD1' ' A' ' 210' ' ' PHE . 44.9 mt -47.07 -56.44 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 124.501 1.126 . . . . 72.340000000000003 109.263 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 210' ' ' PHE . . . . . 0.797 ' CD1' HG22 ' A' ' 209' ' ' ILE . 2.4 m-85 -101.2 67.58 1.18 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.598 1.186 . . . . 74.329999999999998 110.962 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 211' ' ' GLN . . . . . 0.419 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -110.7 145.33 38.19 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.485 1.115 . . . . 72.219999999999999 110.311 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' A' ' 215' ' ' TYR . 34.0 tt0 -49.45 -55.07 14.45 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.511 1.132 . . . . 75.420000000000002 110.326 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.94 -23.83 0.88 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.463 1.102 . . . . 65.319999999999993 109.918 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.419 HG23 ' HG2' ' A' ' 211' ' ' GLN . 20.0 t -95.66 -30.56 4.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 O-C-N 124.527 1.142 . . . . 74.439999999999998 109.322 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 215' ' ' TYR . . . . . 0.455 ' N ' ' O ' ' A' ' 212' ' ' GLU . 6.6 t80 -62.12 -25.11 67.55 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.467 1.104 . . . . 75.329999999999998 110.965 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . 0.413 ' O ' ' N ' ' A' ' 219' ' ' GLN . 3.9 mmtp -73.73 -61.65 1.77 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.504 1.128 . . . . 52.109999999999999 109.303 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 217' ' ' THR . . . . . 0.754 HG22 HD11 ' A' ' 221' ' ' ILE . 71.4 m -46.93 -48.54 21.39 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.487 1.117 . . . . 72.510000000000005 110.383 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -64.54 -25.08 67.83 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.469 1.106 . . . . 75.319999999999993 110.284 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 219' ' ' GLN . . . . . 0.446 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 31.6 tp60 -83.64 -28.85 28.14 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.494 1.121 . . . . 74.129999999999995 110.256 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 220' ' ' THR . . . . . 0.459 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 3.0 m -85.11 -28.35 25.64 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.568 1.167 . . . . 75.340000000000003 110.426 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 221' ' ' ILE . . . . . 0.754 HD11 HG22 ' A' ' 217' ' ' THR . 46.2 mt -76.54 -32.76 21.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.473 1.108 . . . . 71.340000000000003 109.28 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 222' ' ' TRP . . . . . 0.686 ' O ' HG22 ' A' ' 225' ' ' THR . 18.2 t90 -74.29 -58.33 3.37 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.523 1.139 . . . . 61.420000000000002 107.989 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.459 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -51.26 -22.63 2.84 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.551 1.157 . . . . 70.140000000000001 109.325 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -89.32 -35.22 16.24 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.528 1.142 . . . . 71.299999999999997 110.3 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.686 HG22 ' O ' ' A' ' 222' ' ' TRP . 1.9 t -63.08 -15.74 57.63 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.49 1.118 . . . . 54.149999999999999 110.35 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.28 -9.41 59.73 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.386 1.054 . . . . 74.319999999999993 110.284 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 227' ' ' ASN . . . . . 0.44 ' O ' ' N ' ' A' ' 231' ' ' ARG . 0.9 OUTLIER -92.22 -71.05 0.66 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.451 1.094 . . . . 74.310000000000002 109.3 179.945 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 228' ' ' MET . . . . . 0.464 ' CE ' ' HA ' ' A' ' 225' ' ' THR . 0.0 OUTLIER -43.32 -36.11 1.74 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.473 1.108 . . . . 63.130000000000003 110.97 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 229' ' ' VAL . . . . . 0.644 HG13 ' O ' ' A' ' 225' ' ' THR . 30.7 m -71.43 -53.95 19.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.548 1.155 . . . . 72.540000000000006 109.35 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 230' ' ' GLN . . . . . 0.549 ' N ' HG23 ' A' ' 229' ' ' VAL . 3.6 tp60 -68.29 -8.41 39.34 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.412 1.07 . . . . 74.420000000000002 110.258 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 231' ' ' ARG . . . . . 0.44 ' N ' ' O ' ' A' ' 227' ' ' ASN . 20.1 tpt180 -87.62 -83.27 0.21 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.493 1.121 . . . . 73.049999999999997 110.324 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -141.36 36.74 1.69 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.516 1.135 . . . . 51.039999999999999 110.287 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.86 33.88 0.68 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.503 1.127 . . . . 73.230000000000004 111.054 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 8.2 tt -57.06 152.41 2.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.551 1.157 . . . . 74.340000000000003 109.27 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.457 0 O-C-N 124.483 1.115 . . . . 73.209999999999994 109.313 -179.994 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.008 0 N-CA-C 110.998 -0.841 . . . . 61.210000000000001 110.998 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.01 144.05 29.76 Favored 'Trans proline' 0 C--N 1.36 1.166 0 O-C-N 124.56 1.821 . . . . 72.120000000000005 111.007 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.582 ' O ' HD13 ' A' ' 72' ' ' LEU . 1.5 tm? -76.82 -47.77 20.49 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.479 1.112 . . . . 63.210000000000001 109.257 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -119.48 117.41 3.6 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.451 1.095 . . . . 42.439999999999998 111.011 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 60.0 p -131.04 164.99 24.19 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.491 0.76 . . . . 53.520000000000003 109.959 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.9 tt0 -44.35 140.32 2.31 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.596 1.185 . . . . 74.420000000000002 110.331 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -133.01 144.13 49.88 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.518 1.137 . . . . 74.120000000000005 110.317 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.412 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.4 p -178.38 159.49 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.442 1.089 . . . . 65.109999999999999 109.285 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.532 ' O ' ' CD2' ' A' ' 78' ' ' PHE . 10.1 p90 -89.61 28.27 1.34 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.55 1.157 . . . . 70.400000000000006 110.977 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.415 ' C ' ' O ' ' A' ' 78' ' ' PHE . 4.3 tp -39.52 140.59 0.46 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.537 1.148 . . . . 74.049999999999997 109.268 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.488 ' CD ' ' O ' ' A' ' 107' ' ' LYS . 3.2 mtpt -75.99 -64.25 1.13 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.495 1.122 . . . . 72.109999999999999 109.26 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.815 ' CE1' HD11 ' A' ' 83' ' ' ILE . 0.1 OUTLIER -161.54 149.33 15.03 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.457 1.098 . . . . 70.319999999999993 111.001 -179.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 1.026 ' CG1' HG22 ' A' ' 135' ' ' THR . 7.7 p -97.81 169.62 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 O-C-N 124.441 1.088 . . . . 70.340000000000003 109.292 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.826 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.0 mp -132.63 92.2 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.49 1.119 . . . . 74.420000000000002 109.267 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.809 HD11 ' CB ' ' A' ' 128' ' ' ALA . 8.2 mt -70.17 117.81 12.2 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.49 1.119 . . . . 64.299999999999997 109.28 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.769 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -140.35 174.6 10.35 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.513 1.133 . . . . 64.439999999999998 109.583 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.772 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -102.78 164.36 11.68 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.52 1.138 . . . . 53.130000000000003 109.235 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.453 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 21.9 tt0 -69.78 -6.78 34.48 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.586 1.179 . . . . 74.109999999999999 110.262 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -89.9 -46.07 8.8 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.435 1.085 . . . . 71.150000000000006 109.252 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -114.57 44.12 1.79 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.409 1.068 . . . . 62.219999999999999 109.28 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.595 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -78.85 -22.99 45.26 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.512 1.132 . . . . 73.040000000000006 110.432 179.948 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -82.51 -30.2 29.97 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.459 1.099 . . . . 71.239999999999995 109.356 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.411 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -70.22 -57.54 4.78 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.478 1.111 . . . . 75.209999999999994 110.226 -179.958 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 1.035 ' HB2' ' CD2' ' A' ' 138' ' ' LEU . . . -55.19 -35.24 64.62 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.508 1.13 . . . . 43.0 109.298 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.853 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -72.4 -44.32 62.65 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.526 1.141 . . . . 33.32 109.335 179.953 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.687 ' N ' HD13 ' A' ' 94' ' ' LEU . 15.2 tpp180 -48.3 -29.49 3.93 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.479 1.112 . . . . 72.019999999999996 110.303 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.595 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.1 t -81.02 -64.62 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.497 1.123 . . . . 73.409999999999997 109.282 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.481 ' HA ' HD12 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -41.04 -26.21 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.512 1.132 . . . . 72.519999999999996 110.309 -179.968 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.458 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.1 t-20 -72.4 -58.09 3.67 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.449 1.093 . . . . 63.450000000000003 109.333 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.849 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -64.92 -22.28 66.97 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.503 1.127 . . . . 73.209999999999994 109.265 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.849 ' N ' HD23 ' A' ' 99' ' ' LEU . 22.2 mt -62.99 -57.3 11.18 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.481 1.113 . . . . 72.349999999999994 109.301 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.46 58.44 1.01 Allowed 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.47 1.106 . . . . 62.25 110.318 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -178.66 -62.99 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.496 1.123 . . . . 74.099999999999994 109.36 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.416 ' HB3' ' CD2' ' A' ' 104' ' ' PHE . 19.9 t0 -51.86 -49.77 62.26 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 62.130000000000003 109.303 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.506 ' CE2' HG11 ' A' ' 206' ' ' VAL . 0.9 OUTLIER -114.47 -26.54 7.9 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.565 1.165 . . . . 74.019999999999996 111.018 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.436 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 93.54 45.63 3.41 Favored Glycine 0 CA--C 1.529 0.957 0 O-C-N 124.476 1.11 . . . . 63.329999999999998 111.017 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 12.1 mm -84.42 69.34 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.442 0.731 . . . . 51.399999999999999 109.252 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.538 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -115.58 156.35 46.21 Favored Pre-proline 0 C--N 1.325 -0.499 0 O-C-N 124.483 1.114 . . . . 73.530000000000001 109.296 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.538 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.5 Cg_endo -74.92 157.96 99.27 Favored 'Cis proline' 0 C--N 1.36 1.181 0 C-N-CA 121.077 -2.468 . . . . 74.450000000000003 110.957 0.073 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -122.86 133.01 8.9 Favored Glycine 0 CA--C 1.532 1.096 0 O-C-N 124.535 1.147 . . . . 41.219999999999999 110.986 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -154.64 135.02 4.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.534 0.785 . . . . 62.310000000000002 109.354 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.793 HD13 ' HB2' ' A' ' 94' ' ' LEU . 38.2 pt -91.07 176.46 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.449 1.093 . . . . 73.209999999999994 109.292 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.709 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 2.2 t80 -78.71 -19.2 52.96 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.503 1.127 . . . . 74.510000000000005 110.995 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -90.08 -3.59 57.85 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.521 1.138 . . . . 55.0 109.279 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -110.49 -26.41 9.52 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.515 1.134 . . . . 64.120000000000005 110.239 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 6.1 ttm -38.55 111.1 0.6 Allowed Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.525 1.141 . . . . 73.530000000000001 110.991 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 76.45 3.39 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.533 1.807 . . . . 73.209999999999994 111.004 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -125.15 174.11 8.29 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.534 1.146 . . . . 73.409999999999997 109.618 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.69 -179.82 4.61 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.594 1.184 . . . . 75.340000000000003 110.987 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 30.0 mtp85 -117.55 42.15 2.66 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.395 0.703 . . . . 55.219999999999999 110.348 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -78.84 -61.38 2.03 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.483 1.114 . . . . 62.43 110.326 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -167.72 132.66 1.88 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.517 1.135 . . . . 74.049999999999997 109.641 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.66 ' H ' HD12 ' A' ' 122' ' ' LEU . 0.1 OUTLIER -103.94 22.58 14.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.5 1.125 . . . . 74.239999999999995 109.291 -179.923 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -70.79 -52.5 20.2 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.516 1.135 . . . . 75.439999999999998 110.326 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -58.34 101.79 0.09 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.576 1.172 . . . . 74.340000000000003 109.276 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.842 HD22 HD12 ' A' ' 157' ' ' LEU . 0.2 OUTLIER -85.52 -17.14 37.25 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.403 1.064 . . . . 64.219999999999999 109.299 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.482 ' N ' HD12 ' A' ' 125' ' ' LEU . 7.8 t0 -45.31 -59.23 2.77 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.509 1.13 . . . . 61.200000000000003 109.321 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -44.65 -39.25 4.9 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.536 1.147 . . . . 54.549999999999997 109.285 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.809 ' CB ' HD11 ' A' ' 84' ' ' LEU . . . -50.38 -50.49 51.31 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.504 1.128 . . . . 52.109999999999999 109.297 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.507 ' O ' ' CB ' ' A' ' 168' ' ' ASN . 34.6 m -92.48 31.16 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.438 1.086 . . . . 64.030000000000001 109.218 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -114.08 149.18 35.9 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.492 1.12 . . . . 72.310000000000002 109.254 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 39.66 70.03 0.38 Allowed Glycine 0 CA--C 1.531 1.063 0 O-C-N 124.54 1.15 . . . . 63.020000000000003 110.983 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -163.6 179.77 6.98 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.545 0.791 . . . . 65.430000000000007 110.063 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.764 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -102.49 -43.06 5.75 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.526 1.141 . . . . 73.519999999999996 109.279 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.764 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 0.7 OUTLIER -154.99 169.89 23.03 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.534 1.146 . . . . 73.319999999999993 108.05 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 1.026 HG22 ' CG1' ' A' ' 82' ' ' VAL . 1.2 p -137.99 158.32 44.57 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 65.049999999999997 110.374 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.826 ' HB ' HG23 ' A' ' 83' ' ' ILE . 10.5 mm -110.98 142.26 23.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.53 1.144 . . . . 52.030000000000001 109.257 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.802 HD13 ' O ' ' A' ' 136' ' ' ILE . 0.5 OUTLIER -134.69 96.46 3.56 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.462 1.101 . . . . 73.019999999999996 109.31 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 1.035 ' CD2' ' HB2' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.43 96.72 0.08 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.547 1.154 . . . . 73.239999999999995 109.278 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.725 HD11 HD13 ' A' ' 189' ' ' LEU . 0.2 OUTLIER -61.23 102.81 0.24 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.468 1.105 . . . . 52.32 109.291 -179.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.443 ' O ' ' N ' ' A' ' 144' ' ' LEU . 2.6 m -130.47 155.59 46.19 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.446 1.091 . . . . 63.210000000000001 110.397 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -64.42 -36.39 84.0 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.546 1.154 . . . . 63.549999999999997 110.313 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -84.1 -25.93 29.35 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.469 1.106 . . . . 72.200000000000003 109.366 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.772 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 52.9 t80 -85.67 -19.93 30.17 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.479 1.112 . . . . 60.229999999999997 111.06 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.707 HD13 ' C ' ' A' ' 144' ' ' LEU . 2.0 tm? -66.23 -67.23 0.46 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.495 1.122 . . . . 64.239999999999995 109.299 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.45 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 22.4 mmt180 -55.17 -19.69 8.49 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.481 1.113 . . . . 73.129999999999995 110.355 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -71.96 -67.2 0.55 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.475 1.11 . . . . 74.030000000000001 109.318 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.478 HG21 ' CE1' ' A' ' 143' ' ' PHE . 3.1 p -66.84 -54.62 20.54 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.542 1.151 . . . . 75.120000000000005 110.4 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.519 ' CZ3' ' HE3' ' A' ' 158' ' ' MET . 3.3 t-105 -43.08 -36.54 1.67 Allowed 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.518 1.136 . . . . 75.109999999999999 108.029 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 43.7 t -78.64 -45.33 21.77 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.61 1.194 . . . . 74.120000000000005 108.354 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.453 ' N ' ' O ' ' A' ' 147' ' ' THR . 6.3 t-20 -56.51 -21.83 28.7 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.432 1.082 . . . . 72.5 109.319 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.771 ' HE1' HD13 ' A' ' 157' ' ' LEU . 10.7 m-30 -77.06 -51.78 10.46 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.558 1.161 . . . . 75.140000000000001 111.027 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 38.6 tt0 -42.46 -40.9 2.74 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.475 1.109 . . . . 71.109999999999999 110.3 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -88.81 -23.63 22.8 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.465 1.103 . . . . 74.450000000000003 110.924 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.564 ' CE2' ' HB2' ' A' ' 156' ' ' SER . 6.8 t80 -135.17 87.91 2.37 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.481 1.113 . . . . 71.400000000000006 111.116 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.84 -4.65 29.19 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.525 1.141 . . . . 75.420000000000002 110.416 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . 0.564 ' HB2' ' CE2' ' A' ' 154' ' ' TYR . 0.7 OUTLIER -54.68 -34.39 62.23 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.521 1.138 . . . . 65.340000000000003 109.994 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.842 HD12 HD22 ' A' ' 125' ' ' LEU . 0.9 OUTLIER -83.06 -31.43 27.37 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.49 1.119 . . . . 74.040000000000006 109.242 -179.967 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' MET . . . . . 0.9 ' O ' HG22 ' A' ' 161' ' ' VAL . 3.5 mmt -58.94 -37.42 76.68 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.493 1.121 . . . . 72.200000000000003 110.956 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -84.11 -9.62 58.44 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.453 1.095 . . . . 72.439999999999998 109.359 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.921 ' HB3' HG21 ' A' ' 170' ' ' VAL . 0.3 OUTLIER -82.8 -31.37 28.21 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.43 1.082 . . . . 73.409999999999997 110.037 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . 0.9 HG22 ' O ' ' A' ' 158' ' ' MET . 29.8 m -62.18 -18.04 19.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 124.45 1.094 . . . . 61.399999999999999 109.248 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 42.0 m-20 -78.8 0.59 26.37 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.558 1.161 . . . . 62.350000000000001 109.234 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.724 ' NE ' HG23 ' A' ' 192' ' ' ILE . 0.0 OUTLIER 50.55 49.96 19.8 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.478 1.111 . . . . 43.310000000000002 110.281 179.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -50.63 -177.98 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.497 1.123 . . . . 65.519999999999996 110.312 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 22.1 p80 -93.26 39.58 1.05 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.548 1.155 . . . . 64.109999999999999 109.572 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.562 ' C ' HG21 ' A' ' 221' ' ' ILE . 2.7 tptt -94.71 179.33 5.29 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.536 1.147 . . . . 74.0 109.317 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' TYR . . . . . . . . . . . . . 24.4 p90 -84.95 44.27 1.06 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.489 1.118 . . . . 72.019999999999996 110.979 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.507 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 19.5 p30 -170.51 142.31 2.06 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 62.340000000000003 109.352 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.481 ' O ' ' N ' ' A' ' 135' ' ' THR . 1.4 t -128.14 128.4 44.77 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.555 1.159 . . . . 54.43 109.982 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.921 HG21 ' HB3' ' A' ' 160' ' ' SER . 8.9 t -95.59 107.18 19.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.507 1.129 . . . . 71.310000000000002 109.319 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.662 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -121.48 106.31 37.92 Favored Pre-proline 0 C--N 1.324 -0.512 0 O-C-N 124.511 1.132 . . . . 71.540000000000006 109.338 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.884 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -74.98 116.24 4.53 Favored 'Trans proline' 0 C--N 1.359 1.118 0 O-C-N 124.52 1.8 . . . . 60.140000000000001 111.016 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . 0.667 ' CE ' HD12 ' A' ' 195' ' ' LEU . 3.6 ttt -92.46 152.46 19.67 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.492 1.12 . . . . 74.109999999999999 110.997 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . 0.44 ' N ' ' HG2' ' A' ' 173' ' ' MET . 3.6 tpp180 -104.78 116.81 60.27 Favored Pre-proline 0 C--N 1.325 -0.47 0 O-C-N 124.52 1.138 . . . . 61.350000000000001 110.301 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' PRO . . . . . 0.469 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.1 Cg_endo -75.05 153.85 41.84 Favored 'Trans proline' 0 C--N 1.36 1.183 0 O-C-N 124.47 1.774 . . . . 72.200000000000003 110.999 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.901 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -87.31 -43.79 11.9 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.463 1.102 . . . . 43.539999999999999 109.307 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -71.81 -27.21 62.77 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.51 1.131 . . . . 74.239999999999995 109.284 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' ASN . . . . . 0.469 ' CB ' ' HG2' ' A' ' 175' ' ' PRO . 7.1 m-80 -110.85 97.86 35.63 Favored Pre-proline 0 C--N 1.326 -0.445 0 O-C-N 124.435 1.085 . . . . 61.130000000000003 109.307 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.95 121.38 6.56 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.562 1.822 . . . . 74.400000000000006 111.081 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.519 HD13 ' HB2' ' A' ' 184' ' ' ARG . 0.4 OUTLIER -128.9 96.49 29.15 Favored Pre-proline 0 C--N 1.324 -0.527 0 O-C-N 124.575 1.172 . . . . 64.420000000000002 109.327 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.04 171.54 18.12 Favored 'Trans proline' 0 C--N 1.359 1.124 0 O-C-N 124.554 1.818 . . . . 73.049999999999997 110.971 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 7.6 ptp85 -59.66 -23.41 63.03 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.531 1.145 . . . . 71.439999999999998 110.278 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . 0.414 ' HG2' ' N ' ' A' ' 184' ' ' ARG . 2.7 pt-20 -70.05 -29.23 66.2 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.459 1.099 . . . . 60.350000000000001 110.337 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 184' ' ' ARG . . . . . 0.519 ' HB2' HD13 ' A' ' 180' ' ' LEU . 27.7 mmt180 -95.41 -18.74 20.47 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.542 1.151 . . . . 74.019999999999996 110.31 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 185' ' ' THR . . . . . 0.499 HG22 ' HD2' ' A' ' 186' ' ' PRO . 19.9 m -80.9 143.95 54.5 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.516 1.135 . . . . 75.329999999999998 110.381 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . 0.737 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.1 Cg_endo -75.08 155.61 42.55 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.475 1.776 . . . . 72.209999999999994 110.927 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 187' ' ' PHE . . . . . 0.503 ' O ' ' CG2' ' A' ' 191' ' ' THR . 9.2 p90 -69.4 -7.1 34.62 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.513 1.133 . . . . 72.299999999999997 111.04 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . 0.627 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -93.97 -53.14 4.11 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.523 1.139 . . . . 74.030000000000001 109.3 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.863 HD22 ' HG3' ' A' ' 172' ' ' PRO . 53.2 mt -68.3 -42.4 79.52 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.424 1.078 . . . . 74.209999999999994 109.281 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 190' ' ' GLN . . . . . 0.411 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.3 pt20 -63.82 -10.96 23.12 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.512 1.132 . . . . 74.219999999999999 110.327 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 191' ' ' THR . . . . . 0.503 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 36.2 p -113.6 18.31 17.66 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.429 1.08 . . . . 75.030000000000001 110.393 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.738 HD13 ' O ' ' A' ' 161' ' ' VAL . 4.9 mt -136.37 142.46 38.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.462 1.101 . . . . 73.0 109.265 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -48.23 124.31 7.64 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.515 1.135 . . . . 70.540000000000006 109.319 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . 0.884 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -121.09 155.05 35.28 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.463 1.102 . . . . 70.230000000000004 109.311 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 195' ' ' LEU . . . . . 0.707 HD23 HD12 ' A' ' 209' ' ' ILE . 0.3 OUTLIER -82.27 134.22 35.27 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.538 1.149 . . . . 74.209999999999994 109.278 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . 0.412 ' O ' ' HA ' ' A' ' 202' ' ' PHE . 31.0 mt-10 -112.72 131.47 55.65 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.455 1.097 . . . . 72.409999999999997 110.259 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.901 ' HG3' HD21 ' A' ' 176' ' ' LEU . 3.8 tp10 -113.42 -25.37 8.83 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.491 1.119 . . . . 61.439999999999998 110.369 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -96.98 3.95 51.77 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.515 1.135 . . . . 54.219999999999999 110.299 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 19.5 t -97.26 174.27 6.8 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.545 1.153 . . . . 64.019999999999996 109.966 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -83.47 -32.89 25.77 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.54 1.15 . . . . 75.120000000000005 110.253 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -87.71 19.34 33.67 Favored Glycine 0 CA--C 1.529 0.941 0 O-C-N 124.568 1.167 . . . . 71.420000000000002 111.034 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 202' ' ' PHE . . . . . 0.819 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.1 OUTLIER -56.8 -43.42 99.36 Favored Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.454 0.738 . . . . 72.420000000000002 110.98 -179.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 203' ' ' PRO . . . . . 0.615 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.0 Cg_endo -75.02 -28.91 8.73 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.486 1.782 . . . . 63.210000000000001 110.964 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 204' ' ' THR . . . . . 0.402 HG22 ' N ' ' A' ' 205' ' ' GLN . 0.9 OUTLIER -64.69 -65.1 0.72 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.449 1.093 . . . . 60.340000000000003 110.405 179.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 205' ' ' GLN . . . . . 0.402 ' N ' HG22 ' A' ' 204' ' ' THR . 5.8 mt-30 -50.38 -44.31 54.78 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.458 1.099 . . . . 61.409999999999997 110.318 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 206' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 202' ' ' PHE . 72.5 t -56.2 -29.44 27.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.453 1.096 . . . . 70.519999999999996 109.363 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -82.8 -51.54 7.57 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.517 1.136 . . . . 52.020000000000003 110.297 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . 0.42 ' N ' ' HD2' ' A' ' 208' ' ' ARG . 11.6 mpt_? -58.21 -62.52 1.77 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.543 1.152 . . . . 73.230000000000004 110.377 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 209' ' ' ILE . . . . . 0.707 HD12 HD23 ' A' ' 195' ' ' LEU . 84.6 mt -49.85 -51.29 16.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.516 1.135 . . . . 72.420000000000002 109.306 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 210' ' ' PHE . . . . . 0.685 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.2 m-85 -101.49 61.71 0.92 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.494 1.121 . . . . 73.230000000000004 111.016 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 211' ' ' GLN . . . . . 0.544 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -110.94 145.85 37.62 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.507 1.13 . . . . 73.019999999999996 110.334 180.0 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.452 ' O ' ' N ' ' A' ' 215' ' ' TYR . 32.4 tt0 -49.43 -55.02 14.55 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.506 1.129 . . . . 73.420000000000002 110.306 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.04 -23.59 1.24 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.495 1.122 . . . . 74.450000000000003 110.083 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.544 HG23 ' HG2' ' A' ' 211' ' ' GLN . 38.9 t -96.22 -27.49 4.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.538 1.149 . . . . 70.519999999999996 109.321 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 215' ' ' TYR . . . . . 0.452 ' N ' ' O ' ' A' ' 212' ' ' GLU . 3.4 t80 -63.87 -28.72 70.04 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.495 1.122 . . . . 74.209999999999994 111.01 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . 0.439 ' O ' ' N ' ' A' ' 220' ' ' THR . 64.2 mmtt -60.0 -65.28 0.71 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.547 1.154 . . . . 73.510000000000005 109.352 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 217' ' ' THR . . . . . 0.797 HG22 HD11 ' A' ' 221' ' ' ILE . 34.7 m -40.58 -62.94 0.7 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.546 1.154 . . . . 73.430000000000007 110.398 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 218' ' ' GLN . . . . . 0.533 ' HA ' HD12 ' A' ' 221' ' ' ILE . 93.4 mm-40 -50.15 -63.31 1.15 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.52 1.137 . . . . 70.239999999999995 110.342 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 219' ' ' GLN . . . . . 0.41 ' NE2' ' HB3' ' A' ' 223' ' ' LYS . 34.1 tp60 -52.99 -20.2 3.24 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.561 1.163 . . . . 74.120000000000005 110.274 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 220' ' ' THR . . . . . 0.439 ' N ' ' O ' ' A' ' 216' ' ' LYS . 0.9 OUTLIER -87.49 -29.69 21.18 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.476 1.11 . . . . 74.439999999999998 110.435 -179.939 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 221' ' ' ILE . . . . . 0.797 HD11 HG22 ' A' ' 217' ' ' THR . 10.0 mt -78.86 -35.24 17.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.485 1.116 . . . . 71.109999999999999 109.305 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 222' ' ' TRP . . . . . 0.803 ' O ' HG22 ' A' ' 225' ' ' THR . 25.1 t90 -69.91 -55.0 10.86 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.492 1.12 . . . . 74.049999999999997 108.047 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.41 ' HB3' ' NE2' ' A' ' 219' ' ' GLN . 0.0 OUTLIER -58.67 -22.03 55.9 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.467 1.104 . . . . 75.239999999999995 109.356 179.927 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 220' ' ' THR . 67.9 mt-10 -86.57 -36.73 18.73 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.539 1.149 . . . . 55.020000000000003 110.354 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.803 HG22 ' O ' ' A' ' 222' ' ' TRP . 3.0 t -61.55 -20.57 63.41 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.52 1.138 . . . . 73.019999999999996 110.414 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 5.2 mtm180 -75.82 -24.73 55.87 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.514 1.134 . . . . 74.5 110.315 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 227' ' ' ASN . . . . . 0.447 ' O ' ' CG ' ' A' ' 231' ' ' ARG . 0.9 OUTLIER -78.41 -43.47 27.33 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.547 1.154 . . . . 62.340000000000003 109.286 179.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 43.9 mtm -58.28 -34.33 70.41 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.522 1.139 . . . . 75.200000000000003 110.999 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 229' ' ' VAL . . . . . 0.734 HG13 ' HA ' ' A' ' 234' ' ' ILE . 25.0 t -75.81 -57.26 6.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.487 1.117 . . . . 65.340000000000003 109.362 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 230' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -60.32 -15.25 23.76 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.46 1.1 . . . . 70.319999999999993 110.272 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 231' ' ' ARG . . . . . 0.447 ' CG ' ' O ' ' A' ' 227' ' ' ASN . 34.1 mmm-85 -89.86 -89.61 0.15 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.492 1.12 . . . . 70.099999999999994 110.248 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 9.5 tm0? -134.85 62.03 1.66 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.462 1.102 . . . . 74.040000000000006 110.343 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 233' ' ' PHE . . . . . 0.944 ' C ' HD12 ' A' ' 234' ' ' ILE . 1.5 t80 -176.63 -176.36 0.72 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.561 1.163 . . . . 64.140000000000001 111.0 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.944 HD12 ' C ' ' A' ' 233' ' ' PHE . 2.4 mp -134.71 162.79 38.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.504 1.127 . . . . 64.439999999999998 109.318 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 235' ' ' ALA . . . . . 0.473 ' N ' ' CG2' ' A' ' 234' ' ' ILE . . . . . . . . 0 C--N 1.325 -0.468 0 O-C-N 124.517 1.136 . . . . 73.519999999999996 109.292 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.036 0 N-CA-C 110.951 -0.86 . . . . 65.140000000000001 110.951 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.95 170.88 19.42 Favored 'Trans proline' 0 C--N 1.359 1.13 0 O-C-N 124.491 1.785 . . . . 75.140000000000001 110.993 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.68 -45.4 68.42 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 124.51 1.132 . . . . 74.340000000000003 109.31 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -164.97 61.05 0.24 Allowed Glycine 0 CA--C 1.531 1.033 0 O-C-N 124.468 1.105 . . . . 54.420000000000002 111.018 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -128.61 171.96 11.66 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.584 0.814 . . . . 72.519999999999996 109.985 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -92.64 145.95 24.03 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.478 1.111 . . . . 74.409999999999997 110.314 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -128.36 129.21 45.9 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.495 1.122 . . . . 64.409999999999997 110.285 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.512 HG22 ' N ' ' A' ' 78' ' ' PHE . 3.3 p -127.15 165.69 25.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.42 1.075 . . . . 65.129999999999995 109.334 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.512 ' N ' HG22 ' A' ' 77' ' ' VAL . 2.3 t80 -88.87 24.29 2.1 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.535 1.147 . . . . 74.200000000000003 111.046 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.794 HD11 HG22 ' A' ' 110' ' ' ILE . 3.6 tp -40.35 159.33 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.464 1.102 . . . . 75.329999999999998 109.302 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.657 ' HD3' HG22 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -106.24 -49.42 3.36 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.47 1.106 . . . . 73.239999999999995 109.292 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.597 ' CD1' ' O ' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -167.07 132.26 2.07 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.513 1.133 . . . . 74.540000000000006 110.968 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.52 ' CG2' ' CE ' ' A' ' 115' ' ' MET . 3.1 p -90.14 158.17 2.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.487 1.117 . . . . 42.520000000000003 109.293 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.767 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.0 mp -113.56 94.58 3.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 O-C-N 124.46 1.1 . . . . 52.32 109.276 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.06 HD11 ' HB3' ' A' ' 128' ' ' ALA . 5.0 mt -70.25 118.03 12.56 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.523 1.14 . . . . 72.400000000000006 109.362 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.6 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -136.62 173.74 11.38 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.532 1.145 . . . . 53.329999999999998 109.566 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -111.19 163.66 13.68 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.458 1.099 . . . . 72.109999999999999 109.291 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.415 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 10.3 tt0 -65.46 -10.7 36.45 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.562 1.164 . . . . 72.010000000000005 110.36 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -85.38 -44.89 12.39 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.501 1.126 . . . . 62.420000000000002 109.311 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.447 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.6 OUTLIER -119.31 43.3 2.64 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.525 1.14 . . . . 73.349999999999994 109.364 179.945 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.457 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -71.84 -42.92 66.36 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.51 1.131 . . . . 71.340000000000003 110.358 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -64.49 -40.23 95.28 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.46 1.1 . . . . 62.229999999999997 109.277 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.408 ' CD ' ' C ' ' A' ' 92' ' ' GLU . 0.5 OUTLIER -53.28 -69.72 0.11 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.527 1.142 . . . . 75.239999999999995 110.298 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.699 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -43.03 -32.14 0.63 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.565 1.166 . . . . 51.530000000000001 109.329 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.659 ' HG ' HD13 ' A' ' 111' ' ' ILE . 0.8 OUTLIER -67.5 -57.25 6.84 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.468 1.105 . . . . 52.530000000000001 109.27 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.11 -35.25 0.54 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.594 1.183 . . . . 73.019999999999996 110.355 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.653 HG21 ' HE1' ' A' ' 173' ' ' MET . 0.9 OUTLIER -79.31 -65.82 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 O-C-N 124.466 1.104 . . . . 64.510000000000005 109.307 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.814 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -42.21 -24.78 0.06 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.515 1.135 . . . . 74.040000000000006 110.329 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.448 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -74.32 -59.06 2.9 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.561 1.163 . . . . 74.019999999999996 109.306 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.873 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -62.47 -22.58 66.34 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.421 1.076 . . . . 63.509999999999998 109.271 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.873 ' N ' HD23 ' A' ' 99' ' ' LEU . 39.0 mt -73.65 -39.21 64.64 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.533 1.146 . . . . 55.299999999999997 109.311 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.464 ' HB2' ' CD ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -87.84 46.77 1.42 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.579 1.174 . . . . 63.5 110.318 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -175.8 -60.39 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.543 1.152 . . . . 51.100000000000001 109.253 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.509 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 49.0 t0 -40.45 -63.17 0.67 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.541 1.15 . . . . 73.150000000000006 109.324 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.939 ' CE2' HG11 ' A' ' 206' ' ' VAL . 4.9 m-85 -103.02 -14.62 16.38 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.465 1.103 . . . . 73.430000000000007 111.017 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.82 39.23 7.14 Favored Glycine 0 CA--C 1.53 1.009 0 O-C-N 124.514 1.134 . . . . 61.020000000000003 110.952 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.657 HG22 ' HD3' ' A' ' 80' ' ' LYS . 11.0 mm -75.57 72.21 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 O-C-N 124.516 0.774 . . . . 63.130000000000003 109.349 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.55 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -118.38 151.79 49.99 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.476 1.11 . . . . 74.040000000000006 109.363 179.996 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.55 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.0 147.46 89.33 Favored 'Cis proline' 0 C--N 1.36 1.169 0 C-N-CA 121.01 -2.496 . . . . 73.420000000000002 110.977 0.023 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -124.34 135.04 9.4 Favored Glycine 0 CA--C 1.531 1.068 0 O-C-N 124.431 1.082 . . . . 72.109999999999999 110.942 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.794 HG22 HD11 ' A' ' 79' ' ' LEU . 9.9 tt -156.94 153.94 6.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.499 0.764 . . . . 75.340000000000003 109.332 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.814 HG23 ' HG2' ' A' ' 97' ' ' GLN . 8.7 pt -95.98 -177.06 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.549 1.156 . . . . 65.430000000000007 109.319 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.606 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 5.4 t80 -80.92 -19.08 45.06 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.54 1.15 . . . . 62.43 110.959 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.441 ' HB2' ' HE1' ' A' ' 85' ' ' HIS . . . -91.6 -12.87 33.05 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.496 1.122 . . . . 42.140000000000001 109.294 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.419 ' C ' HD11 ' A' ' 110' ' ' ILE . 37.6 mm-40 -97.62 -24.53 15.49 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.475 1.109 . . . . 72.219999999999999 110.324 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.52 ' CE ' ' CG2' ' A' ' 82' ' ' VAL . 7.4 ttm -46.03 143.93 3.2 Favored Pre-proline 0 C--N 1.324 -0.511 0 O-C-N 124.421 1.076 . . . . 62.119999999999997 111.007 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.473 ' HD2' ' CG ' ' A' ' 115' ' ' MET . 18.0 Cg_endo -75.01 71.46 5.0 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.527 1.804 . . . . 70.030000000000001 110.95 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -97.53 -43.38 7.26 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.484 1.115 . . . . 73.030000000000001 109.597 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 78.47 -68.24 2.98 Favored Glycine 0 CA--C 1.53 1.002 0 O-C-N 124.507 1.13 . . . . 72.319999999999993 111.044 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 64.3 mtp180 -47.28 171.02 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.533 0.784 . . . . 62.329999999999998 110.231 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -101.08 -68.24 0.82 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.523 1.14 . . . . 73.420000000000002 110.264 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -46.63 144.16 2.39 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.505 1.128 . . . . 75.409999999999997 109.577 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -104.46 138.37 40.94 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.476 1.11 . . . . 72.049999999999997 109.319 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -76.77 -65.12 0.98 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.536 1.148 . . . . 65.109999999999999 110.3 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -159.67 172.55 17.55 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.484 1.115 . . . . 74.420000000000002 109.315 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.54 HD12 ' N ' ' A' ' 126' ' ' ASP . 0.2 OUTLIER -85.36 -17.26 37.27 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.462 1.101 . . . . 60.420000000000002 109.323 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.54 ' N ' HD12 ' A' ' 125' ' ' LEU . 3.9 p-10 -67.86 -15.36 63.58 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.462 1.101 . . . . 71.439999999999998 109.284 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.407 ' O ' ' ND2' ' A' ' 130' ' ' ASN . 66.7 m-20 -62.3 -27.6 69.15 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.536 1.148 . . . . 74.150000000000006 109.402 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 1.06 ' HB3' HD11 ' A' ' 84' ' ' LEU . . . -93.14 -13.12 28.85 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.495 1.122 . . . . 75.239999999999995 109.352 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.728 ' O ' HG12 ' A' ' 129' ' ' VAL . 71.1 t -92.86 30.44 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 124.593 1.183 . . . . 74.049999999999997 109.247 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.407 ' ND2' ' O ' ' A' ' 127' ' ' ASP . 28.3 p30 -135.81 151.18 49.81 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.553 1.158 . . . . 74.530000000000001 109.306 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 42.87 64.53 1.64 Allowed Glycine 0 CA--C 1.53 0.972 0 O-C-N 124.582 1.176 . . . . 64.129999999999995 111.005 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -163.61 -174.29 3.64 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.48 0.753 . . . . 54.329999999999998 109.96 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.608 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -113.71 -35.91 5.04 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.539 1.149 . . . . 71.439999999999998 109.302 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.687 ' HB3' HD13 ' A' ' 171' ' ' ILE . 0.6 OUTLIER -159.07 163.58 36.15 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.556 1.16 . . . . 73.5 108.039 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 28.4 p -131.42 135.47 47.19 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.532 1.145 . . . . 64.25 110.383 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.767 ' HB ' HG23 ' A' ' 83' ' ' ILE . 36.4 mm -84.31 136.99 21.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.485 1.116 . . . . 64.030000000000001 109.314 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.717 HD23 ' O ' ' A' ' 136' ' ' ILE . 21.2 mt -129.7 99.08 5.01 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.582 1.176 . . . . 51.219999999999999 109.338 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.699 HD21 ' HB2' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.26 88.19 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.573 1.171 . . . . 64.409999999999997 109.295 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 18.6 mt -56.93 99.19 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.495 1.122 . . . . 71.439999999999998 109.322 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.612 HG23 ' OD1' ' A' ' 178' ' ' ASN . 10.1 m -124.03 177.31 5.86 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.531 1.144 . . . . 72.439999999999998 110.458 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.567 ' H ' HG22 ' A' ' 140' ' ' THR . 18.9 mt-10 -80.32 -33.7 37.31 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.435 1.085 . . . . 74.25 110.23 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -89.58 -20.84 23.26 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.492 1.12 . . . . 60.340000000000003 109.334 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.478 ' CZ ' HG21 ' A' ' 147' ' ' THR . 19.6 t80 -89.8 -46.34 8.65 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.554 1.159 . . . . 71.400000000000006 111.078 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.761 HD13 ' C ' ' A' ' 144' ' ' LEU . 1.5 tm? -46.88 -61.08 2.02 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.469 1.106 . . . . 71.450000000000003 109.242 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 9.9 mmt85 -60.59 -20.69 61.28 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.488 1.117 . . . . 72.409999999999997 110.27 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -71.89 -66.43 0.64 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.568 1.167 . . . . 71.219999999999999 109.26 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.478 HG21 ' CZ ' ' A' ' 143' ' ' PHE . 16.5 p -69.37 -54.52 14.03 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.457 1.098 . . . . 72.439999999999998 110.38 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.471 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 24.1 t-105 -42.17 -38.05 1.62 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.962 -1.125 . . . . 72.439999999999998 107.962 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . 0.446 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 53.3 t -79.02 -45.33 20.42 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.524 1.14 . . . . 71.120000000000005 108.295 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.439 ' N ' ' O ' ' A' ' 147' ' ' THR . 3.0 t30 -57.91 -17.78 18.88 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.484 1.115 . . . . 65.150000000000006 109.306 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.561 ' HD2' ' HE3' ' A' ' 158' ' ' MET . 9.7 m-30 -83.06 -46.35 12.93 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 75.409999999999997 111.004 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -49.21 -33.51 12.67 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.48 1.113 . . . . 65.239999999999995 110.287 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -97.29 -19.83 18.28 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.45 1.094 . . . . 75.120000000000005 111.023 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.48 ' CE1' ' HB2' ' A' ' 156' ' ' SER . 0.4 OUTLIER -128.59 94.94 3.99 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.535 1.147 . . . . 74.400000000000006 111.006 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.401 ' O ' ' N ' ' A' ' 158' ' ' MET . 3.5 t -64.53 -21.23 66.63 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.526 1.141 . . . . 75.150000000000006 110.355 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . 0.48 ' HB2' ' CE1' ' A' ' 154' ' ' TYR . 18.8 t -40.13 -48.16 2.46 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.503 1.127 . . . . 63.310000000000002 109.997 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.445 HD21 HD13 ' A' ' 125' ' ' LEU . 0.5 OUTLIER -70.29 -42.95 71.38 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.519 1.137 . . . . 72.430000000000007 109.323 179.97 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' MET . . . . . 0.607 ' HE1' HG21 ' A' ' 161' ' ' VAL . 24.9 mmt -55.2 -20.71 11.32 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.55 1.156 . . . . 72.409999999999997 110.982 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 20.1 m-80 -86.3 -30.78 22.0 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.623 1.202 . . . . 73.510000000000005 109.275 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.583 ' HB2' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -82.22 -17.48 45.93 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.518 1.136 . . . . 75.430000000000007 110.026 179.973 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . 0.607 HG21 ' HE1' ' A' ' 158' ' ' MET . 6.6 t -61.85 -30.6 48.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.48 1.113 . . . . 31.399999999999999 109.297 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . 0.482 ' O ' ' C ' ' A' ' 163' ' ' ARG . 15.5 t-20 -82.41 4.53 23.73 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.59 1.181 . . . . 75.120000000000005 109.263 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.482 ' C ' ' O ' ' A' ' 162' ' ' ASN . 0.0 OUTLIER 32.42 49.77 0.16 Allowed 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.498 1.124 . . . . 75.140000000000001 110.289 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -52.37 -173.74 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.508 1.13 . . . . 72.019999999999996 110.292 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -84.18 60.74 6.11 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.504 1.127 . . . . 72.140000000000001 109.528 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.49 ' HG3' ' CD1' ' A' ' 167' ' ' TYR . 0.1 OUTLIER -121.51 157.66 30.17 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.544 1.152 . . . . 74.310000000000002 109.28 179.976 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' TYR . . . . . 0.579 ' CE1' ' OG1' ' A' ' 225' ' ' THR . 52.1 p90 -54.65 -47.17 73.87 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.54 1.15 . . . . 74.329999999999998 110.999 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.565 ' N ' ' CD2' ' A' ' 167' ' ' TYR . 12.7 p30 -87.07 126.18 34.6 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.439 1.087 . . . . 71.420000000000002 109.279 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.416 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 3.1 t -121.86 176.91 5.51 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.494 1.121 . . . . 55.119999999999997 110.011 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.727 ' O ' HD12 ' A' ' 171' ' ' ILE . 3.2 t -134.16 117.26 24.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.464 1.103 . . . . 73.409999999999997 109.291 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.727 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.6 mp -128.13 97.45 29.04 Favored Pre-proline 0 C--N 1.325 -0.481 0 O-C-N 124.518 1.136 . . . . 74.510000000000005 109.252 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.905 ' HG3' HD22 ' A' ' 189' ' ' LEU . 18.6 Cg_endo -74.95 107.1 2.4 Favored 'Trans proline' 0 C--N 1.359 1.126 0 O-C-N 124.51 1.795 . . . . 71.439999999999998 111.003 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . 0.653 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.8 ttt -82.52 157.66 23.46 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.427 1.079 . . . . 72.049999999999997 110.982 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . 0.436 ' N ' ' HG2' ' A' ' 173' ' ' MET . 29.4 mmm-85 -108.98 113.67 59.08 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.498 1.124 . . . . 74.109999999999999 110.314 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' PRO . . . . . 0.448 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.3 Cg_endo -74.99 146.39 32.61 Favored 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.451 1.764 . . . . 55.219999999999999 111.013 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.572 HD13 ' N ' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -82.32 -40.77 20.97 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.534 1.146 . . . . 73.540000000000006 109.251 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -72.18 -28.63 63.34 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 124.535 1.147 . . . . 65.319999999999993 109.293 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' ASN . . . . . 0.612 ' OD1' HG23 ' A' ' 140' ' ' THR . 4.7 m-80 -110.77 99.2 41.06 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.53 1.144 . . . . 73.409999999999997 109.255 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 135.49 19.15 Favored 'Trans proline' 0 C--N 1.359 1.111 0 O-C-N 124.449 1.763 . . . . 43.399999999999999 111.019 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.604 HD12 ' OG1' ' A' ' 185' ' ' THR . 0.4 OUTLIER -141.2 96.99 7.0 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.463 1.102 . . . . 71.209999999999994 109.364 179.973 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.01 171.35 18.51 Favored 'Trans proline' 0 C--N 1.359 1.121 0 O-C-N 124.529 1.804 . . . . 62.399999999999999 110.978 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . 0.5 ' CG ' ' OE1' ' A' ' 190' ' ' GLN . 50.0 mtm-85 -62.74 -23.57 67.25 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.55 1.156 . . . . 74.099999999999994 110.305 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -72.02 -5.17 33.13 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.499 1.125 . . . . 60.509999999999998 110.279 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 184' ' ' ARG . . . . . 0.484 ' O ' HD11 ' A' ' 180' ' ' LEU . 15.6 mmt85 -128.94 4.95 5.38 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.478 1.111 . . . . 65.329999999999998 110.274 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 185' ' ' THR . . . . . 0.604 ' OG1' HD12 ' A' ' 180' ' ' LEU . 51.5 m -110.97 143.8 29.05 Favored Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.49 1.119 . . . . 74.0 110.36 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . 0.7 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -75.05 146.91 33.03 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.556 1.819 . . . . 72.439999999999998 111.018 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 187' ' ' PHE . . . . . 0.457 ' O ' HG23 ' A' ' 191' ' ' THR . 38.6 p90 -63.05 -11.49 19.79 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.447 1.092 . . . . 73.439999999999998 111.031 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -87.78 -54.03 4.46 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.51 1.131 . . . . 71.019999999999996 109.313 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.905 HD22 ' HG3' ' A' ' 172' ' ' PRO . 23.0 mt -73.31 -19.0 61.14 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.504 1.127 . . . . 64.030000000000001 109.311 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 190' ' ' GLN . . . . . 0.5 ' OE1' ' CG ' ' A' ' 182' ' ' ARG . 6.7 tt0 -84.84 -2.2 57.45 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.485 1.115 . . . . 64.109999999999999 110.297 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 191' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 187' ' ' PHE . 41.2 p -126.38 1.83 7.0 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.509 1.13 . . . . 53.340000000000003 110.399 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.497 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 12.9 mt -94.25 163.94 2.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.547 1.154 . . . . 74.239999999999995 109.309 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 193' ' ' ASN . . . . . 0.491 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 58.8 t30 -78.07 57.53 1.81 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.52 1.138 . . . . 64.049999999999997 109.319 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . 0.857 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -61.11 177.16 0.36 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.485 1.116 . . . . 65.329999999999998 109.324 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 195' ' ' LEU . . . . . 0.935 HD23 HD12 ' A' ' 209' ' ' ILE . 0.2 OUTLIER -108.29 152.89 24.01 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.523 1.139 . . . . 64.519999999999996 109.26 -179.932 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . 0.55 ' H ' HD13 ' A' ' 195' ' ' LEU . 99.1 mt-10 -144.47 137.09 26.69 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.535 1.147 . . . . 53.210000000000001 110.341 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.475 ' HG3' ' CD1' ' A' ' 176' ' ' LEU . 0.8 OUTLIER -111.06 -12.0 14.23 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.431 1.082 . . . . 74.299999999999997 110.29 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . 0.457 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 1.4 pt-20 -95.22 13.24 26.14 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.482 1.114 . . . . 64.310000000000002 110.318 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 1.7 t -118.18 164.96 14.39 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.541 1.151 . . . . 73.25 110.005 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -78.59 -26.5 45.49 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.51 1.131 . . . . 74.120000000000005 110.298 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -87.08 13.08 60.42 Favored Glycine 0 CA--C 1.53 1.009 0 O-C-N 124.45 1.094 . . . . 74.310000000000002 111.026 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 202' ' ' PHE . . . . . 0.774 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.0 OUTLIER -52.61 -45.74 96.04 Favored Pre-proline 0 C--N 1.325 -0.458 0 O-C-N 124.423 0.72 . . . . 72.25 110.986 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 203' ' ' PRO . . . . . 0.592 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.2 Cg_endo -74.97 -34.8 3.58 Favored 'Trans proline' 0 C--N 1.359 1.116 0 O-C-N 124.562 1.822 . . . . 54.539999999999999 111.014 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -57.45 -56.0 27.47 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.448 1.092 . . . . 61.009999999999998 110.358 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -63.61 -36.65 84.51 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.467 1.104 . . . . 74.510000000000005 110.33 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 206' ' ' VAL . . . . . 0.939 HG11 ' CE2' ' A' ' 104' ' ' PHE . 37.7 t -63.86 -37.09 78.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 O-C-N 124.491 1.119 . . . . 74.400000000000006 109.329 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 207' ' ' GLU . . . . . 0.435 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 4.3 mt-10 -69.68 -49.49 53.01 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.545 1.153 . . . . 72.329999999999998 110.305 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 80.0 mtt-85 -67.21 -66.25 0.58 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.476 1.11 . . . . 70.239999999999995 110.271 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 209' ' ' ILE . . . . . 0.935 HD12 HD23 ' A' ' 195' ' ' LEU . 45.4 mt -43.46 -57.78 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.53 1.144 . . . . 70.109999999999999 109.309 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 210' ' ' PHE . . . . . 0.83 ' CD1' HG22 ' A' ' 209' ' ' ILE . 3.2 m-85 -102.53 69.45 1.1 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.54 1.15 . . . . 62.219999999999999 110.967 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 211' ' ' GLN . . . . . 0.468 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -110.83 143.26 41.69 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.457 1.098 . . . . 61.140000000000001 110.3 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.454 ' O ' ' N ' ' A' ' 215' ' ' TYR . 29.2 tt0 -50.09 -53.74 25.21 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.541 1.15 . . . . 71.219999999999999 110.246 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -48.56 -23.53 1.02 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.482 1.114 . . . . 71.439999999999998 109.983 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.468 HG23 ' HG2' ' A' ' 211' ' ' GLN . 20.4 t -95.14 -29.56 4.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 O-C-N 124.499 1.124 . . . . 71.019999999999996 109.26 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 215' ' ' TYR . . . . . 0.461 ' OH ' ' CD2' ' A' ' 78' ' ' PHE . 9.4 t80 -61.92 -19.01 62.25 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.476 1.11 . . . . 72.150000000000006 111.039 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . 0.42 ' N ' ' HD2' ' A' ' 216' ' ' LYS . 16.5 mmmt -76.13 -44.52 38.06 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.539 1.149 . . . . 75.120000000000005 109.245 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 217' ' ' THR . . . . . 0.871 HG22 HD11 ' A' ' 221' ' ' ILE . 74.7 m -59.63 -66.43 0.51 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.5 1.125 . . . . 44.009999999999998 110.445 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 218' ' ' GLN . . . . . 0.425 ' NE2' ' N ' ' A' ' 218' ' ' GLN . 0.0 OUTLIER -51.34 -28.31 12.01 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.486 1.117 . . . . 73.200000000000003 110.32 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 219' ' ' GLN . . . . . 0.426 ' NE2' ' HD2' ' A' ' 223' ' ' LYS . 33.3 tp60 -67.96 -55.57 12.25 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.54 1.15 . . . . 74.5 110.263 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.6 m -62.31 -36.4 82.05 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.534 1.146 . . . . 63.310000000000002 110.392 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 221' ' ' ILE . . . . . 0.871 HD11 HG22 ' A' ' 217' ' ' THR . 20.3 mt -66.87 -18.91 24.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.519 1.137 . . . . 74.230000000000004 109.302 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 222' ' ' TRP . . . . . 1.027 ' O ' HG22 ' A' ' 225' ' ' THR . 11.8 t90 -69.89 -64.68 0.84 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.517 1.135 . . . . 71.219999999999999 107.958 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.492 ' CB ' ' HZ2' ' A' ' 223' ' ' LYS . 0.0 OUTLIER -54.14 -31.21 51.81 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.509 1.13 . . . . 73.209999999999994 109.247 -179.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.81 -42.64 70.01 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.498 1.124 . . . . 75.409999999999997 110.301 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 1.027 HG22 ' O ' ' A' ' 222' ' ' TRP . 5.4 t -57.3 -23.77 50.66 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.523 1.139 . . . . 65.420000000000002 110.405 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 16.8 mtm180 -77.62 -22.48 50.71 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.485 1.116 . . . . 72.510000000000005 110.342 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 227' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -85.12 -35.56 21.7 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.471 1.107 . . . . 74.310000000000002 109.294 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 228' ' ' MET . . . . . 0.436 ' CE ' ' HA ' ' A' ' 225' ' ' THR . 55.1 mtm -60.68 -45.2 95.08 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.51 1.131 . . . . 63.219999999999999 110.993 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 229' ' ' VAL . . . . . 0.462 HG23 ' N ' ' A' ' 230' ' ' GLN . 31.0 m -63.77 -49.4 82.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.529 1.143 . . . . 75.150000000000006 109.323 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 230' ' ' GLN . . . . . 0.462 ' N ' HG23 ' A' ' 229' ' ' VAL . 2.5 tp60 -71.39 -6.67 41.94 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.497 1.123 . . . . 73.530000000000001 110.3 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 17.9 ttt85 -90.98 -85.72 0.22 Allowed 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.558 1.161 . . . . 73.129999999999995 110.239 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 6.0 tm0? -138.98 39.12 2.14 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.597 1.186 . . . . 65.25 110.269 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -151.52 37.68 0.6 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.474 1.109 . . . . 73.409999999999997 111.012 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 5.8 mm -47.87 140.67 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.492 1.12 . . . . 71.129999999999995 109.358 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.481 0 O-C-N 124.559 1.162 . . . . 54.009999999999998 109.349 179.975 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.001 0 N-CA-C 110.988 -0.845 . . . . 61.0 110.988 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.9 141.86 27.47 Favored 'Trans proline' 0 C--N 1.36 1.182 0 O-C-N 124.494 1.787 . . . . 55.219999999999999 111.04 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.572 HD13 ' N ' ' A' ' 73' ' ' GLY . 0.7 OUTLIER -100.1 128.78 46.12 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.501 1.126 . . . . 74.25 109.327 179.918 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.572 ' N ' HD13 ' A' ' 72' ' ' LEU . . . 42.09 73.77 0.2 Allowed Glycine 0 CA--C 1.53 0.983 0 O-C-N 124.548 1.155 . . . . 74.439999999999998 111.02 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.7 p -123.34 131.63 53.72 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.485 0.756 . . . . 71.239999999999995 110.042 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.401 ' HG3' ' N ' ' A' ' 76' ' ' GLU . 50.1 tp10 -81.88 152.64 26.75 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.514 1.134 . . . . 72.239999999999995 110.313 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.476 ' OE2' ' CH2' ' A' ' 222' ' ' TRP . 0.1 OUTLIER -124.27 157.06 35.79 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.476 1.11 . . . . 74.25 110.296 -179.986 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.444 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 2.4 p -179.83 151.05 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.418 1.074 . . . . 61.340000000000003 109.295 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.553 ' CE2' ' HD3' ' A' ' 108' ' ' PRO . 48.2 p90 -96.22 40.33 1.13 Allowed 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.556 1.16 . . . . 74.010000000000005 111.003 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.475 HD11 HG22 ' A' ' 110' ' ' ILE . 3.0 tp -39.97 133.82 1.59 Allowed 'General case' 0 C--N 1.323 -0.553 0 O-C-N 124.52 1.138 . . . . 65.329999999999998 109.258 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.964 ' NZ ' HG23 ' A' ' 106' ' ' ILE . 9.2 mmmm -57.04 -66.35 0.47 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.483 1.114 . . . . 55.240000000000002 109.317 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.605 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 2.2 p90 -166.32 179.81 5.43 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.585 1.178 . . . . 72.129999999999995 111.001 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 1.047 HG11 ' HB1' ' A' ' 128' ' ' ALA . 0.8 OUTLIER -111.73 149.91 14.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.433 1.083 . . . . 71.420000000000002 109.318 179.999 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.892 ' CG2' ' HB1' ' A' ' 93' ' ' ALA . 4.9 mp -121.2 89.51 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.533 1.145 . . . . 72.420000000000002 109.252 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.893 HD21 ' CB ' ' A' ' 128' ' ' ALA . 6.2 mt -70.24 121.79 18.27 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.568 1.168 . . . . 71.409999999999997 109.35 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.823 ' CD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -144.14 174.64 10.7 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.541 1.151 . . . . 75.209999999999994 109.552 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.478 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -111.99 164.35 13.23 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.474 1.109 . . . . 70.150000000000006 109.279 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -63.04 -12.27 25.19 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.502 1.126 . . . . 73.519999999999996 110.244 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -82.33 -46.12 14.02 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.481 1.113 . . . . 64.439999999999998 109.273 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -120.71 44.33 2.52 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.452 1.095 . . . . 71.430000000000007 109.293 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.607 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -76.85 -25.66 53.41 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.457 1.098 . . . . 74.510000000000005 110.347 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -85.79 -21.75 28.01 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.453 1.096 . . . . 72.349999999999994 109.314 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -73.18 -45.67 55.11 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.56 1.163 . . . . 72.439999999999998 110.338 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.892 ' HB1' ' CG2' ' A' ' 83' ' ' ILE . . . -70.14 -31.43 68.93 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.464 1.103 . . . . 71.409999999999997 109.352 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.941 ' HB2' HD13 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -73.1 -52.82 12.84 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.51 1.131 . . . . 74.5 109.311 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.663 ' N ' HD13 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -43.23 -37.25 2.07 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.46 1.1 . . . . 73.209999999999994 110.328 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.805 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.3 t -73.42 -64.76 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.512 1.133 . . . . 64.439999999999998 109.315 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.486 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -40.6 -26.86 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.53 1.144 . . . . 64.430000000000007 110.319 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.454 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.0 OUTLIER -73.21 -60.18 2.36 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.521 1.138 . . . . 62.229999999999997 109.287 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.841 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -62.61 -22.11 66.16 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.504 1.127 . . . . 73.120000000000005 109.282 179.995 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.841 ' N ' HD23 ' A' ' 99' ' ' LEU . 28.5 mt -67.75 -43.23 80.35 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.415 1.072 . . . . 61.219999999999999 109.272 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -86.41 46.73 1.38 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.567 1.167 . . . . 64.409999999999997 110.272 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -166.68 -63.74 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.574 1.171 . . . . 61.240000000000002 109.247 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.551 ' OD1' ' CE2' ' A' ' 104' ' ' PHE . 22.4 t70 -46.55 -46.46 19.38 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.55 1.156 . . . . 63.310000000000002 109.297 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.911 ' CE1' HG11 ' A' ' 206' ' ' VAL . 0.4 OUTLIER -116.26 -31.87 5.5 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.514 1.134 . . . . 74.019999999999996 110.96 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.444 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 100.73 44.63 2.07 Favored Glycine 0 CA--C 1.531 1.049 0 O-C-N 124.519 1.137 . . . . 74.129999999999995 110.986 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.964 HG23 ' NZ ' ' A' ' 80' ' ' LYS . 6.1 mm -84.95 70.11 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.556 0.798 . . . . 73.510000000000005 109.308 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.541 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -120.92 155.48 57.52 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.468 1.105 . . . . 74.420000000000002 109.272 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.553 ' HD3' ' CE2' ' A' ' 78' ' ' PHE . 18.1 Cg_endo -74.97 160.76 96.07 Favored 'Cis proline' 0 C--N 1.36 1.176 0 C-N-CA 120.927 -2.53 . . . . 74.140000000000001 111.022 -0.052 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -136.56 137.11 8.81 Favored Glycine 0 CA--C 1.53 0.985 0 O-C-N 124.498 1.124 . . . . 65.409999999999997 111.028 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.544 HD11 ' O ' ' A' ' 114' ' ' GLU . 2.5 tt -148.2 152.09 12.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.529 0.782 . . . . 65.200000000000003 109.263 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.941 HD13 ' HB2' ' A' ' 94' ' ' LEU . 40.9 pt -101.22 167.33 2.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.426 1.079 . . . . 50.409999999999997 109.31 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.802 ' CD1' HD23 ' A' ' 84' ' ' LEU . 2.7 t80 -66.88 -19.24 65.7 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.481 1.113 . . . . 55.539999999999999 111.0 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -90.69 -6.64 54.23 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.552 1.157 . . . . 73.109999999999999 109.324 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.544 ' O ' HD11 ' A' ' 110' ' ' ILE . 12.2 mm-40 -110.64 -5.91 14.95 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.495 1.122 . . . . 72.299999999999997 110.3 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 10.8 ttm -61.4 110.94 3.54 Favored Pre-proline 0 C--N 1.325 -0.457 0 O-C-N 124.456 1.097 . . . . 74.430000000000007 110.958 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.95 70.52 5.23 Favored 'Trans proline' 0 C--N 1.359 1.128 0 O-C-N 124.497 1.788 . . . . 51.039999999999999 111.0 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 17.7 p-80 -79.82 -44.54 20.37 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.403 1.064 . . . . 75.329999999999998 109.546 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 109.42 -110.3 2.93 Favored Glycine 0 CA--C 1.531 1.033 0 O-C-N 124.424 1.078 . . . . 72.209999999999994 110.957 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -106.37 -9.72 16.63 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.496 0.762 . . . . 72.010000000000005 110.307 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -61.54 165.48 4.86 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.409 1.068 . . . . 55.350000000000001 110.283 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -84.46 126.18 33.04 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.544 1.153 . . . . 71.519999999999996 109.583 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.773 HD12 ' CE2' ' A' ' 112' ' ' PHE . 0.3 OUTLIER -79.79 -23.41 42.16 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.479 1.112 . . . . 71.230000000000004 109.262 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 21.1 mp0 -38.93 -33.75 0.13 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.455 1.097 . . . . 53.439999999999998 110.274 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 18.6 m-20 -56.31 98.16 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.551 1.157 . . . . 43.229999999999997 109.336 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.591 ' CD1' HD23 ' A' ' 157' ' ' LEU . 4.2 pp -83.55 -17.36 42.06 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.401 1.063 . . . . 73.340000000000003 109.303 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.44 ' O ' ' N ' ' A' ' 129' ' ' VAL . 11.9 p-10 -63.85 -42.34 97.61 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.494 1.121 . . . . 70.030000000000001 109.313 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -48.98 -32.92 9.98 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.509 1.131 . . . . 74.040000000000006 109.307 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 1.047 ' HB1' HG11 ' A' ' 82' ' ' VAL . . . -68.44 -36.2 78.7 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.522 1.138 . . . . 72.319999999999993 109.311 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.673 HG12 ' O ' ' A' ' 129' ' ' VAL . 53.9 t -89.12 14.2 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.478 1.111 . . . . 63.100000000000001 109.29 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -129.27 120.84 26.39 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.544 1.153 . . . . 71.150000000000006 109.265 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 88.2 -20.12 31.41 Favored Glycine 0 CA--C 1.53 0.973 0 O-C-N 124.506 1.129 . . . . 35.100000000000001 110.994 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 39.2 m -87.95 151.67 22.63 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.522 0.777 . . . . 62.43 110.027 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.785 ' HB3' ' O ' ' A' ' 80' ' ' LYS . . . -94.44 -9.69 34.76 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.454 1.096 . . . . 71.219999999999999 109.308 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.597 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 9.7 m-90 -161.91 173.7 14.14 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.524 1.14 . . . . 73.420000000000002 107.981 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.946 HG22 HG12 ' A' ' 82' ' ' VAL . 11.8 p -153.29 131.26 11.76 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 124.528 1.143 . . . . 61.409999999999997 110.436 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.763 ' C ' HD23 ' A' ' 137' ' ' LEU . 21.5 mm -93.21 134.62 30.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 124.552 1.158 . . . . 64.010000000000005 109.292 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.884 ' O ' HD22 ' A' ' 139' ' ' LEU . 5.2 mt -113.64 85.49 2.21 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.499 1.124 . . . . 72.040000000000006 109.263 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.777 HD22 ' HB2' ' A' ' 93' ' ' ALA . 1.8 tp -62.65 90.14 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.575 1.172 . . . . 64.310000000000002 109.33 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.884 HD22 ' O ' ' A' ' 137' ' ' LEU . 0.7 OUTLIER -70.44 116.69 11.06 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.541 1.15 . . . . 34.299999999999997 109.272 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.421 ' HB ' ' CB ' ' A' ' 143' ' ' PHE . 6.8 m -139.22 157.87 45.17 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.43 1.082 . . . . 60.100000000000001 110.352 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -50.24 -40.96 49.23 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.477 1.111 . . . . 62.200000000000003 110.271 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -89.27 -52.18 5.19 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.509 1.13 . . . . 73.150000000000006 109.337 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 1.007 ' CE1' HG21 ' A' ' 147' ' ' THR . 29.0 t80 -52.18 -20.16 2.42 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.483 1.114 . . . . 72.120000000000005 111.018 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.695 ' C ' HD13 ' A' ' 144' ' ' LEU . 1.9 tm? -72.14 -67.54 0.53 Allowed 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.518 1.136 . . . . 75.239999999999995 109.282 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.445 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 25.4 mmm180 -52.75 -23.1 6.11 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.59 1.181 . . . . 70.349999999999994 110.302 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -75.69 -73.11 0.28 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.521 1.138 . . . . 64.540000000000006 109.265 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 1.007 HG21 ' CE1' ' A' ' 143' ' ' PHE . 47.2 p -57.42 -56.18 25.24 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.428 1.08 . . . . 64.140000000000001 110.403 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.494 ' CH2' ' HB3' ' A' ' 186' ' ' PRO . 4.6 t-105 -43.9 -42.2 5.67 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.558 1.161 . . . . 73.409999999999997 108.01 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . 0.445 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 12.6 t -67.88 -45.4 74.58 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.486 1.116 . . . . 44.240000000000002 108.279 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.454 ' N ' ' O ' ' A' ' 147' ' ' THR . 34.2 m-20 -52.23 -61.96 1.94 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.5 1.125 . . . . 70.430000000000007 109.309 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.869 ' CE1' HD12 ' A' ' 157' ' ' LEU . 9.8 m-30 -38.46 -45.88 1.09 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.437 1.086 . . . . 63.340000000000003 110.971 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.27 -48.84 45.66 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.544 1.153 . . . . 65.420000000000002 110.31 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -88.06 -11.72 46.34 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.538 1.148 . . . . 73.530000000000001 111.041 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.4 ' N ' ' O ' ' A' ' 150' ' ' ASN . 3.2 m-30 -116.67 77.36 1.1 Allowed 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.437 1.086 . . . . 74.439999999999998 110.995 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.444 ' O ' ' ND2' ' A' ' 159' ' ' ASN . 1.1 t -61.82 -13.41 23.71 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.538 1.149 . . . . 64.329999999999998 110.448 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 13.1 m -71.53 -32.26 67.96 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.461 1.1 . . . . 74.340000000000003 110.017 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.869 HD12 ' CE1' ' A' ' 151' ' ' PHE . 0.4 OUTLIER -74.1 -47.21 37.86 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.566 1.166 . . . . 53.009999999999998 109.322 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' MET . . . . . 0.623 ' CE ' HG21 ' A' ' 161' ' ' VAL . 1.9 tpt -48.76 -23.01 0.91 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.485 1.115 . . . . 71.420000000000002 111.083 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' ASN . . . . . 0.528 ' N ' HD22 ' A' ' 159' ' ' ASN . 1.5 m-80 -77.84 -42.79 32.41 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.528 1.143 . . . . 71.25 109.271 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.542 ' CB ' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -63.16 -22.79 67.1 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.484 1.115 . . . . 74.030000000000001 110.011 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . 0.623 HG21 ' CE ' ' A' ' 158' ' ' MET . 41.9 t -57.41 -17.87 7.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.489 1.118 . . . . 70.109999999999999 109.315 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -90.96 21.5 4.16 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.621 1.201 . . . . 73.430000000000007 109.288 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.483 ' CD ' ' O ' ' A' ' 170' ' ' VAL . 0.0 OUTLIER 46.6 37.12 4.16 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.5 1.125 . . . . 73.329999999999998 110.327 -179.94 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' A' ' 163' ' ' ARG . 5.0 mt-30 -38.3 131.31 1.19 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.483 1.114 . . . . 73.230000000000004 110.295 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 12.6 m170 -90.1 57.4 3.76 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.518 1.136 . . . . 75.510000000000005 109.587 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.608 ' HA ' HG21 ' A' ' 221' ' ' ILE . 0.0 OUTLIER -118.25 89.7 3.18 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.534 1.146 . . . . 64.329999999999998 109.24 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' TYR . . . . . 0.603 ' CD1' ' O ' ' A' ' 166' ' ' LYS . 12.7 p90 36.61 32.98 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.571 1.17 . . . . 75.200000000000003 111.047 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.439 ' ND2' ' O ' ' A' ' 129' ' ' VAL . 27.0 p30 178.48 156.97 0.45 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.548 1.155 . . . . 75.019999999999996 109.277 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.576 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 0.4 OUTLIER -140.05 176.99 8.29 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.494 1.121 . . . . 42.030000000000001 109.969 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.902 ' O ' HD12 ' A' ' 171' ' ' ILE . 65.3 t -131.34 120.57 46.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.563 1.164 . . . . 71.439999999999998 109.272 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.902 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.3 mp -136.37 105.42 9.31 Favored Pre-proline 0 C--N 1.325 -0.468 0 O-C-N 124.497 1.123 . . . . 70.420000000000002 109.359 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.674 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.5 Cg_endo -74.95 112.96 3.68 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.507 1.793 . . . . 44.439999999999998 111.041 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . 0.805 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.7 ttt -89.16 160.67 16.87 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.576 1.173 . . . . 64.219999999999999 110.96 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . 0.423 ' N ' ' HG2' ' A' ' 173' ' ' MET . 0.0 OUTLIER -123.48 119.05 27.35 Favored Pre-proline 0 C--N 1.325 -0.48 0 O-C-N 124.531 1.144 . . . . 73.049999999999997 110.296 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' PRO . . . . . 0.636 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -75.05 155.05 42.68 Favored 'Trans proline' 0 C--N 1.36 1.142 0 O-C-N 124.5 1.79 . . . . 71.109999999999999 110.983 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 1.018 HD21 ' CG ' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -98.18 -36.87 9.91 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.584 1.177 . . . . 75.120000000000005 109.319 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . 0.547 HD22 ' N ' ' A' ' 177' ' ' ASN . 1.1 m-80 -72.68 -23.02 60.83 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.504 1.127 . . . . 53.200000000000003 109.278 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -110.35 113.09 56.61 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.409 1.068 . . . . 71.099999999999994 109.292 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.05 115.02 4.16 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.536 1.808 . . . . 62.020000000000003 110.958 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.539 HD13 ' HB2' ' A' ' 184' ' ' ARG . 0.8 OUTLIER -132.86 96.62 17.88 Favored Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.537 1.148 . . . . 61.399999999999999 109.342 179.939 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' PRO . . . . . 0.424 ' HG2' ' CG ' ' A' ' 183' ' ' GLU . 18.3 Cg_endo -74.98 164.21 33.83 Favored 'Trans proline' 0 C--N 1.361 1.203 0 O-C-N 124.455 1.766 . . . . 52.219999999999999 111.025 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . 0.424 ' HG3' ' N ' ' A' ' 183' ' ' GLU . 0.7 OUTLIER -51.88 -35.16 44.16 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.446 1.091 . . . . 73.099999999999994 110.329 -179.985 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . 0.424 ' CG ' ' HG2' ' A' ' 181' ' ' PRO . 4.7 pt-20 -56.8 -32.01 65.25 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.54 1.15 . . . . 55.140000000000001 110.324 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 184' ' ' ARG . . . . . 0.539 ' HB2' HD13 ' A' ' 180' ' ' LEU . 5.7 mmp_? -87.96 -28.6 21.37 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.476 1.11 . . . . 75.519999999999996 110.236 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 185' ' ' THR . . . . . 0.494 HG22 ' HD2' ' A' ' 186' ' ' PRO . 21.2 m -77.27 144.03 70.3 Favored Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.477 1.111 . . . . 73.129999999999995 110.454 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . 0.701 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -74.93 152.33 41.0 Favored 'Trans proline' 0 C--N 1.36 1.167 0 O-C-N 124.508 1.793 . . . . 64.200000000000003 111.02 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 187' ' ' PHE . . . . . 0.483 ' O ' ' CG2' ' A' ' 191' ' ' THR . 13.2 p90 -68.22 -6.79 25.48 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.517 1.135 . . . . 72.409999999999997 111.0 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.75 -53.84 3.86 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.528 1.143 . . . . 63.420000000000002 109.267 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.701 HD12 ' CG ' ' A' ' 186' ' ' PRO . 49.3 mt -68.5 -42.21 78.91 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.455 1.097 . . . . 74.010000000000005 109.306 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 190' ' ' GLN . . . . . 0.402 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.1 pt20 -63.31 -11.5 22.52 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.5 1.125 . . . . 72.239999999999995 110.293 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 191' ' ' THR . . . . . 0.483 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 32.5 p -112.67 2.4 16.1 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.49 1.118 . . . . 74.120000000000005 110.353 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.49 ' CG2' ' N ' ' A' ' 193' ' ' ASN . 30.9 mt -105.31 163.36 4.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.461 1.101 . . . . 72.340000000000003 109.36 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 193' ' ' ASN . . . . . 0.49 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 22.7 p30 -66.8 74.78 0.11 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.507 1.129 . . . . 74.010000000000005 109.301 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . 0.674 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -70.04 156.36 39.27 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.557 1.16 . . . . 52.530000000000001 109.342 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 195' ' ' LEU . . . . . 0.725 HD23 ' CD1' ' A' ' 209' ' ' ILE . 0.3 OUTLIER -95.83 127.58 41.98 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.474 1.109 . . . . 72.310000000000002 109.256 -179.967 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . 0.402 ' HB3' ' CB ' ' A' ' 199' ' ' SER . 45.3 mt-10 -108.42 130.42 55.24 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.543 1.152 . . . . 73.019999999999996 110.292 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 1.018 ' CG ' HD21 ' A' ' 176' ' ' LEU . 25.2 tp10 -100.53 -23.14 14.77 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.509 1.131 . . . . 72.519999999999996 110.305 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . 0.508 ' HB3' HD12 ' A' ' 176' ' ' LEU . 0.4 OUTLIER -104.95 15.33 27.91 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.527 1.142 . . . . 64.239999999999995 110.292 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . 0.402 ' CB ' ' HB3' ' A' ' 196' ' ' GLU . 40.2 t -104.54 139.78 38.94 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.437 1.086 . . . . 73.219999999999999 110.023 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 21.5 ttp180 -59.47 -15.34 16.86 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.538 1.149 . . . . 75.319999999999993 110.315 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -102.89 17.61 52.15 Favored Glycine 0 CA--C 1.531 1.047 0 O-C-N 124.543 1.152 . . . . 44.219999999999999 110.928 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 202' ' ' PHE . . . . . 0.8 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.1 OUTLIER -54.16 -44.49 98.58 Favored Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 124.535 0.785 . . . . 65.209999999999994 111.019 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 203' ' ' PRO . . . . . 0.601 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.2 Cg_endo -74.99 -34.98 3.42 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.542 1.811 . . . . 75.209999999999994 110.994 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.98 -51.03 70.86 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.538 1.149 . . . . 53.140000000000001 110.411 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 205' ' ' GLN . . . . . 0.401 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 6.2 mt-30 -69.53 -33.04 72.23 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.495 1.122 . . . . 71.510000000000005 110.3 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 206' ' ' VAL . . . . . 0.911 HG11 ' CE1' ' A' ' 104' ' ' PHE . 50.5 t -70.28 -29.68 40.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.564 1.165 . . . . 61.119999999999997 109.287 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 207' ' ' GLU . . . . . 0.504 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 3.9 mt-10 -77.92 -36.67 49.16 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.544 1.152 . . . . 74.109999999999999 110.335 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -78.79 -62.93 1.54 Allowed 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.459 1.099 . . . . 72.239999999999995 110.279 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 209' ' ' ILE . . . . . 0.825 HG22 ' CD1' ' A' ' 210' ' ' PHE . 81.3 mt -47.83 -61.13 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.443 1.09 . . . . 73.439999999999998 109.325 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 210' ' ' PHE . . . . . 0.825 ' CD1' HG22 ' A' ' 209' ' ' ILE . 3.9 m-85 -97.42 67.36 2.09 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.519 1.137 . . . . 75.340000000000003 111.012 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 211' ' ' GLN . . . . . 0.504 ' CB ' ' O ' ' A' ' 207' ' ' GLU . 0.0 OUTLIER -110.98 141.09 44.92 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.502 1.126 . . . . 71.129999999999995 110.372 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.454 ' O ' ' N ' ' A' ' 215' ' ' TYR . 25.6 tt0 -51.97 -51.52 56.63 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.528 1.142 . . . . 71.530000000000001 110.255 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.42 -23.16 0.85 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.443 1.09 . . . . 64.120000000000005 109.943 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.432 HG23 ' HG2' ' A' ' 211' ' ' GLN . 17.4 t -95.47 -30.19 4.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 O-C-N 124.603 1.189 . . . . 73.030000000000001 109.301 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 215' ' ' TYR . . . . . 0.454 ' N ' ' O ' ' A' ' 212' ' ' GLU . 13.7 t80 -64.64 -20.37 66.25 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.586 1.178 . . . . 74.319999999999993 111.025 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 4.8 mmpt? -69.37 -54.88 12.27 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.468 1.105 . . . . 72.299999999999997 109.305 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 217' ' ' THR . . . . . 0.796 HG22 HD11 ' A' ' 221' ' ' ILE . 2.2 m -49.13 -67.52 0.26 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.506 1.129 . . . . 74.239999999999995 110.409 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 218' ' ' GLN . . . . . 0.947 ' HA ' HD12 ' A' ' 221' ' ' ILE . 0.0 OUTLIER -50.32 -43.64 53.86 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.493 1.12 . . . . 75.340000000000003 110.252 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 219' ' ' GLN . . . . . 0.402 ' CB ' ' O ' ' A' ' 215' ' ' TYR . 38.2 tp60 -52.3 -37.87 56.92 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.505 1.128 . . . . 73.409999999999997 110.284 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 22.7 m -79.6 -35.17 40.0 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.429 1.081 . . . . 73.040000000000006 110.381 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 221' ' ' ILE . . . . . 0.947 HD12 ' HA ' ' A' ' 218' ' ' GLN . 10.9 mt -66.03 -27.24 40.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 O-C-N 124.443 1.09 . . . . 71.209999999999994 109.32 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 222' ' ' TRP . . . . . 0.697 ' O ' HG22 ' A' ' 225' ' ' THR . 24.1 t90 -89.11 -49.18 6.9 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.498 1.124 . . . . 54.43 107.991 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.462 ' CD ' ' C ' ' A' ' 223' ' ' LYS . 0.0 OUTLIER -60.47 -16.77 39.91 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.532 1.145 . . . . 73.0 109.283 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -93.13 -35.4 13.2 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.554 1.159 . . . . 61.130000000000003 110.309 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.697 HG22 ' O ' ' A' ' 222' ' ' TRP . 3.3 t -65.96 -16.09 63.58 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.483 1.114 . . . . 74.25 110.412 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 10.7 mtm180 -72.85 -14.72 61.56 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.503 1.127 . . . . 71.040000000000006 110.269 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 227' ' ' ASN . . . . . 0.44 ' O ' ' N ' ' A' ' 231' ' ' ARG . 1.1 m-80 -85.4 -64.41 1.16 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.498 1.124 . . . . 73.239999999999995 109.301 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 228' ' ' MET . . . . . 0.432 ' HG3' HG13 ' A' ' 229' ' ' VAL . 17.4 ptp -38.41 -42.79 0.76 Allowed 'General case' 0 C--N 1.323 -0.549 0 O-C-N 124.553 1.158 . . . . 53.439999999999998 110.988 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 229' ' ' VAL . . . . . 0.483 HG23 ' N ' ' A' ' 230' ' ' GLN . 19.6 m -67.15 -50.33 64.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.545 1.153 . . . . 55.130000000000003 109.296 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 230' ' ' GLN . . . . . 0.483 ' N ' HG23 ' A' ' 229' ' ' VAL . 2.2 tp-100 -70.32 -6.62 36.44 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.503 1.127 . . . . 75.310000000000002 110.272 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 231' ' ' ARG . . . . . 0.44 ' N ' ' O ' ' A' ' 227' ' ' ASN . 14.9 tpt180 -95.9 -79.82 0.43 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.528 1.143 . . . . 65.019999999999996 110.254 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -146.25 53.37 1.13 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.501 1.126 . . . . 74.340000000000003 110.268 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 233' ' ' PHE . . . . . 0.597 ' O ' HD13 ' A' ' 234' ' ' ILE . 0.4 OUTLIER -165.73 -173.12 2.6 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.503 1.127 . . . . 72.099999999999994 111.064 179.941 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.597 HD13 ' O ' ' A' ' 233' ' ' PHE . 7.5 mm -138.55 161.18 30.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.469 1.106 . . . . 71.219999999999999 109.308 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.47 0 O-C-N 124.542 1.151 . . . . 75.310000000000002 109.288 179.99 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.006 0 N-CA-C 111.018 -0.833 . . . . 61.530000000000001 111.018 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.97 145.04 31.07 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.536 1.809 . . . . 72.230000000000004 111.039 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.541 HD13 ' N ' ' A' ' 73' ' ' GLY . 0.4 OUTLIER -110.5 121.58 45.65 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.393 1.058 . . . . 65.129999999999995 109.278 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.541 ' N ' HD13 ' A' ' 72' ' ' LEU . . . 71.21 59.15 5.15 Favored Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.501 1.126 . . . . 53.310000000000002 110.975 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.424 ' OG ' ' N ' ' A' ' 75' ' ' GLU . 0.8 OUTLIER -119.53 175.16 5.98 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.455 0.738 . . . . 61.310000000000002 110.027 179.976 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.424 ' N ' ' OG ' ' A' ' 74' ' ' SER . 10.2 tt0 -39.07 149.42 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.535 1.147 . . . . 73.439999999999998 110.3 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -140.54 127.85 21.15 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.468 1.105 . . . . 74.010000000000005 110.325 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.427 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 5.3 p -140.37 160.03 25.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 O-C-N 124.452 1.095 . . . . 74.420000000000002 109.303 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.49 ' CE2' ' OH ' ' A' ' 215' ' ' TYR . 5.6 t80 -88.68 24.82 1.89 Allowed 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.481 1.113 . . . . 74.299999999999997 111.004 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.407 ' C ' ' O ' ' A' ' 78' ' ' PHE . 3.2 tp -39.5 143.14 0.23 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.486 1.116 . . . . 74.409999999999997 109.269 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.6 ' O ' ' HB3' ' A' ' 133' ' ' ALA . 8.2 ttmt -79.03 -62.3 1.74 Allowed 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.522 1.139 . . . . 62.43 109.249 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.944 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.3 OUTLIER -165.47 140.09 4.87 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.563 1.164 . . . . 75.140000000000001 110.979 179.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.94 ' CG1' HG22 ' A' ' 135' ' ' THR . 7.5 p -90.69 167.49 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 O-C-N 124.428 1.08 . . . . 65.219999999999999 109.313 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.944 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 3.8 mp -132.64 92.0 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.47 1.106 . . . . 72.030000000000001 109.33 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.735 HD21 ' HB3' ' A' ' 128' ' ' ALA . 5.9 mp -70.16 113.22 7.13 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.454 1.096 . . . . 71.409999999999997 109.304 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.619 ' CB ' HD22 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -128.44 174.39 9.39 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.465 1.103 . . . . 73.219999999999999 109.661 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -113.24 162.47 15.98 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.538 1.149 . . . . 55.25 109.309 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -64.31 -11.33 31.02 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.541 1.151 . . . . 61.009999999999998 110.374 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -81.68 -45.95 15.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.482 1.114 . . . . 74.439999999999998 109.284 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.416 ' CG ' HD23 ' A' ' 138' ' ' LEU . 0.8 OUTLIER -124.58 44.21 2.82 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.441 1.088 . . . . 64.019999999999996 109.265 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.607 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -75.54 -33.89 60.71 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.456 1.098 . . . . 72.340000000000003 110.383 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -79.01 -17.21 55.75 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.537 1.148 . . . . 73.099999999999994 109.354 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -79.39 -54.04 6.32 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.548 1.155 . . . . 72.400000000000006 110.302 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.872 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -65.16 -19.75 66.12 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.473 1.108 . . . . 73.409999999999997 109.251 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.936 ' HB2' HD13 ' A' ' 111' ' ' ILE . 0.1 OUTLIER -87.96 -51.89 5.57 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.573 1.17 . . . . 64.409999999999997 109.264 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.568 ' N ' HD13 ' A' ' 94' ' ' LEU . 10.7 tpt180 -45.27 -33.32 2.33 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.514 1.133 . . . . 72.519999999999996 110.334 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.582 HG13 ' N ' ' A' ' 97' ' ' GLN . 10.7 p -82.77 -55.89 6.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.516 1.135 . . . . 72.219999999999999 109.295 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.582 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -48.24 -22.12 0.61 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.466 1.104 . . . . 73.230000000000004 110.339 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -77.21 -38.61 51.03 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.466 1.104 . . . . 73.5 109.334 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.783 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -83.08 -21.99 33.57 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.473 1.108 . . . . 72.519999999999996 109.263 -179.98 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.783 ' N ' HD23 ' A' ' 99' ' ' LEU . 71.9 mt -63.44 -51.51 65.37 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.529 1.143 . . . . 55.450000000000003 109.276 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -77.5 54.79 1.21 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.487 1.117 . . . . 64.129999999999995 110.306 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -176.3 -67.05 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.482 1.114 . . . . 70.040000000000006 109.321 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -43.57 -54.09 5.17 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.462 1.101 . . . . 51.310000000000002 109.276 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.418 ' CZ ' ' HB3' ' A' ' 203' ' ' PRO . 6.4 m-85 -107.96 -31.2 8.08 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.507 1.13 . . . . 71.430000000000007 110.992 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 104.78 41.98 1.9 Allowed Glycine 0 CA--C 1.531 1.048 0 O-C-N 124.482 1.114 . . . . 71.239999999999995 110.996 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.1 mm -82.97 79.69 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.555 0.797 . . . . 74.040000000000006 109.295 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.538 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -131.76 156.39 80.18 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.522 1.139 . . . . 73.310000000000002 109.321 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.538 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.0 160.1 97.05 Favored 'Cis proline' 0 C--N 1.36 1.168 0 C-N-CA 120.981 -2.508 . . . . 71.209999999999994 110.994 -0.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -122.7 141.48 14.03 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.466 1.104 . . . . 60.229999999999997 111.046 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -158.72 130.16 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.5 0.765 . . . . 53.340000000000003 109.275 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.936 HD13 ' HB2' ' A' ' 94' ' ' LEU . 1.9 pt -96.67 156.88 3.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.571 1.169 . . . . 73.450000000000003 109.291 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.685 ' HE1' ' HB2' ' A' ' 128' ' ' ALA . 1.5 t80 -54.65 -19.17 5.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.491 1.12 . . . . 43.43 110.998 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.856 ' HB3' HD12 ' A' ' 111' ' ' ILE . . . -76.26 -51.58 11.74 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.541 1.15 . . . . 52.420000000000002 109.356 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -71.02 -25.93 62.89 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.425 1.078 . . . . 73.140000000000001 110.319 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.43 ' HE1' ' CG2' ' A' ' 82' ' ' VAL . 34.8 tpp -38.12 111.03 0.57 Allowed Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.508 1.13 . . . . 73.140000000000001 110.974 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.96 140.21 25.31 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.483 1.781 . . . . 64.519999999999996 111.048 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.564 ' CE1' HD12 ' A' ' 122' ' ' LEU . 10.2 p80 -166.01 109.47 0.79 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.543 1.152 . . . . 51.020000000000003 109.605 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -68.64 -27.77 73.6 Favored Glycine 0 CA--C 1.531 1.041 0 O-C-N 124.547 1.154 . . . . 74.349999999999994 111.079 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 22.0 ttm-85 -63.0 151.04 40.86 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.588 0.817 . . . . 64.120000000000005 110.307 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -54.66 -176.65 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.535 1.147 . . . . 74.530000000000001 110.274 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -47.68 136.0 10.97 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.48 1.113 . . . . 74.140000000000001 109.658 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.84 HD22 ' O ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -137.49 127.12 25.23 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.498 1.123 . . . . 62.420000000000002 109.337 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -101.83 5.61 41.17 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.477 1.111 . . . . 51.409999999999997 110.315 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 73.7 m-80 -73.53 99.36 3.01 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.555 1.159 . . . . 74.299999999999997 109.342 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.643 HD11 ' HE1' ' A' ' 151' ' ' PHE . 1.1 pt? -75.01 -17.27 60.55 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.532 1.145 . . . . 63.240000000000002 109.242 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.9 -40.06 72.49 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.55 1.157 . . . . 73.209999999999994 109.265 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -43.9 -54.53 5.24 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.548 1.155 . . . . 75.400000000000006 109.302 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.735 ' HB3' HD21 ' A' ' 84' ' ' LEU . . . -60.5 -36.03 77.37 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.53 1.144 . . . . 63.219999999999999 109.293 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.822 HG21 HD21 ' A' ' 157' ' ' LEU . 3.4 t -73.31 -5.5 6.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.526 1.141 . . . . 73.310000000000002 109.276 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.738 HD21 ' HB1' ' A' ' 235' ' ' ALA . 11.0 t-20 -109.59 119.81 40.55 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.473 1.108 . . . . 72.420000000000002 109.268 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 78.77 63.49 2.09 Favored Glycine 0 CA--C 1.529 0.951 0 O-C-N 124.436 1.085 . . . . 63.25 111.033 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 50.9 p -163.52 155.94 17.94 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.45 0.735 . . . . 42.229999999999997 110.073 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.6 ' HB3' ' O ' ' A' ' 80' ' ' LYS . . . -94.92 -22.31 18.07 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.497 1.123 . . . . 73.150000000000006 109.336 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.583 ' CZ2' ' HA ' ' A' ' 210' ' ' PHE . 16.1 m-90 -161.07 154.87 22.27 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.492 1.12 . . . . 71.530000000000001 108.041 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.94 HG22 ' CG1' ' A' ' 82' ' ' VAL . 1.8 p -140.55 122.3 15.36 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.551 1.157 . . . . 72.219999999999999 110.391 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.754 ' O ' HD23 ' A' ' 137' ' ' LEU . 0.9 OUTLIER -84.08 142.09 13.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.542 1.151 . . . . 74.239999999999995 109.23 -179.936 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.754 HD23 ' O ' ' A' ' 136' ' ' ILE . 47.7 mt -130.06 98.88 4.88 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.535 1.147 . . . . 72.129999999999995 109.378 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.872 HD21 ' HB2' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.46 102.23 0.3 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.571 1.169 . . . . 50.329999999999998 109.307 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.955 HD11 HD13 ' A' ' 189' ' ' LEU . 0.2 OUTLIER -68.56 99.13 0.94 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.474 1.109 . . . . 75.510000000000005 109.269 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.447 ' O ' ' N ' ' A' ' 144' ' ' LEU . 2.4 m -125.34 141.55 52.01 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.582 1.176 . . . . 74.140000000000001 110.394 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.441 ' HB3' ' CD2' ' A' ' 180' ' ' LEU . 0.1 OUTLIER -47.41 -46.18 26.11 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.512 1.132 . . . . 73.329999999999998 110.307 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . 0.453 ' OD1' ' N ' ' A' ' 143' ' ' PHE . 11.2 p30 -73.04 -47.57 43.6 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.562 1.164 . . . . 71.430000000000007 109.331 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.976 ' CE2' HG21 ' A' ' 147' ' ' THR . 76.9 t80 -60.24 -19.37 54.26 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.44 1.087 . . . . 72.109999999999999 110.997 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.723 ' C ' HD13 ' A' ' 144' ' ' LEU . 2.0 tm? -66.83 -67.54 0.44 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.515 1.134 . . . . 73.349999999999994 109.319 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.447 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 30.3 mmt180 -50.95 -21.51 1.78 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.534 1.146 . . . . 75.420000000000002 110.276 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 92.7 m-20 -78.36 -72.33 0.38 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.442 1.089 . . . . 71.400000000000006 109.283 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.976 HG21 ' CE2' ' A' ' 143' ' ' PHE . 20.6 p -58.64 -56.0 27.76 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.489 1.118 . . . . 72.420000000000002 110.394 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.407 ' CE3' ' HA ' ' A' ' 148' ' ' TRP . 2.1 t-105 -43.48 -56.65 3.51 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.98 -1.119 . . . . 75.010000000000005 107.98 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . 0.447 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 42.6 t -58.86 -37.88 77.51 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.446 1.091 . . . . 74.129999999999995 108.261 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.457 ' HA ' ' CE2' ' A' ' 153' ' ' PHE . 14.5 t-20 -63.5 -27.6 69.38 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.47 1.106 . . . . 72.450000000000003 109.3 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.853 ' CZ ' HD12 ' A' ' 157' ' ' LEU . 10.1 m-30 -87.15 -13.3 44.46 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.452 1.095 . . . . 72.409999999999997 110.978 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -75.46 -35.76 60.83 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.541 1.151 . . . . 61.200000000000003 110.293 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.594 ' C ' ' CD1' ' A' ' 153' ' ' PHE . 0.8 OUTLIER -94.08 -21.4 19.15 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.489 1.118 . . . . 74.099999999999994 111.017 -179.989 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.557 ' HB2' ' CE1' ' A' ' 153' ' ' PHE . 1.0 OUTLIER -115.24 109.74 18.41 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.519 1.137 . . . . 63.229999999999997 111.043 -179.974 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.44 ' O ' ' ND2' ' A' ' 159' ' ' ASN . 1.2 t -85.81 -5.98 59.17 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.573 1.17 . . . . 72.450000000000003 110.369 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 1.6 t -72.52 -31.89 65.69 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.543 1.152 . . . . 45.130000000000003 110.051 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.853 HD12 ' CZ ' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -85.46 -25.87 26.65 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.471 1.107 . . . . 72.239999999999995 109.291 179.984 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' MET . . . . . 0.701 ' HE2' ' HA ' ' A' ' 158' ' ' MET . 7.0 mmt -67.64 -25.61 65.82 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.445 1.091 . . . . 74.450000000000003 110.978 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' ASN . . . . . 0.647 ' N ' HD22 ' A' ' 159' ' ' ASN . 0.9 OUTLIER -78.08 -15.81 58.57 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.475 1.11 . . . . 73.430000000000007 109.354 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.94 ' OG ' HG21 ' A' ' 170' ' ' VAL . 0.5 OUTLIER -80.0 -43.08 22.61 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.521 1.138 . . . . 65.319999999999993 109.976 179.978 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . 0.686 HG22 ' O ' ' A' ' 158' ' ' MET . 35.5 m -61.02 -17.02 15.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 O-C-N 124.447 1.092 . . . . 75.549999999999997 109.258 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -76.04 -0.8 23.04 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.509 1.13 . . . . 64.519999999999996 109.323 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.488 ' NH2' ' H ' ' A' ' 170' ' ' VAL . 2.6 mmp_? 51.35 58.64 5.3 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.472 1.108 . . . . 71.230000000000004 110.32 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -78.62 -163.54 0.47 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.51 1.131 . . . . 73.299999999999997 110.353 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -112.17 54.48 0.7 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.476 1.11 . . . . 73.430000000000007 109.552 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.572 ' HG3' ' CD2' ' A' ' 167' ' ' TYR . 3.5 tptt -97.72 164.46 12.39 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.476 1.11 . . . . 63.539999999999999 109.309 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' TYR . . . . . 0.581 ' CD1' ' N ' ' A' ' 168' ' ' ASN . 40.0 p90 -58.09 -48.22 80.83 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.46 1.1 . . . . 74.200000000000003 110.983 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.581 ' N ' ' CD1' ' A' ' 167' ' ' TYR . 7.8 p30 -79.86 134.88 36.34 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.519 1.137 . . . . 62.310000000000002 109.264 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.574 ' HB3' ' CD1' ' A' ' 134' ' ' TRP . 47.0 t -113.06 132.3 55.47 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.463 1.102 . . . . 73.530000000000001 109.992 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 1.015 ' O ' HD12 ' A' ' 171' ' ' ILE . 9.6 t -99.48 133.98 40.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.494 1.121 . . . . 63.439999999999998 109.272 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 1.015 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.2 mp -140.52 108.05 6.61 Favored Pre-proline 0 C--N 1.326 -0.44 0 O-C-N 124.389 1.056 . . . . 72.340000000000003 109.361 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.715 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -74.99 106.57 2.3 Favored 'Trans proline' 0 C--N 1.359 1.097 0 O-C-N 124.537 1.809 . . . . 74.209999999999994 111.012 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . 0.43 ' HG2' ' N ' ' A' ' 174' ' ' ARG . 6.7 ttt -89.21 156.41 18.79 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.579 1.175 . . . . 60.109999999999999 110.983 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . 0.43 ' N ' ' HG2' ' A' ' 173' ' ' MET . 8.7 mmm-85 -114.94 121.62 35.02 Favored Pre-proline 0 C--N 1.324 -0.506 0 O-C-N 124.47 1.106 . . . . 73.239999999999995 110.284 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' PRO . . . . . 0.746 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -75.01 159.94 40.71 Favored 'Trans proline' 0 C--N 1.359 1.114 0 O-C-N 124.516 1.798 . . . . 61.439999999999998 110.975 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.958 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -104.21 -40.17 6.24 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.523 1.139 . . . . 73.120000000000005 109.278 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . 0.414 HD22 ' N ' ' A' ' 177' ' ' ASN . 1.3 m-80 -72.89 -23.76 60.76 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.543 1.152 . . . . 75.099999999999994 109.311 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -110.19 105.91 57.59 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.503 1.127 . . . . 75.109999999999999 109.34 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.92 115.67 4.36 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.466 1.772 . . . . 74.019999999999996 111.049 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.639 HD21 ' CB ' ' A' ' 184' ' ' ARG . 2.1 tm? -139.12 101.67 7.61 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.432 1.083 . . . . 72.209999999999994 109.342 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.99 171.79 17.64 Favored 'Trans proline' 0 C--N 1.362 1.245 0 O-C-N 124.441 1.759 . . . . 73.230000000000004 110.993 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 3.5 ptp85 -59.53 -32.17 70.08 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.505 1.128 . . . . 64.219999999999999 110.299 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -48.47 -31.82 6.92 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.523 1.14 . . . . 51.549999999999997 110.279 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 184' ' ' ARG . . . . . 0.639 ' CB ' HD21 ' A' ' 180' ' ' LEU . 39.6 mmt180 -96.11 -22.38 17.36 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.507 1.129 . . . . 61.229999999999997 110.292 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 185' ' ' THR . . . . . 0.578 HG23 HD23 ' A' ' 139' ' ' LEU . 12.1 m -77.44 144.35 70.09 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.492 1.12 . . . . 51.219999999999999 110.424 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . 0.796 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.2 Cg_endo -74.97 164.6 33.07 Favored 'Trans proline' 0 C--N 1.36 1.155 0 O-C-N 124.404 1.739 . . . . 60.240000000000002 110.989 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 187' ' ' PHE . . . . . 0.466 ' O ' ' CG2' ' A' ' 191' ' ' THR . 32.2 p90 -77.35 -6.92 55.07 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.596 1.185 . . . . 75.329999999999998 111.028 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . 0.566 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -95.33 -51.29 4.65 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.434 1.084 . . . . 71.400000000000006 109.279 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.955 HD13 HD11 ' A' ' 139' ' ' LEU . 49.4 mt -68.39 -42.66 78.77 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.502 1.126 . . . . 63.329999999999998 109.257 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 190' ' ' GLN . . . . . 0.439 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 2.0 pt20 -65.2 -9.68 25.4 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.505 1.128 . . . . 74.129999999999995 110.262 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 191' ' ' THR . . . . . 0.466 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 80.8 p -120.84 24.55 10.17 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.491 1.119 . . . . 73.319999999999993 110.403 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.566 HD11 ' O ' ' A' ' 161' ' ' VAL . 7.8 mt -123.41 163.32 22.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.499 1.125 . . . . 73.329999999999998 109.315 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 193' ' ' ASN . . . . . 0.496 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 2.4 m-20 -66.71 74.22 0.1 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.558 1.161 . . . . 70.439999999999998 109.284 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . 0.715 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -71.04 162.3 29.66 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.452 1.095 . . . . 73.549999999999997 109.3 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 195' ' ' LEU . . . . . 0.754 HD23 HD12 ' A' ' 209' ' ' ILE . 0.3 OUTLIER -106.72 149.32 27.41 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.478 1.111 . . . . 72.450000000000003 109.288 -179.967 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . 0.415 ' N ' HD13 ' A' ' 195' ' ' LEU . 6.8 mm-40 -142.94 142.07 31.59 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.477 1.111 . . . . 53.43 110.335 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.958 ' HG3' HD21 ' A' ' 176' ' ' LEU . 3.4 pm0 -113.62 -28.67 7.4 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.464 1.103 . . . . 72.230000000000004 110.233 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . 0.493 ' HG2' HD12 ' A' ' 176' ' ' LEU . 1.5 pp20? -77.39 0.7 21.47 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.488 1.118 . . . . 60.340000000000003 110.334 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 6.9 t -104.28 161.33 14.14 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.49 1.119 . . . . 71.219999999999999 110.042 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 22.0 ttt-85 -77.55 -26.14 50.7 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.458 1.099 . . . . 72.0 110.274 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -88.73 21.99 23.67 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.554 1.159 . . . . 42.030000000000001 110.98 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 202' ' ' PHE . . . . . 0.848 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.3 OUTLIER -61.18 -41.96 83.35 Favored Pre-proline 0 C--N 1.326 -0.438 0 O-C-N 124.458 0.74 . . . . 73.340000000000003 110.981 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 203' ' ' PRO . . . . . 0.646 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.6 Cg_endo -74.94 -37.43 2.08 Favored 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.494 1.786 . . . . 44.340000000000003 111.049 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.36 -50.98 61.3 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.558 1.161 . . . . 71.329999999999998 110.406 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 205' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 3.0 mt-30 -71.05 -40.15 71.83 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.559 1.162 . . . . 74.549999999999997 110.326 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 206' ' ' VAL . . . . . 0.848 HG23 ' O ' ' A' ' 202' ' ' PHE . 57.1 t -62.82 -26.64 41.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 O-C-N 124.586 1.179 . . . . 75.150000000000006 109.261 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -81.01 -49.93 10.32 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.482 1.114 . . . . 64.319999999999993 110.345 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 83.7 mtt-85 -67.46 -62.75 1.27 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.57 1.169 . . . . 71.530000000000001 110.293 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 209' ' ' ILE . . . . . 0.754 HD12 HD23 ' A' ' 195' ' ' LEU . 96.5 mt -45.61 -50.0 3.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.554 1.159 . . . . 71.140000000000001 109.325 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 210' ' ' PHE . . . . . 0.751 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.5 m-85 -105.83 67.39 0.75 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.524 1.14 . . . . 64.310000000000002 111.01 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 211' ' ' GLN . . . . . 0.548 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.3 OUTLIER -111.04 142.95 42.51 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.485 1.116 . . . . 72.230000000000004 110.324 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.449 ' CG ' ' HE3' ' A' ' 216' ' ' LYS . 7.1 tt0 -49.06 -54.42 16.01 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.498 1.124 . . . . 65.120000000000005 110.324 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.01 -25.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.499 1.125 . . . . 51.299999999999997 109.993 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.548 HG23 ' HG2' ' A' ' 211' ' ' GLN . 42.5 t -96.1 -28.45 3.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.487 1.117 . . . . 72.299999999999997 109.279 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 215' ' ' TYR . . . . . 0.49 ' OH ' ' CE2' ' A' ' 78' ' ' PHE . 32.0 t80 -64.69 -30.77 71.79 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.522 1.139 . . . . 74.120000000000005 111.051 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . 0.449 ' HE3' ' CG ' ' A' ' 212' ' ' GLU . 12.7 mttp -63.11 -66.32 0.56 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.565 1.166 . . . . 73.420000000000002 109.323 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 217' ' ' THR . . . . . 0.713 HG22 HD11 ' A' ' 221' ' ' ILE . 86.9 m -41.01 -55.26 2.59 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.502 1.126 . . . . 74.450000000000003 110.362 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 218' ' ' GLN . . . . . 0.453 ' O ' ' N ' ' A' ' 221' ' ' ILE . 18.6 mm-40 -57.15 -67.2 0.34 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.496 1.122 . . . . 75.319999999999993 110.321 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 37.8 tp60 -44.05 -27.36 0.37 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.539 1.15 . . . . 73.219999999999999 110.385 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 4.4 m -81.2 -41.01 22.96 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.503 1.127 . . . . 74.120000000000005 110.392 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 221' ' ' ILE . . . . . 0.713 HD11 HG22 ' A' ' 217' ' ' THR . 14.5 mt -66.56 -31.26 52.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.439 1.087 . . . . 75.420000000000002 109.215 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 222' ' ' TRP . . . . . 0.965 ' O ' HG22 ' A' ' 225' ' ' THR . 28.9 t90 -69.57 -61.46 1.78 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.549 1.156 . . . . 74.5 107.968 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.516 ' HA ' ' CD ' ' A' ' 226' ' ' ARG . 0.0 OUTLIER -54.05 -20.48 6.51 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.564 1.165 . . . . 70.120000000000005 109.275 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -93.23 -23.13 18.64 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.518 1.136 . . . . 73.510000000000005 110.344 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.965 HG22 ' O ' ' A' ' 222' ' ' TRP . 5.8 t -64.02 -15.05 58.52 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.554 1.159 . . . . 74.230000000000004 110.353 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 226' ' ' ARG . . . . . 0.516 ' CD ' ' HA ' ' A' ' 223' ' ' LYS . 0.8 OUTLIER -76.69 -30.39 56.69 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.503 1.127 . . . . 73.239999999999995 110.279 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 227' ' ' ASN . . . . . 0.667 ' N ' HD22 ' A' ' 227' ' ' ASN . 0.9 OUTLIER -79.7 -59.72 2.63 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.467 1.105 . . . . 62.130000000000003 109.243 -179.94 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 228' ' ' MET . . . . . 0.415 ' HG3' ' N ' ' A' ' 229' ' ' VAL . 10.1 ptp -41.82 -36.64 1.08 Allowed 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.577 1.173 . . . . 51.200000000000003 111.041 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 229' ' ' VAL . . . . . 0.481 HG13 ' HA ' ' A' ' 234' ' ' ILE . 5.7 t -76.76 -41.84 33.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.411 1.07 . . . . 54.119999999999997 109.297 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 230' ' ' GLN . . . . . 0.448 ' N ' ' O ' ' A' ' 227' ' ' ASN . 0.0 OUTLIER -68.29 -12.84 61.69 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.452 1.095 . . . . 73.430000000000007 110.322 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 38.2 mmm-85 -91.55 -80.34 0.35 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.501 1.126 . . . . 72.340000000000003 110.315 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -147.79 54.22 1.05 Allowed 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.547 1.154 . . . . 73.450000000000003 110.319 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 233' ' ' PHE . . . . . 0.724 ' O ' HD13 ' A' ' 234' ' ' ILE . 0.1 OUTLIER -161.53 173.27 15.05 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.6 1.187 . . . . 73.120000000000005 110.944 179.958 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.724 HD13 ' O ' ' A' ' 233' ' ' PHE . 13.4 mm -136.47 159.56 37.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.494 1.121 . . . . 72.439999999999998 109.367 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 235' ' ' ALA . . . . . 0.738 ' HB1' HD21 ' A' ' 130' ' ' ASN . . . . . . . . 0 C--N 1.325 -0.468 0 O-C-N 124.492 1.12 . . . . 74.230000000000004 109.316 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.997 0 N-CA-C 111.002 -0.839 . . . . 52.020000000000003 111.002 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 169.2 23.14 Favored 'Trans proline' 0 C--N 1.359 1.103 0 O-C-N 124.465 1.771 . . . . 70.420000000000002 111.009 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.496 HD13 ' O ' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -109.4 -43.78 4.04 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.572 1.17 . . . . 64.030000000000001 109.275 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -76.67 -63.89 2.25 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.53 1.144 . . . . 73.120000000000005 110.985 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.33 166.26 0.89 Allowed 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.51 0.771 . . . . 73.540000000000006 110.026 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.3 tp10 -59.83 144.28 49.0 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.415 1.072 . . . . 53.409999999999997 110.32 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.404 ' OE1' ' NH1' ' A' ' 226' ' ' ARG . 2.5 tt0 -129.18 127.79 42.06 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.555 1.159 . . . . 55.539999999999999 110.265 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.54 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.7 p -124.72 162.71 26.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 124.454 1.096 . . . . 73.510000000000005 109.288 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.451 ' N ' HG22 ' A' ' 77' ' ' VAL . 8.3 m-85 -88.84 25.21 1.83 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.494 1.121 . . . . 61.520000000000003 111.007 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.677 HD11 HG22 ' A' ' 110' ' ' ILE . 6.1 tp -40.07 158.51 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.553 1.158 . . . . 62.140000000000001 109.317 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.903 ' HZ3' ' HA ' ' A' ' 106' ' ' ILE . 11.4 ptmt -111.76 -47.68 3.13 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.458 1.099 . . . . 71.209999999999994 109.338 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 1.127 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.1 OUTLIER -166.48 151.3 7.84 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.567 1.167 . . . . 75.430000000000007 110.936 -179.972 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.535 HG22 ' N ' ' A' ' 83' ' ' ILE . 3.9 p -104.86 167.78 2.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.451 1.095 . . . . 45.549999999999997 109.347 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 1.127 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 2.3 mp -126.49 105.03 13.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 O-C-N 124.525 1.14 . . . . 63.310000000000002 109.412 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.525 HD23 ' HA ' ' A' ' 84' ' ' LEU . 5.3 mt -70.22 133.27 46.88 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.464 1.102 . . . . 50.219999999999999 109.259 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.68 ' CB ' HD22 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -156.61 174.45 15.43 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.519 1.137 . . . . 72.450000000000003 109.568 179.972 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.577 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -119.2 164.92 14.88 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.514 1.133 . . . . 41.539999999999999 109.307 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -54.46 -35.12 62.69 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 124.478 1.111 . . . . 73.310000000000002 110.267 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -69.28 -46.33 67.46 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.554 1.159 . . . . 65.409999999999997 109.281 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.726 ' HB3' HD23 ' A' ' 138' ' ' LEU . 2.1 m-20 -108.02 44.43 1.1 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.464 1.103 . . . . 72.349999999999994 109.33 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.587 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -80.42 -51.59 8.65 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.47 1.106 . . . . 70.030000000000001 110.39 -179.962 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.04 -32.88 74.59 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.479 1.112 . . . . 73.219999999999999 109.289 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.404 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 4.5 tp10 -58.61 -67.8 0.32 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.498 1.124 . . . . 71.409999999999997 110.288 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.652 ' HB1' ' CG2' ' A' ' 83' ' ' ILE . . . -47.71 -29.66 3.23 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.495 1.122 . . . . 72.310000000000002 109.302 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.496 ' HG ' HD13 ' A' ' 111' ' ' ILE . 1.2 tt -69.9 -49.62 50.4 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.506 1.128 . . . . 71.420000000000002 109.332 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -47.19 -33.15 5.03 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.474 1.109 . . . . 73.030000000000001 110.326 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.814 HG21 ' HE1' ' A' ' 173' ' ' MET . 1.8 t -79.31 -64.69 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.531 1.145 . . . . 73.549999999999997 109.224 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.607 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -45.08 -22.48 0.1 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.489 1.118 . . . . 74.120000000000005 110.353 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.435 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.0 OUTLIER -78.02 -59.91 2.59 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.541 1.151 . . . . 75.209999999999994 109.291 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.836 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -61.73 -21.55 64.61 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.509 1.131 . . . . 71.230000000000004 109.375 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.836 ' N ' HD23 ' A' ' 99' ' ' LEU . 22.6 mt -66.42 -52.61 44.73 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.521 1.138 . . . . 73.400000000000006 109.292 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.408 ' O ' ' HG3' ' A' ' 101' ' ' GLN . 10.4 pt20 -81.0 49.86 1.3 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.485 1.116 . . . . 72.420000000000002 110.276 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -169.63 -65.79 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.498 1.124 . . . . 64.230000000000004 109.337 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -48.42 -48.13 37.38 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.455 1.097 . . . . 75.040000000000006 109.29 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -115.94 -29.8 6.24 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.596 1.185 . . . . 74.450000000000003 111.018 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.43 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 95.21 45.83 2.95 Favored Glycine 0 CA--C 1.53 1.012 0 O-C-N 124.517 1.136 . . . . 64.239999999999995 110.95 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.903 ' HA ' ' HZ3' ' A' ' 80' ' ' LYS . 10.0 mm -81.29 68.12 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.452 0.736 . . . . 75.340000000000003 109.326 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.524 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -118.42 155.46 51.96 Favored Pre-proline 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 64.019999999999996 109.327 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.524 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.96 154.43 99.69 Favored 'Cis proline' 0 C--N 1.359 1.117 0 C-N-CA 120.925 -2.531 . . . . 54.0 111.049 -0.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -135.2 142.99 14.49 Favored Glycine 0 CA--C 1.531 1.038 0 O-C-N 124.468 1.105 . . . . 43.539999999999999 110.957 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.677 HG22 HD11 ' A' ' 79' ' ' LEU . 3.3 tt -153.2 151.92 10.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.506 0.768 . . . . 75.409999999999997 109.269 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.607 HG23 ' HG2' ' A' ' 97' ' ' GLN . 21.3 pt -95.73 -178.14 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.445 1.091 . . . . 74.409999999999997 109.293 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.45 ' HB3' ' CE1' ' A' ' 85' ' ' HIS . 8.0 t80 -82.07 -19.21 40.7 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.488 1.118 . . . . 64.140000000000001 111.059 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.45 -4.37 51.41 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.425 1.078 . . . . 63.039999999999999 109.251 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.43 ' O ' HD11 ' A' ' 110' ' ' ILE . 48.6 mm-40 -109.09 -12.22 14.85 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.502 1.126 . . . . 71.049999999999997 110.292 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.444 ' CG ' ' HD2' ' A' ' 116' ' ' PRO . 6.2 ttm -55.74 143.89 58.08 Favored Pre-proline 0 C--N 1.326 -0.439 0 O-C-N 124.465 1.103 . . . . 73.439999999999998 111.06 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.444 ' HD2' ' CG ' ' A' ' 115' ' ' MET . 18.2 Cg_endo -74.99 83.48 1.81 Allowed 'Trans proline' 0 C--N 1.36 1.159 0 O-C-N 124.498 1.788 . . . . 72.030000000000001 110.964 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.435 ' CD2' ' HB3' ' A' ' 115' ' ' MET . 1.6 p80 -165.56 145.58 6.71 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.51 1.131 . . . . 71.239999999999995 109.627 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -151.5 94.14 0.15 Allowed Glycine 0 CA--C 1.529 0.96 0 O-C-N 124.526 1.141 . . . . 63.109999999999999 110.961 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.413 ' N ' ' HD3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER -123.02 177.69 5.4 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.427 0.722 . . . . 65.209999999999994 110.332 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -47.66 -72.08 0.06 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.529 1.143 . . . . 74.340000000000003 110.326 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 3.8 t-160 -104.3 -175.57 2.83 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.521 1.138 . . . . 72.099999999999994 109.612 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.583 HD22 ' N ' ' A' ' 122' ' ' LEU . 0.4 OUTLIER -103.68 23.15 13.17 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.513 1.133 . . . . 62.310000000000002 109.332 179.959 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.89 175.5 0.12 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.559 1.162 . . . . 73.329999999999998 110.318 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 65.28 50.01 1.84 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.485 1.116 . . . . 73.230000000000004 109.274 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.634 HD12 ' N ' ' A' ' 126' ' ' ASP . 2.4 pp -59.8 -17.61 37.15 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.479 1.112 . . . . 72.109999999999999 109.249 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.634 ' N ' HD12 ' A' ' 125' ' ' LEU . 7.4 t0 -62.81 -14.12 41.72 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 124.568 1.168 . . . . 74.099999999999994 109.295 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -55.54 -26.29 42.42 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.518 1.136 . . . . 73.209999999999994 109.366 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -93.91 -22.5 18.57 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.459 1.099 . . . . 72.230000000000004 109.324 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.568 HG12 ' O ' ' A' ' 129' ' ' VAL . 25.4 t -82.8 5.17 2.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.5 1.125 . . . . 63.520000000000003 109.259 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 -143.55 118.54 10.02 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.579 1.175 . . . . 74.219999999999999 109.293 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 102.1 42.19 2.29 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.478 1.111 . . . . 30.350000000000001 111.032 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . 0.462 ' CB ' ' HA ' ' A' ' 81' ' ' PHE . 0.2 OUTLIER -163.26 -177.03 5.11 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.513 0.772 . . . . 52.119999999999997 110.014 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.832 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -107.24 -25.86 11.31 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.536 1.148 . . . . 73.120000000000005 109.343 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.832 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 4.2 m-90 -159.66 172.9 16.91 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.487 1.117 . . . . 74.540000000000006 108.035 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.491 ' O ' ' CD1' ' A' ' 137' ' ' LEU . 38.9 p -147.25 124.62 11.6 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.518 1.136 . . . . 61.5 110.421 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.764 HD13 HG13 ' A' ' 83' ' ' ILE . 1.1 mp -84.32 128.65 38.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.528 1.143 . . . . 65.310000000000002 109.353 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.717 HD12 ' C ' ' A' ' 136' ' ' ILE . 2.0 mp -110.96 101.69 10.23 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.508 1.13 . . . . 74.329999999999998 109.252 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.726 HD23 ' HB3' ' A' ' 89' ' ' ASP . 0.1 OUTLIER -62.02 89.87 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.43 1.081 . . . . 73.519999999999996 109.306 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.864 HD21 HG23 ' A' ' 185' ' ' THR . 5.2 tp -63.04 99.99 0.19 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.472 1.107 . . . . 72.329999999999998 109.27 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 18.9 m -131.11 154.11 48.65 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.542 1.151 . . . . 74.219999999999999 110.397 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -52.71 -34.32 51.81 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.54 1.15 . . . . 72.120000000000005 110.304 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -89.39 -53.06 4.72 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.541 1.151 . . . . 73.010000000000005 109.324 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.592 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 58.7 t80 -55.16 -19.8 8.69 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.442 1.089 . . . . 71.109999999999999 110.982 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.594 ' C ' HD13 ' A' ' 144' ' ' LEU . 3.0 tm? -63.08 -67.83 0.39 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.52 1.138 . . . . 64.150000000000006 109.3 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.454 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 0.2 OUTLIER -62.7 -15.03 50.87 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.521 1.138 . . . . 72.040000000000006 110.255 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -64.21 -60.65 2.95 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.551 1.157 . . . . 65.409999999999997 109.246 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.573 HG23 ' CZ ' ' A' ' 151' ' ' PHE . 1.0 OUTLIER -92.06 -47.03 7.48 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.523 1.139 . . . . 74.439999999999998 110.392 -179.946 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.502 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 30.2 t-105 -43.37 -35.72 1.65 Allowed 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.503 1.127 . . . . 73.0 108.017 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . 0.454 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 17.9 t -80.37 -45.01 18.45 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.479 1.112 . . . . 73.420000000000002 108.282 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.427 ' N ' ' O ' ' A' ' 147' ' ' THR . 24.3 t-20 -60.7 -15.65 31.26 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.461 1.1 . . . . 50.240000000000002 109.317 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.698 ' CZ ' HD12 ' A' ' 157' ' ' LEU . 10.7 m-30 -82.41 -50.91 8.36 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.54 1.15 . . . . 75.209999999999994 110.951 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -46.26 -38.11 8.11 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.507 1.13 . . . . 72.049999999999997 110.385 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -77.66 -33.76 53.32 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.483 1.114 . . . . 72.400000000000006 110.957 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -116.41 91.32 3.55 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.468 1.105 . . . . 73.219999999999999 110.966 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.2 t -62.56 -13.03 26.52 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.5 1.125 . . . . 72.409999999999997 110.334 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 12.1 t -70.19 -18.64 63.19 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.461 1.1 . . . . 63.240000000000002 109.956 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.698 HD12 ' CZ ' ' A' ' 151' ' ' PHE . 0.2 OUTLIER -88.58 -36.02 16.57 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.523 1.139 . . . . 74.239999999999995 109.315 179.98 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' MET . . . . . 0.479 ' HA ' ' CE ' ' A' ' 158' ' ' MET . 2.2 mmt -68.67 -11.55 60.3 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.53 1.144 . . . . 65.049999999999997 110.989 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -77.58 -48.52 16.73 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.465 1.103 . . . . 75.329999999999998 109.317 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.471 ' HB3' ' CG2' ' A' ' 170' ' ' VAL . 0.4 OUTLIER -59.86 -24.88 64.59 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.495 1.122 . . . . 70.430000000000007 110.019 179.958 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . 0.832 ' O ' HD11 ' A' ' 192' ' ' ILE . 44.2 t -62.01 -18.03 18.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.513 1.133 . . . . 60.130000000000003 109.337 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . 0.42 ' HB3' ' NE2' ' A' ' 164' ' ' GLN . 4.0 t-20 -79.45 1.36 25.82 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.427 1.079 . . . . 45.030000000000001 109.271 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.487 ' NH1' ' ND2' ' A' ' 193' ' ' ASN . 17.6 mmm-85 63.33 62.97 0.93 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.449 1.093 . . . . 62.030000000000001 110.323 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . 0.549 HE21 ' N ' ' A' ' 164' ' ' GLN . 0.0 OUTLIER -60.1 -173.66 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 75.209999999999994 110.244 -179.973 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -124.54 24.72 7.8 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.572 1.17 . . . . 73.129999999999995 109.62 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -82.95 174.89 10.49 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.566 1.166 . . . . 74.219999999999999 109.284 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' TYR . . . . . 0.714 ' HB2' HG22 ' A' ' 221' ' ' ILE . 9.9 t80 -45.27 -65.47 0.53 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.53 1.144 . . . . 74.400000000000006 111.04 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.413 ' ND2' ' H ' ' A' ' 168' ' ' ASN . 2.6 p30 -76.84 154.67 33.64 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.487 1.117 . . . . 63.32 109.316 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.54 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 43.2 m -140.23 168.09 20.63 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.479 1.112 . . . . 73.349999999999994 110.065 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.99 ' O ' HD12 ' A' ' 171' ' ' ILE . 73.0 t -122.72 130.96 74.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.546 1.154 . . . . 52.43 109.253 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.99 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.1 mp -142.34 110.74 5.9 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.52 1.138 . . . . 73.099999999999994 109.313 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.674 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.0 Cg_endo -75.06 106.77 2.34 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.533 1.807 . . . . 75.430000000000007 110.939 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . 0.814 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.1 ttt -87.37 155.69 19.92 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.515 1.135 . . . . 62.119999999999997 110.968 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . 0.517 HH21 ' HB2' ' A' ' 139' ' ' LEU . 0.0 OUTLIER -115.89 116.53 40.44 Favored Pre-proline 0 C--N 1.325 -0.46 0 O-C-N 124.49 1.119 . . . . 73.209999999999994 110.321 -179.966 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' PRO . . . . . 0.663 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -75.04 160.12 40.41 Favored 'Trans proline' 0 C--N 1.359 1.109 0 O-C-N 124.492 1.786 . . . . 43.25 110.943 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.824 ' N ' HD13 ' A' ' 176' ' ' LEU . 0.0 OUTLIER -95.25 -43.8 7.9 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.526 1.141 . . . . 73.420000000000002 109.257 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . 0.469 ' H ' ' ND2' ' A' ' 177' ' ' ASN . 1.9 p30 -72.77 -25.71 61.28 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.509 1.13 . . . . 60.130000000000003 109.25 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -110.26 102.38 51.05 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.52 1.138 . . . . 73.349999999999994 109.326 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.04 134.32 17.61 Favored 'Trans proline' 0 C--N 1.359 1.118 0 O-C-N 124.48 1.779 . . . . 71.040000000000006 110.969 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.401 ' HA ' HD22 ' A' ' 180' ' ' LEU . 1.2 tm? -141.18 97.18 6.98 Favored Pre-proline 0 C--N 1.326 -0.42 0 O-C-N 124.493 1.121 . . . . 61.520000000000003 109.3 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.02 165.8 30.52 Favored 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.495 1.787 . . . . 61.350000000000001 110.973 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . 0.416 ' HG3' ' N ' ' A' ' 183' ' ' GLU . 5.4 ptm180 -68.11 -22.33 64.9 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.54 1.15 . . . . 73.209999999999994 110.283 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' A' ' 182' ' ' ARG . 11.6 pt-20 -61.96 -14.5 35.45 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.53 1.144 . . . . 72.310000000000002 110.262 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -121.4 3.43 10.26 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.594 1.184 . . . . 74.439999999999998 110.313 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 185' ' ' THR . . . . . 0.864 HG23 HD21 ' A' ' 139' ' ' LEU . 10.5 m -100.42 144.13 27.87 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.476 1.11 . . . . 64.049999999999997 110.425 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . 0.786 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -74.95 164.38 33.52 Favored 'Trans proline' 0 C--N 1.36 1.179 0 O-C-N 124.522 1.801 . . . . 72.310000000000002 110.97 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 187' ' ' PHE . . . . . 0.495 ' O ' ' CG2' ' A' ' 191' ' ' THR . 5.7 p90 -77.01 -7.0 54.87 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.515 1.134 . . . . 74.439999999999998 110.996 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -95.03 -51.36 4.69 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.557 1.161 . . . . 74.530000000000001 109.252 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.786 HD12 ' CG ' ' A' ' 186' ' ' PRO . 51.9 mt -68.41 -42.55 78.82 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.555 1.159 . . . . 63.43 109.37 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 190' ' ' GLN . . . . . 0.436 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.9 pt20 -65.3 -9.41 24.07 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.494 1.121 . . . . 74.140000000000001 110.241 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 191' ' ' THR . . . . . 0.495 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 67.7 p -119.32 17.95 13.0 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.472 1.107 . . . . 63.039999999999999 110.439 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.832 HD11 ' O ' ' A' ' 161' ' ' VAL . 7.4 mt -112.97 157.36 13.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.552 1.157 . . . . 72.219999999999999 109.277 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 193' ' ' ASN . . . . . 0.555 HD21 HD11 ' A' ' 171' ' ' ILE . 46.2 p-10 -65.53 75.38 0.06 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.477 1.111 . . . . 72.430000000000007 109.324 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . 0.674 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -71.9 149.58 45.0 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.424 1.078 . . . . 74.310000000000002 109.292 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 195' ' ' LEU . . . . . 0.584 HD23 HD12 ' A' ' 209' ' ' ILE . 0.5 OUTLIER -93.15 124.53 37.19 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.533 1.146 . . . . 64.439999999999998 109.291 -179.951 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -118.6 109.17 15.83 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.529 1.143 . . . . 72.209999999999994 110.287 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.819 ' CG ' HD11 ' A' ' 176' ' ' LEU . 14.0 pt-20 -79.63 -34.03 40.93 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.453 1.095 . . . . 73.510000000000005 110.314 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . 0.575 ' CG ' HD12 ' A' ' 176' ' ' LEU . 11.7 pt-20 -79.62 2.43 22.51 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.49 1.119 . . . . 64.310000000000002 110.303 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 29.4 t -96.52 145.35 25.78 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.445 1.09 . . . . 53.450000000000003 110.063 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -57.55 -28.69 63.76 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.535 1.147 . . . . 72.439999999999998 110.371 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -93.59 23.44 30.41 Favored Glycine 0 CA--C 1.53 1.027 0 O-C-N 124.552 1.158 . . . . 72.209999999999994 111.03 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 202' ' ' PHE . . . . . 0.863 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.2 OUTLIER -59.04 -43.14 97.04 Favored Pre-proline 0 C--N 1.324 -0.534 0 O-C-N 124.567 0.804 . . . . 75.299999999999997 111.027 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 203' ' ' PRO . . . . . 0.619 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -75.03 -36.05 2.76 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.487 1.783 . . . . 71.030000000000001 110.971 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -57.87 -47.2 83.42 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.483 1.114 . . . . 70.140000000000001 110.36 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 205' ' ' GLN . . . . . 0.401 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 1.8 mt-30 -70.67 -40.04 73.19 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.495 1.122 . . . . 64.439999999999998 110.293 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 206' ' ' VAL . . . . . 0.863 HG23 ' O ' ' A' ' 202' ' ' PHE . 89.7 t -66.85 -27.83 41.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.453 1.095 . . . . 63.229999999999997 109.273 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 207' ' ' GLU . . . . . 0.477 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 2.3 mt-10 -80.31 -51.72 8.56 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.494 1.121 . . . . 72.120000000000005 110.253 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 77.4 mtt180 -62.75 -57.92 9.26 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.518 1.136 . . . . 55.350000000000001 110.34 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 209' ' ' ILE . . . . . 0.766 HG22 ' CD1' ' A' ' 210' ' ' PHE . 65.5 mt -52.49 -53.82 18.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.485 1.116 . . . . 73.019999999999996 109.29 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 210' ' ' PHE . . . . . 0.766 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.1 m-85 -104.97 57.51 0.69 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.488 1.118 . . . . 74.439999999999998 110.959 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 211' ' ' GLN . . . . . 0.503 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -96.23 139.51 32.28 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.414 1.071 . . . . 53.43 110.291 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 215' ' ' TYR . 56.9 tt0 -49.98 -53.35 27.03 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.516 1.135 . . . . 73.209999999999994 110.309 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -47.1 -24.25 0.63 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.478 1.111 . . . . 64.340000000000003 110.013 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.503 HG23 ' HG2' ' A' ' 211' ' ' GLN . 34.6 t -95.9 -32.02 4.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.513 1.133 . . . . 62.109999999999999 109.261 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 215' ' ' TYR . . . . . 0.45 ' N ' ' O ' ' A' ' 212' ' ' GLU . 4.5 t80 -63.3 -36.41 83.6 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.512 1.133 . . . . 72.530000000000001 111.027 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt -50.4 -60.86 2.57 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.547 1.154 . . . . 72.230000000000004 109.289 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 217' ' ' THR . . . . . 0.966 HG22 HD11 ' A' ' 221' ' ' ILE . 1.3 m -51.98 -46.89 65.03 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.446 1.091 . . . . 73.209999999999994 110.443 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 218' ' ' GLN . . . . . 0.695 ' HA ' HD12 ' A' ' 221' ' ' ILE . 11.0 mm-40 -49.11 -54.67 15.11 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.476 1.11 . . . . 71.010000000000005 110.265 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 219' ' ' GLN . . . . . 0.417 ' NE2' ' HB2' ' A' ' 223' ' ' LYS . 21.8 tp60 -45.42 -52.81 9.59 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.514 1.134 . . . . 75.129999999999995 110.295 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -59.09 -44.87 91.96 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.483 1.115 . . . . 74.019999999999996 110.399 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 221' ' ' ILE . . . . . 0.966 HD11 HG22 ' A' ' 217' ' ' THR . 17.4 mt -59.18 -27.31 36.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.536 1.148 . . . . 72.409999999999997 109.311 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 222' ' ' TRP . . . . . 0.572 ' HB2' ' CE1' ' A' ' 167' ' ' TYR . 21.2 t90 -89.41 -17.42 28.8 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.98 -1.119 . . . . 71.519999999999996 107.98 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.417 ' HB2' ' NE2' ' A' ' 219' ' ' GLN . 1.6 tmmm? -85.91 -29.73 23.41 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.457 1.098 . . . . 71.430000000000007 109.351 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . 0.463 ' CG ' ' HA ' ' A' ' 221' ' ' ILE . 0.2 OUTLIER -86.67 -35.26 19.43 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.458 1.099 . . . . 72.409999999999997 110.262 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.702 ' O ' HG13 ' A' ' 229' ' ' VAL . 14.9 t -62.57 -12.72 24.5 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.503 1.127 . . . . 75.030000000000001 110.357 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 226' ' ' ARG . . . . . 0.501 ' CG ' ' O ' ' A' ' 222' ' ' TRP . 6.2 mtm180 -79.47 -16.48 56.0 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.483 1.114 . . . . 75.510000000000005 110.243 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 227' ' ' ASN . . . . . 0.401 ' O ' ' N ' ' A' ' 231' ' ' ARG . 1.0 OUTLIER -89.21 -46.76 8.55 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.452 1.095 . . . . 44.219999999999999 109.277 -179.95 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 10.6 mtm -57.53 -34.37 69.06 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.543 1.152 . . . . 75.329999999999998 110.977 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 229' ' ' VAL . . . . . 0.702 HG13 ' O ' ' A' ' 225' ' ' THR . 21.2 m -73.7 -51.21 25.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 O-C-N 124.507 1.129 . . . . 64.219999999999999 109.324 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 230' ' ' GLN . . . . . 0.501 ' N ' HG23 ' A' ' 229' ' ' VAL . 4.5 tp-100 -71.41 -7.5 47.72 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.491 1.119 . . . . 71.030000000000001 110.314 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 231' ' ' ARG . . . . . 0.401 ' N ' ' O ' ' A' ' 227' ' ' ASN . 15.2 ttp180 -92.87 -82.42 0.33 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.468 1.105 . . . . 72.400000000000006 110.289 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -143.29 50.62 1.4 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.533 1.146 . . . . 55.409999999999997 110.318 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 233' ' ' PHE . . . . . 0.404 ' O ' HD13 ' A' ' 234' ' ' ILE . 1.5 t80 -163.18 -174.07 3.68 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.506 1.129 . . . . 71.420000000000002 111.022 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.404 HD13 ' O ' ' A' ' 233' ' ' PHE . 16.8 mm -139.84 150.94 21.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 124.454 1.097 . . . . 71.340000000000003 109.337 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 235' ' ' ALA . . . . . 0.661 ' HB2' HG11 ' A' ' 229' ' ' VAL . . . . . . . . 0 C--N 1.325 -0.498 0 O-C-N 124.529 1.143 . . . . 72.420000000000002 109.275 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.054 0 N-CA-C 110.93 -0.868 . . . . 60.409999999999997 110.93 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.97 -165.88 0.31 Allowed 'Trans proline' 0 C--N 1.361 1.188 0 O-C-N 124.533 1.807 . . . . 72.030000000000001 111.064 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.411 ' C ' ' CD1' ' A' ' 72' ' ' LEU . 0.1 OUTLIER -116.64 -73.11 0.66 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.503 1.127 . . . . 60.420000000000002 109.356 179.923 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -93.48 -54.93 1.62 Allowed Glycine 0 CA--C 1.529 0.943 0 O-C-N 124.503 1.127 . . . . 73.310000000000002 111.023 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 68.82 10.47 7.92 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.509 0.77 . . . . 73.219999999999999 109.977 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -43.49 130.48 5.12 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.491 1.119 . . . . 73.430000000000007 110.336 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -118.29 130.79 56.24 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.42 1.075 . . . . 73.209999999999994 110.303 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.505 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 2.9 p -132.05 157.27 43.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.568 1.168 . . . . 72.340000000000003 109.307 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.499 ' CE2' ' HG3' ' A' ' 108' ' ' PRO . 51.4 p90 -89.72 30.95 0.98 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.448 1.092 . . . . 71.209999999999994 110.984 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.626 HD11 HG22 ' A' ' 110' ' ' ILE . 6.1 tp -39.91 134.81 1.39 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.553 1.158 . . . . 72.129999999999995 109.359 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.475 ' O ' ' CB ' ' A' ' 133' ' ' ALA . 9.1 ttmt -74.84 -67.07 0.67 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.589 1.181 . . . . 71.319999999999993 109.365 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 1.08 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 1.5 p90 -152.16 140.68 20.69 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.384 1.052 . . . . 64.219999999999999 111.018 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.576 HG12 ' HB ' ' A' ' 135' ' ' THR . 8.6 p -84.07 171.59 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 O-C-N 124.48 1.112 . . . . 64.340000000000003 109.306 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 1.08 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 2.8 mp -137.4 86.04 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.574 1.172 . . . . 73.540000000000006 109.224 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.753 HD11 ' HB3' ' A' ' 128' ' ' ALA . 12.8 mt -70.41 101.38 1.94 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.501 1.125 . . . . 73.430000000000007 109.275 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.654 ' CE1' ' HB2' ' A' ' 113' ' ' ALA . 0.0 OUTLIER -121.32 174.62 6.61 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 124.552 1.157 . . . . 65.150000000000006 109.6 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.435 ' HB2' ' CD1' ' A' ' 143' ' ' PHE . . . -117.37 164.49 14.78 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.444 1.09 . . . . 74.400000000000006 109.252 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.4 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 21.0 tt0 -63.54 -11.4 24.04 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.512 1.132 . . . . 71.540000000000006 110.316 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -83.66 -45.93 12.89 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.488 1.118 . . . . 44.210000000000001 109.278 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.415 ' CG ' HD23 ' A' ' 138' ' ' LEU . 1.3 p30 -123.05 44.44 2.66 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.475 1.11 . . . . 74.519999999999996 109.324 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.623 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -76.03 -28.94 57.89 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.49 1.119 . . . . 71.319999999999993 110.42 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -84.72 -24.2 29.0 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.472 1.108 . . . . 73.230000000000004 109.408 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.424 ' HG3' ' ND2' ' A' ' 177' ' ' ASN . 0.0 OUTLIER -71.68 -54.73 9.38 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.495 1.122 . . . . 43.340000000000003 110.325 179.972 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.944 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -59.63 -35.63 74.75 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.471 1.107 . . . . 45.020000000000003 109.296 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.842 HD22 ' O ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -69.95 -49.6 50.17 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.537 1.148 . . . . 64.420000000000002 109.249 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.705 ' N ' HD13 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -44.97 -37.83 4.29 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.515 1.134 . . . . 63.009999999999998 110.232 -179.955 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.591 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.1 t -73.63 -64.51 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.489 1.118 . . . . 53.0 109.268 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.453 ' N ' HG12 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -41.67 -26.53 0.08 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.463 1.102 . . . . 74.200000000000003 110.302 -179.95 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.449 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.4 t-20 -71.34 -49.68 39.96 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.516 1.135 . . . . 73.299999999999997 109.286 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.85 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -74.95 -22.19 58.72 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.555 1.159 . . . . 74.120000000000005 109.333 -179.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.85 ' N ' HD23 ' A' ' 99' ' ' LEU . 30.8 mt -62.83 -51.73 65.89 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.529 1.143 . . . . 65.319999999999993 109.281 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 101' ' ' GLN . 10.0 pt20 -79.81 51.48 1.32 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.538 1.149 . . . . 73.120000000000005 110.297 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -170.13 -66.55 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.566 1.166 . . . . 61.140000000000001 109.27 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -50.28 -44.67 53.95 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.466 1.104 . . . . 72.430000000000007 109.36 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.513 ' HE2' HD23 ' A' ' 100' ' ' LEU . 1.6 m-85 -116.5 -32.27 5.28 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.514 1.134 . . . . 74.530000000000001 111.011 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.429 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 98.47 44.7 2.47 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 124.474 1.109 . . . . 64.409999999999997 110.978 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.414 HG23 ' HD3' ' A' ' 80' ' ' LYS . 8.9 mm -84.1 72.64 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.519 0.776 . . . . 71.230000000000004 109.31 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.522 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -119.9 156.69 54.01 Favored Pre-proline 0 C--N 1.324 -0.51 0 O-C-N 124.515 1.135 . . . . 74.439999999999998 109.322 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.522 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.1 Cg_endo -75.06 164.39 88.49 Favored 'Cis proline' 0 C--N 1.359 1.121 0 C-N-CA 120.994 -2.502 . . . . 65.209999999999994 110.953 0.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.44 125.4 5.02 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.405 1.066 . . . . 72.340000000000003 111.008 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.626 HG22 HD11 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -141.17 130.27 24.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.439 0.729 . . . . 70.310000000000002 109.271 179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 1.107 HD12 ' HB3' ' A' ' 113' ' ' ALA . 1.8 pt -94.19 148.49 4.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 124.447 1.092 . . . . 72.230000000000004 109.326 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.573 ' CE1' HD21 ' A' ' 84' ' ' LEU . 2.6 t80 -51.59 -20.25 1.88 Allowed 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.49 1.119 . . . . 70.420000000000002 110.965 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 1.107 ' HB3' HD12 ' A' ' 111' ' ' ILE . . . -78.89 -35.98 42.78 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.512 1.132 . . . . 64.439999999999998 109.288 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -83.37 -24.87 31.83 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.474 1.109 . . . . 71.400000000000006 110.327 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 42.1 tpp -37.37 110.81 0.51 Allowed Pre-proline 0 C--N 1.326 -0.45 0 O-C-N 124.536 1.147 . . . . 74.5 110.997 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.95 -16.54 20.28 Favored 'Trans proline' 0 C--N 1.36 1.158 0 O-C-N 124.525 1.803 . . . . 74.409999999999997 110.994 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -42.76 -34.12 0.86 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.514 1.134 . . . . 74.239999999999995 109.629 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . 0.509 ' HA3' HD12 ' A' ' 122' ' ' LEU . . . 179.58 165.02 32.98 Favored Glycine 0 CA--C 1.53 1.027 0 O-C-N 124.494 1.121 . . . . 63.420000000000002 110.967 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 36.6 mtt180 -41.38 -74.31 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.516 0.774 . . . . 73.129999999999995 110.345 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -133.47 -70.67 0.52 Allowed 'General case' 0 C--N 1.324 -0.535 0 O-C-N 124.553 1.158 . . . . 70.530000000000001 110.306 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -105.5 99.61 9.21 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.512 1.133 . . . . 74.010000000000005 109.571 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.806 HD13 ' N ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -110.94 -29.24 8.01 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.44 1.088 . . . . 75.030000000000001 109.279 179.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.635 ' H ' HD22 ' A' ' 122' ' ' LEU . 71.9 mm-40 -151.56 170.12 20.43 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.516 1.135 . . . . 72.140000000000001 110.313 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -43.97 149.84 0.3 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.491 1.119 . . . . 62.210000000000001 109.341 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.779 HD12 ' N ' ' A' ' 126' ' ' ASP . 0.7 OUTLIER -59.16 -17.37 26.6 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.564 1.165 . . . . 71.430000000000007 109.31 -179.982 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.779 ' N ' HD12 ' A' ' 125' ' ' LEU . 1.4 t70 -59.8 -20.23 55.52 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.504 1.127 . . . . 71.409999999999997 109.328 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -55.3 -21.87 16.49 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.434 1.084 . . . . 72.519999999999996 109.281 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.753 ' HB3' HD11 ' A' ' 84' ' ' LEU . . . -77.42 -40.87 41.99 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.488 1.118 . . . . 62.420000000000002 109.326 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.534 HG11 HG22 ' A' ' 170' ' ' VAL . 3.6 m -92.27 29.3 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 O-C-N 124.576 1.173 . . . . 73.530000000000001 109.26 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 24.4 m-20 -109.97 124.22 51.03 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.493 1.121 . . . . 73.120000000000005 109.283 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . 0.556 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 44.21 73.05 0.28 Allowed Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.532 1.145 . . . . 41.200000000000003 111.028 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . 0.402 ' O ' ' O ' ' A' ' 167' ' ' TYR . 2.5 m -162.96 -175.79 4.56 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.491 0.76 . . . . 73.239999999999995 109.955 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.564 ' CB ' ' CE3' ' A' ' 134' ' ' TRP . . . -99.83 -77.11 0.53 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.497 1.123 . . . . 54.219999999999999 109.296 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.586 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 0.8 OUTLIER -125.18 176.16 6.91 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.544 1.153 . . . . 74.030000000000001 108.001 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.576 ' HB ' HG12 ' A' ' 82' ' ' VAL . 3.4 t -153.98 130.86 10.89 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.462 1.101 . . . . 73.329999999999998 110.423 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.763 HD13 ' HE2' ' A' ' 81' ' ' PHE . 1.4 mp -84.33 133.53 29.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.514 1.134 . . . . 64.040000000000006 109.303 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.692 HD11 ' CG1' ' A' ' 170' ' ' VAL . 10.2 mt -116.13 96.75 5.71 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.51 1.131 . . . . 75.109999999999999 109.311 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.944 HD21 ' HB2' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.34 92.08 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.522 1.139 . . . . 63.219999999999999 109.311 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.576 HD11 ' HB2' ' A' ' 172' ' ' PRO . 97.4 mt -68.43 111.04 4.42 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.513 1.133 . . . . 61.340000000000003 109.3 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.663 HG23 ' CG ' ' A' ' 178' ' ' ASN . 4.5 m -124.61 160.97 27.26 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 124.482 1.114 . . . . 72.140000000000001 110.47 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -56.04 -39.12 71.51 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.523 1.14 . . . . 73.430000000000007 110.352 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -89.6 -52.62 4.92 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.452 1.095 . . . . 71.310000000000002 109.318 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.54 ' CE2' HG21 ' A' ' 147' ' ' THR . 55.3 t80 -53.23 -24.92 12.34 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.536 1.148 . . . . 72.540000000000006 110.968 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.611 HD13 ' N ' ' A' ' 145' ' ' ARG . 2.0 tm? -70.95 -67.19 0.52 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.545 1.153 . . . . 75.340000000000003 109.304 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.611 ' N ' HD13 ' A' ' 144' ' ' LEU . 0.8 OUTLIER -46.23 -25.03 0.54 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.526 1.141 . . . . 70.319999999999993 110.296 179.99 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -81.03 -54.54 5.46 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.545 1.153 . . . . 55.100000000000001 109.263 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.545 ' O ' ' CG ' ' A' ' 151' ' ' PHE . 27.2 p -70.48 -7.54 44.23 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.497 1.123 . . . . 74.319999999999993 110.414 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.564 ' CZ2' ' HB3' ' A' ' 186' ' ' PRO . 0.8 OUTLIER -96.77 -25.75 15.39 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.447 1.092 . . . . 75.230000000000004 108.059 179.916 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 14.5 t -82.77 -39.48 21.77 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.448 1.093 . . . . 74.420000000000002 108.269 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.405 ' O ' ' N ' ' A' ' 154' ' ' TYR . 4.0 m120 -68.12 -53.13 27.6 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.442 1.089 . . . . 75.150000000000006 109.269 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 1.009 ' CZ ' HD12 ' A' ' 157' ' ' LEU . 6.9 m-30 -46.43 -53.2 11.55 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.512 1.132 . . . . 74.120000000000005 111.01 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -46.83 -47.53 21.12 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.534 1.146 . . . . 74.430000000000007 110.301 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -79.54 -19.43 49.57 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.581 1.176 . . . . 74.409999999999997 110.965 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.405 ' N ' ' O ' ' A' ' 150' ' ' ASN . 3.1 m-30 -113.31 97.82 6.72 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.551 1.157 . . . . 73.540000000000006 110.998 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.416 ' O ' ' ND2' ' A' ' 159' ' ' ASN . 1.2 t -74.93 -3.01 29.63 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.509 1.131 . . . . 64.120000000000005 110.389 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 8.8 t -78.51 -67.82 0.7 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.578 1.174 . . . . 54.32 109.939 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 1.009 HD12 ' CZ ' ' A' ' 151' ' ' PHE . 0.4 OUTLIER -44.04 -51.69 7.65 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.491 1.12 . . . . 71.340000000000003 109.263 -179.933 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' MET . . . . . 0.488 ' HA ' ' CE ' ' A' ' 158' ' ' MET . 6.6 mmt -44.15 -43.24 6.91 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.558 1.161 . . . . 75.120000000000005 110.937 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' ASN . . . . . 0.416 ' ND2' ' O ' ' A' ' 155' ' ' THR . 17.6 m-20 -64.24 -42.29 96.6 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 74.209999999999994 109.241 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.575 ' HB2' HG21 ' A' ' 170' ' ' VAL . 1.3 m -59.37 -35.2 73.46 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.592 1.183 . . . . 72.140000000000001 110.001 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . 0.861 ' O ' HD13 ' A' ' 192' ' ' ILE . 36.1 t -62.08 -18.36 19.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 O-C-N 124.577 1.173 . . . . 71.430000000000007 109.348 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -87.48 11.42 14.79 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.579 1.174 . . . . 70.319999999999993 109.282 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.697 ' NE ' HG23 ' A' ' 192' ' ' ILE . 0.6 OUTLIER 38.75 59.08 1.63 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.55 1.156 . . . . 74.5 110.271 -179.956 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -73.17 -173.11 1.23 Allowed 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.557 1.161 . . . . 74.109999999999999 110.284 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 27.6 p80 -85.59 51.04 2.08 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.528 1.143 . . . . 64.519999999999996 109.595 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.584 ' C ' HG21 ' A' ' 221' ' ' ILE . 0.0 OUTLIER -109.9 173.33 6.38 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.518 1.136 . . . . 75.450000000000003 109.23 -179.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' TYR . . . . . 0.402 ' O ' ' O ' ' A' ' 132' ' ' SER . 28.2 p90 -87.46 40.33 0.92 Allowed 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.465 1.103 . . . . 75.099999999999994 110.964 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -164.16 124.13 2.06 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.519 1.137 . . . . 71.319999999999993 109.296 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.504 ' HB3' ' CD1' ' A' ' 134' ' ' TRP . 27.6 t -118.28 105.79 12.12 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.441 1.088 . . . . 74.230000000000004 110.052 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.692 ' CG1' HD11 ' A' ' 137' ' ' LEU . 5.0 t -79.53 122.08 34.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.495 1.122 . . . . 65.510000000000005 109.319 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.597 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.3 mp -128.67 113.74 19.24 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.464 1.103 . . . . 51.310000000000002 109.251 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.915 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.1 Cg_endo -75.04 107.43 2.48 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.502 1.791 . . . . 74.209999999999994 110.992 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . 0.664 ' CE ' HD12 ' A' ' 195' ' ' LEU . 3.2 ttt -87.75 152.25 22.27 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.501 1.126 . . . . 64.420000000000002 110.976 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . 0.424 ' N ' ' HG2' ' A' ' 173' ' ' MET . 0.0 OUTLIER -100.76 112.41 64.64 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.509 1.131 . . . . 63.020000000000003 110.305 179.975 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' PRO . . . . . 0.413 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.2 Cg_endo -74.97 151.57 39.86 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.58 1.831 . . . . 74.019999999999996 111.026 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.873 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -86.56 -42.68 13.31 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.581 1.175 . . . . 65.219999999999999 109.33 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . 0.424 ' ND2' ' HG3' ' A' ' 92' ' ' GLU . 7.2 p30 -72.17 -28.0 62.94 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.528 1.142 . . . . 71.209999999999994 109.269 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' ASN . . . . . 0.663 ' CG ' HG23 ' A' ' 140' ' ' THR . 6.7 m-20 -110.7 98.19 36.41 Favored Pre-proline 0 C--N 1.324 -0.507 0 O-C-N 124.533 1.146 . . . . 73.400000000000006 109.325 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.98 114.98 4.15 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.565 1.824 . . . . 43.100000000000001 110.992 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.628 HD12 ' OG1' ' A' ' 185' ' ' THR . 0.4 OUTLIER -121.88 96.65 46.8 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.509 1.131 . . . . 71.310000000000002 109.313 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.05 167.49 26.89 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.44 1.758 . . . . 55.43 110.989 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 14.4 ptt180 -61.55 -25.58 67.39 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.563 1.164 . . . . 71.219999999999999 110.33 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -71.31 -9.99 59.03 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.433 1.083 . . . . 72.510000000000005 110.343 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -112.95 -28.87 7.56 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.482 1.114 . . . . 74.040000000000006 110.295 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 185' ' ' THR . . . . . 0.628 ' OG1' HD12 ' A' ' 180' ' ' LEU . 53.4 m -72.3 143.92 86.29 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.463 1.102 . . . . 70.510000000000005 110.352 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . 0.669 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.7 Cg_endo -74.96 146.56 32.96 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.492 1.785 . . . . 62.420000000000002 111.067 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 187' ' ' PHE . . . . . 0.606 ' O ' HG23 ' A' ' 191' ' ' THR . 24.7 p90 -61.69 -12.49 16.71 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.56 1.162 . . . . 73.540000000000006 110.991 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . 0.417 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -87.05 -53.62 4.77 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.53 1.144 . . . . 53.409999999999997 109.306 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.669 HD12 ' CG ' ' A' ' 186' ' ' PRO . 23.2 mt -74.53 -16.34 60.83 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.562 1.164 . . . . 53.299999999999997 109.311 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 190' ' ' GLN . . . . . 0.401 ' O ' ' CG ' ' A' ' 190' ' ' GLN . 6.2 tt0 -86.68 -8.25 57.59 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.567 1.167 . . . . 64.120000000000005 110.243 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 191' ' ' THR . . . . . 0.606 HG23 ' O ' ' A' ' 187' ' ' PHE . 31.5 p -115.73 18.71 15.63 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.515 1.134 . . . . 75.140000000000001 110.322 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.861 HD13 ' O ' ' A' ' 161' ' ' VAL . 8.8 mt -130.73 145.84 34.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.444 1.09 . . . . 54.340000000000003 109.248 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -52.77 118.53 3.73 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.504 1.127 . . . . 41.0 109.27 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . 0.915 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -110.95 177.6 4.61 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.5 1.125 . . . . 70.329999999999998 109.297 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 195' ' ' LEU . . . . . 0.665 HD23 HD12 ' A' ' 209' ' ' ILE . 0.2 OUTLIER -109.63 127.84 54.82 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.452 1.095 . . . . 74.099999999999994 109.238 -179.958 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -109.51 120.04 41.28 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.526 1.141 . . . . 75.349999999999994 110.258 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.873 ' HG3' HD21 ' A' ' 176' ' ' LEU . 12.0 tp10 -101.84 -22.41 14.36 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.516 1.135 . . . . 63.100000000000001 110.236 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . 0.432 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 1.3 pt-20 -94.06 9.88 35.9 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.455 1.097 . . . . 75.5 110.298 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 2.3 t -112.31 151.22 29.96 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.504 1.127 . . . . 64.099999999999994 109.979 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 26.5 ttt85 -64.23 -26.46 68.51 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.52 1.138 . . . . 72.540000000000006 110.286 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -89.51 26.7 8.75 Favored Glycine 0 CA--C 1.53 0.989 0 O-C-N 124.465 1.103 . . . . 63.039999999999999 111.001 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 202' ' ' PHE . . . . . 0.778 ' O ' HG23 ' A' ' 206' ' ' VAL . 3.3 t80 -68.34 -38.72 13.75 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 124.506 0.768 . . . . 73.510000000000005 110.972 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 203' ' ' PRO . . . . . 0.687 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.1 Cg_endo -74.95 -30.11 7.59 Favored 'Trans proline' 0 C--N 1.36 1.168 0 O-C-N 124.519 1.8 . . . . 62.439999999999998 111.021 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 204' ' ' THR . . . . . 0.419 HG22 ' N ' ' A' ' 205' ' ' GLN . 0.9 OUTLIER -64.14 -65.73 0.64 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.475 1.109 . . . . 72.530000000000001 110.4 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 205' ' ' GLN . . . . . 0.419 ' N ' HG22 ' A' ' 204' ' ' THR . 2.4 mt-30 -50.09 -41.82 48.92 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.49 1.118 . . . . 73.340000000000003 110.334 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 206' ' ' VAL . . . . . 0.794 HG11 HD22 ' A' ' 100' ' ' LEU . 53.7 t -59.84 -30.06 44.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.514 1.134 . . . . 62.329999999999998 109.288 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -79.81 -53.25 6.96 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.516 1.135 . . . . 70.040000000000006 110.297 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . 0.419 ' N ' ' HD2' ' A' ' 208' ' ' ARG . 3.2 mpt_? -55.91 -59.15 5.3 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.503 1.127 . . . . 73.319999999999993 110.305 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 209' ' ' ILE . . . . . 0.665 HD12 HD23 ' A' ' 195' ' ' LEU . 73.2 mt -54.29 -59.15 2.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.572 1.17 . . . . 73.510000000000005 109.29 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 210' ' ' PHE . . . . . 0.647 ' CD2' HG13 ' A' ' 206' ' ' VAL . 1.0 OUTLIER -92.17 62.34 4.11 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.501 1.126 . . . . 73.310000000000002 111.05 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 211' ' ' GLN . . . . . 0.536 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -110.87 145.46 38.23 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.52 1.137 . . . . 73.319999999999993 110.289 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 215' ' ' TYR . 27.8 tt0 -49.11 -55.14 13.19 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.487 1.117 . . . . 74.140000000000001 110.333 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.68 -24.23 1.3 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.517 1.136 . . . . 71.540000000000006 110.022 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.536 HG23 ' HG2' ' A' ' 211' ' ' GLN . 40.4 t -96.31 -27.46 3.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.539 1.149 . . . . 42.140000000000001 109.265 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 215' ' ' TYR . . . . . 0.447 ' N ' ' O ' ' A' ' 212' ' ' GLU . 12.0 t80 -66.08 -27.21 67.9 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.493 1.121 . . . . 64.239999999999995 110.973 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . 0.443 ' O ' ' N ' ' A' ' 220' ' ' THR . 12.8 mmtp -59.49 -58.27 9.35 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.382 1.051 . . . . 53.140000000000001 109.274 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 217' ' ' THR . . . . . 0.636 HG22 HD11 ' A' ' 221' ' ' ILE . 4.4 m -50.1 -62.94 1.28 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.503 1.127 . . . . 64.340000000000003 110.355 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 218' ' ' GLN . . . . . 0.475 ' HA ' HD12 ' A' ' 221' ' ' ILE . 3.5 mp0 -54.2 -27.1 32.1 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.533 1.146 . . . . 64.25 110.333 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 219' ' ' GLN . . . . . 0.444 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 30.8 tp60 -82.29 -25.86 33.63 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.464 1.102 . . . . 71.209999999999994 110.269 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 220' ' ' THR . . . . . 0.444 ' O ' ' CG ' ' A' ' 224' ' ' GLU . 1.1 m -88.09 -20.32 25.86 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.53 1.144 . . . . 74.540000000000006 110.388 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 221' ' ' ILE . . . . . 0.636 HD11 HG22 ' A' ' 217' ' ' THR . 19.8 mt -82.12 -41.76 18.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.424 1.078 . . . . 72.120000000000005 109.27 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 222' ' ' TRP . . . . . 0.816 ' O ' HG22 ' A' ' 225' ' ' THR . 13.9 t90 -64.51 -55.86 17.9 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.507 1.13 . . . . 73.329999999999998 107.999 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.02 -18.64 25.48 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.46 1.1 . . . . 73.340000000000003 109.318 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . 0.444 ' CG ' ' O ' ' A' ' 220' ' ' THR . 3.0 mm-40 -90.0 -33.63 16.28 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.522 1.139 . . . . 72.349999999999994 110.304 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.816 HG22 ' O ' ' A' ' 222' ' ' TRP . 4.1 t -65.17 -21.72 66.81 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.568 1.167 . . . . 72.430000000000007 110.383 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 1.1 mtm105 -77.85 -19.21 55.27 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.503 1.127 . . . . 72.519999999999996 110.275 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 227' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -87.39 -38.63 16.0 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.39 1.057 . . . . 70.329999999999998 109.316 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 9.6 mtm -60.2 -38.69 84.1 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.487 1.117 . . . . 73.450000000000003 110.989 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 229' ' ' VAL . . . . . 0.444 HG23 ' N ' ' A' ' 230' ' ' GLN . 29.4 m -70.86 -48.55 56.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 O-C-N 124.501 1.126 . . . . 61.210000000000001 109.281 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 230' ' ' GLN . . . . . 0.444 ' N ' HG23 ' A' ' 229' ' ' VAL . 0.0 OUTLIER -74.2 -5.6 42.88 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.449 1.093 . . . . 63.439999999999998 110.301 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -90.04 -82.42 0.27 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.595 1.184 . . . . 75.140000000000001 110.223 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 3.7 tp60 -141.36 35.86 1.68 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.547 1.154 . . . . 74.209999999999994 110.32 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -149.19 42.37 0.93 Allowed 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.465 1.103 . . . . 50.119999999999997 110.963 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 7.6 mm -53.2 150.74 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 O-C-N 124.488 1.118 . . . . 62.329999999999998 109.267 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.484 0 O-C-N 124.499 1.125 . . . . 75.140000000000001 109.35 179.922 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.493 ' C ' ' HB1' ' A' ' 235' ' ' ALA . . . . . . . . 0 CA--C 1.53 0.997 0 N-CA-C 110.959 -0.857 . . . . 74.340000000000003 110.959 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 159.6 41.22 Favored 'Trans proline' 0 C--N 1.36 1.137 0 O-C-N 124.483 1.78 . . . . 74.230000000000004 111.001 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.534 HD13 ' N ' ' A' ' 73' ' ' GLY . 1.1 tm? -105.45 126.55 52.25 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.501 1.126 . . . . 64.010000000000005 109.314 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.534 ' N ' HD13 ' A' ' 72' ' ' LEU . . . 56.69 82.0 0.06 OUTLIER Glycine 0 CA--C 1.531 1.032 0 O-C-N 124.515 1.134 . . . . 64.409999999999997 111.019 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.4 p -109.43 171.44 7.44 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.57 0.806 . . . . 74.219999999999999 109.995 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 76' ' ' GLU . 31.5 tp10 -56.69 153.21 10.89 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.502 1.126 . . . . 61.030000000000001 110.302 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.404 ' N ' ' HG3' ' A' ' 75' ' ' GLU . 2.1 tt0 -136.06 127.84 29.18 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.48 1.112 . . . . 64.030000000000001 110.281 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.592 HG22 ' H ' ' A' ' 79' ' ' LEU . 6.5 p -124.88 149.38 29.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 O-C-N 124.507 1.13 . . . . 74.310000000000002 109.274 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.415 ' O ' ' C ' ' A' ' 79' ' ' LEU . 34.1 t80 -80.38 12.76 2.77 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.463 1.102 . . . . 74.540000000000006 111.016 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.592 ' H ' HG22 ' A' ' 77' ' ' VAL . 15.5 tp -39.19 157.58 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.531 1.144 . . . . 71.400000000000006 109.299 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.834 ' HZ3' ' HA ' ' A' ' 106' ' ' ILE . 5.0 ptpt -100.83 -45.81 5.33 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.515 1.134 . . . . 70.349999999999994 109.333 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.833 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.7 OUTLIER -167.78 129.1 1.46 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.46 1.1 . . . . 73.299999999999997 110.963 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.953 HG12 HG22 ' A' ' 135' ' ' THR . 9.3 p -84.51 174.33 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.506 1.129 . . . . 74.140000000000001 109.317 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.861 ' CG2' ' HB1' ' A' ' 93' ' ' ALA . 2.1 mp -129.32 95.1 2.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.419 1.075 . . . . 70.439999999999998 109.344 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.814 HD11 ' HB3' ' A' ' 128' ' ' ALA . 1.0 OUTLIER -74.21 93.73 2.37 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.479 1.112 . . . . 74.409999999999997 109.232 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.706 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -112.85 174.49 5.87 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.49 1.119 . . . . 73.439999999999998 109.643 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.86 ' HB2' ' CD1' ' A' ' 143' ' ' PHE . . . -110.75 148.35 32.51 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.472 1.107 . . . . 62.530000000000001 109.276 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -50.3 -21.8 1.54 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.562 1.164 . . . . 74.519999999999996 110.411 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -77.37 -46.26 23.36 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.47 1.106 . . . . 72.439999999999998 109.299 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.68 ' CB ' HD12 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -117.05 44.46 2.07 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.581 1.176 . . . . 75.109999999999999 109.288 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.609 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -76.79 -44.1 34.12 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.478 1.112 . . . . 72.120000000000005 110.366 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -63.14 -37.67 88.13 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.487 1.117 . . . . 51.32 109.339 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.446 ' O ' ' N ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -55.63 -69.38 0.14 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.428 1.08 . . . . 61.299999999999997 110.339 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 1.154 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -47.73 -36.75 11.89 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.496 1.122 . . . . 52.229999999999997 109.268 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.646 HD23 ' O ' ' A' ' 94' ' ' LEU . 0.6 OUTLIER -67.7 -36.18 80.18 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.466 1.104 . . . . 75.420000000000002 109.364 179.936 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.446 ' N ' ' O ' ' A' ' 92' ' ' GLU . 17.5 tpp85 -61.0 -47.84 84.58 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.448 1.093 . . . . 73.540000000000006 110.32 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.622 HG21 ' HE1' ' A' ' 173' ' ' MET . 0.3 OUTLIER -69.59 -52.83 28.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.595 1.185 . . . . 74.140000000000001 109.31 179.993 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.549 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -51.8 -17.77 1.05 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.612 1.195 . . . . 71.150000000000006 110.347 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.411 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -81.83 -52.41 7.14 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.484 1.115 . . . . 74.209999999999994 109.27 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.827 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -68.16 -22.46 64.85 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.475 1.109 . . . . 74.430000000000007 109.328 -179.937 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.827 ' N ' HD23 ' A' ' 99' ' ' LEU . 32.8 mt -66.81 -48.36 69.19 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.46 1.1 . . . . 73.040000000000006 109.298 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -79.52 52.84 1.45 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.501 1.126 . . . . 72.420000000000002 110.323 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -175.97 -64.17 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.529 1.143 . . . . 62.409999999999997 109.263 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -46.01 -45.95 16.19 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.473 1.108 . . . . 63.210000000000001 109.283 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -116.47 -32.02 5.38 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.444 1.09 . . . . 70.519999999999996 111.01 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.404 ' CA ' ' HD3' ' A' ' 107' ' ' LYS . . . 108.15 37.9 2.07 Favored Glycine 0 CA--C 1.53 1.02 0 O-C-N 124.538 1.148 . . . . 73.439999999999998 111.015 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.834 ' HA ' ' HZ3' ' A' ' 80' ' ' LYS . 16.6 mm -78.56 74.87 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.516 0.774 . . . . 72.150000000000006 109.362 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.557 ' H ' ' NZ ' ' A' ' 80' ' ' LYS . 0.0 OUTLIER -126.92 155.99 74.76 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.516 1.135 . . . . 72.109999999999999 109.28 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.53 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.4 Cg_endo -74.94 161.22 95.27 Favored 'Cis proline' 0 C--N 1.36 1.152 0 C-N-CA 121.026 -2.489 . . . . 61.219999999999999 111.02 -0.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -117.6 119.3 4.38 Favored Glycine 0 CA--C 1.53 0.97 0 O-C-N 124.422 1.076 . . . . 61.450000000000003 111.036 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.402 HD11 ' C ' ' A' ' 114' ' ' GLU . 0.0 OUTLIER -138.95 128.59 31.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.469 0.746 . . . . 72.5 109.287 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.706 HD12 ' NE2' ' A' ' 85' ' ' HIS . 39.3 pt -89.28 174.4 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.456 1.097 . . . . 72.200000000000003 109.323 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.986 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 2.4 t80 -75.2 -18.65 60.1 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.418 1.074 . . . . 71.409999999999997 110.967 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.5 -3.11 53.53 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.493 1.121 . . . . 71.319999999999993 109.256 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.402 ' C ' HD11 ' A' ' 110' ' ' ILE . 23.5 mt-10 -107.65 -26.74 10.71 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.532 1.145 . . . . 71.129999999999995 110.281 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.455 ' HG3' ' CD2' ' A' ' 117' ' ' HIS . 35.6 tpp -41.72 110.77 0.81 Allowed Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.502 1.126 . . . . 74.25 111.011 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -74.92 115.35 4.26 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.479 1.779 . . . . 74.400000000000006 111.066 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.455 ' CD2' ' HG3' ' A' ' 115' ' ' MET . 12.2 m-70 -121.02 -176.34 3.25 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.511 1.132 . . . . 75.430000000000007 109.616 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -77.37 -146.86 2.56 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.526 1.141 . . . . 61.329999999999998 111.018 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 31.2 ttp85 -107.64 42.1 1.4 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.475 0.75 . . . . 74.109999999999999 110.276 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -122.79 158.91 29.19 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.528 1.143 . . . . 70.439999999999998 110.303 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . 0.419 ' CD2' ' H ' ' A' ' 121' ' ' HIS . 4.4 p80 -96.29 79.71 3.15 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.462 1.101 . . . . 72.209999999999994 109.587 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.618 ' C ' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -44.2 145.45 0.78 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.517 1.135 . . . . 74.239999999999995 109.322 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -132.13 11.04 4.6 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.494 1.121 . . . . 72.129999999999995 110.283 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -113.28 116.74 30.22 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.422 1.076 . . . . 71.019999999999996 109.351 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 1.04 HD11 HD11 ' A' ' 157' ' ' LEU . 3.6 pp -85.3 -17.25 37.44 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.567 1.167 . . . . 65.129999999999995 109.304 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -63.09 -14.3 46.7 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.566 1.166 . . . . 74.549999999999997 109.332 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.48 -48.79 65.7 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.438 1.087 . . . . 51.450000000000003 109.292 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.986 ' HB2' ' CE1' ' A' ' 112' ' ' PHE . . . -65.64 -22.71 66.67 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.499 1.124 . . . . 61.240000000000002 109.357 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.627 HG12 ' O ' ' A' ' 129' ' ' VAL . 70.9 t -86.6 10.04 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.517 1.136 . . . . 72.230000000000004 109.339 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -135.64 119.34 17.15 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 124.534 1.146 . . . . 75.219999999999999 109.302 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 91.76 47.98 3.29 Favored Glycine 0 CA--C 1.53 0.974 0 O-C-N 124.474 1.109 . . . . 51.420000000000002 111.033 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . 0.51 ' OG ' HD23 ' A' ' 79' ' ' LEU . 3.2 m -163.35 171.14 16.5 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.496 0.762 . . . . 75.310000000000002 109.956 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.525 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -104.85 -27.35 11.79 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.535 1.147 . . . . 60.43 109.251 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.587 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 6.6 m-90 -158.82 157.83 32.34 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.536 1.148 . . . . 74.230000000000004 108.0 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.953 HG22 HG12 ' A' ' 82' ' ' VAL . 6.3 p -140.56 128.77 22.31 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.5 1.125 . . . . 61.340000000000003 110.412 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.54 HD13 ' HE2' ' A' ' 81' ' ' PHE . 1.4 mp -84.07 149.6 4.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 124.423 1.077 . . . . 71.230000000000004 109.321 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.678 HD11 HG13 ' A' ' 170' ' ' VAL . 47.6 mt -131.35 108.02 9.35 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.507 1.13 . . . . 74.010000000000005 109.356 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 1.154 HD21 ' HB2' ' A' ' 93' ' ' ALA . 1.4 mm? -62.35 93.25 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.502 1.126 . . . . 63.32 109.306 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.853 HD21 HG23 ' A' ' 185' ' ' THR . 6.3 tp -69.12 99.15 1.08 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.55 1.156 . . . . 73.140000000000001 109.334 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.427 ' O ' ' N ' ' A' ' 144' ' ' LEU . 2.5 m -127.05 162.68 25.47 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.568 1.167 . . . . 71.219999999999999 110.401 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -69.41 -29.95 67.81 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.5 1.125 . . . . 70.5 110.329 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -89.61 -25.06 21.49 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.457 1.098 . . . . 62.229999999999997 109.318 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.86 ' CD1' ' HB2' ' A' ' 86' ' ' ALA . 82.0 t80 -90.16 -19.8 23.82 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.472 1.107 . . . . 73.019999999999996 111.016 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.584 ' C ' HD13 ' A' ' 144' ' ' LEU . 2.7 tm? -53.62 -67.61 0.24 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.602 1.188 . . . . 75.430000000000007 109.292 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.49 ' N ' HD13 ' A' ' 144' ' ' LEU . 54.6 mmm-85 -57.98 -16.38 12.25 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.545 1.153 . . . . 61.43 110.273 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -77.47 -34.68 54.27 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.522 1.139 . . . . 52.100000000000001 109.336 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.855 HG21 ' CE2' ' A' ' 143' ' ' PHE . 2.1 p -102.87 -8.3 20.85 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.555 1.16 . . . . 73.329999999999998 110.406 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.424 ' HA ' ' CE3' ' A' ' 148' ' ' TRP . 0.3 OUTLIER -95.85 -25.35 16.05 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.077 -1.082 . . . . 62.229999999999997 108.077 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 16.8 t -92.53 -37.71 12.34 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.534 1.146 . . . . 71.340000000000003 108.275 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.516 ' O ' ' CG ' ' A' ' 154' ' ' TYR . 68.7 m-20 -68.47 -49.65 58.25 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.52 1.137 . . . . 73.439999999999998 109.255 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.789 ' CD1' HD13 ' A' ' 157' ' ' LEU . 6.4 m-30 -60.88 -55.33 34.34 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.505 1.128 . . . . 63.210000000000001 111.007 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 30.3 tp60 -48.1 -47.74 34.16 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.517 1.136 . . . . 54.310000000000002 110.323 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -74.1 -20.3 60.31 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.495 1.122 . . . . 74.239999999999995 110.962 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.516 ' CG ' ' O ' ' A' ' 150' ' ' ASN . 15.8 m-30 -117.79 83.2 1.95 Allowed 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.49 1.119 . . . . 71.420000000000002 111.032 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.3 t -49.7 -22.84 1.49 Allowed 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.429 1.081 . . . . 73.25 110.364 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 11.3 p -62.03 -40.58 96.22 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.49 1.119 . . . . 65.340000000000003 109.992 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 1.04 HD11 HD11 ' A' ' 125' ' ' LEU . 6.4 mt -68.5 -47.41 67.07 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.441 1.088 . . . . 65.0 109.272 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' MET . . . . . 0.436 ' HE2' HG11 ' A' ' 161' ' ' VAL . 5.3 mmt -47.04 -33.04 4.45 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.512 1.133 . . . . 64.420000000000002 111.0 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -66.11 -44.76 83.36 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 124.496 1.122 . . . . 52.340000000000003 109.328 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.542 ' HB3' HG21 ' A' ' 170' ' ' VAL . 1.4 m -71.83 -28.76 63.79 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.542 1.151 . . . . 74.239999999999995 110.011 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . 0.649 ' CG2' ' CE2' ' A' ' 151' ' ' PHE . 3.5 t -56.84 -18.08 6.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.508 1.13 . . . . 73.25 109.318 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . 0.479 ' O ' ' N ' ' A' ' 164' ' ' GLN . 1.5 t-20 -90.61 20.97 4.24 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.491 1.12 . . . . 74.140000000000001 109.354 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.422 ' C ' ' O ' ' A' ' 162' ' ' ASN . 0.1 OUTLIER 36.43 31.79 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.492 1.12 . . . . 71.450000000000003 110.294 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . 0.479 ' N ' ' O ' ' A' ' 162' ' ' ASN . 34.1 mt-30 -38.34 132.03 1.12 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.471 1.107 . . . . 65.430000000000007 110.224 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.527 ' CG ' ' O ' ' A' ' 165' ' ' HIS . 5.4 p80 -69.47 72.2 0.32 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.513 1.133 . . . . 73.430000000000007 109.565 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.44 ' O ' ' NE2' ' A' ' 218' ' ' GLN . 0.5 OUTLIER -125.13 -178.7 4.28 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.467 1.104 . . . . 63.299999999999997 109.336 179.928 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' TYR . . . . . 0.467 ' CD1' ' HB2' ' A' ' 168' ' ' ASN . 37.8 p90 -49.82 -35.83 24.38 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.662 1.226 . . . . 73.0 111.029 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.467 ' HB2' ' CD1' ' A' ' 167' ' ' TYR . 2.9 t30 -117.12 129.41 55.95 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.52 1.138 . . . . 74.299999999999997 109.323 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.451 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 0.4 OUTLIER -119.87 155.59 32.37 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.436 1.085 . . . . 62.509999999999998 109.992 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.804 ' C ' HD12 ' A' ' 171' ' ' ILE . 18.5 t -118.82 122.06 68.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.437 1.086 . . . . 54.210000000000001 109.26 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.804 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -127.1 112.84 21.71 Favored Pre-proline 0 C--N 1.324 -0.522 0 O-C-N 124.503 1.127 . . . . 71.340000000000003 109.348 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.719 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.96 106.6 2.3 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.518 1.799 . . . . 75.329999999999998 111.024 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . 0.647 ' CE ' HD12 ' A' ' 195' ' ' LEU . 11.0 ttt -82.92 166.32 18.99 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.531 1.144 . . . . 74.329999999999998 110.943 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . 0.424 ' N ' ' HG2' ' A' ' 173' ' ' MET . 17.0 mmm-85 -131.21 126.47 21.47 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.485 1.115 . . . . 74.209999999999994 110.356 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' PRO . . . . . 0.489 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.4 Cg_endo -75.01 163.18 35.83 Favored 'Trans proline' 0 C--N 1.36 1.14 0 O-C-N 124.481 1.78 . . . . 73.439999999999998 110.984 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.921 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -94.85 -47.19 6.56 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.531 1.144 . . . . 73.540000000000006 109.289 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -71.27 -25.27 62.39 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.533 1.146 . . . . 63.350000000000001 109.365 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' ASN . . . . . 0.489 ' CB ' ' HG2' ' A' ' 175' ' ' PRO . 7.5 m-80 -109.39 100.95 43.78 Favored Pre-proline 0 C--N 1.325 -0.496 0 O-C-N 124.551 1.157 . . . . 72.519999999999996 109.305 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.03 138.92 23.59 Favored 'Trans proline' 0 C--N 1.361 1.205 0 O-C-N 124.488 1.783 . . . . 72.310000000000002 111.037 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.436 ' HA ' HD22 ' A' ' 180' ' ' LEU . 0.4 OUTLIER -141.18 96.76 7.08 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.465 1.103 . . . . 73.430000000000007 109.314 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.95 166.31 29.51 Favored 'Trans proline' 0 C--N 1.361 1.22 0 O-C-N 124.51 1.795 . . . . 42.409999999999997 111.039 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 26.2 mtm105 -60.38 -26.72 66.86 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.467 1.104 . . . . 70.519999999999996 110.283 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -61.49 -18.74 60.42 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.514 1.134 . . . . 72.409999999999997 110.367 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -113.09 -0.59 14.66 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.508 1.13 . . . . 63.130000000000003 110.265 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 185' ' ' THR . . . . . 0.853 HG23 HD21 ' A' ' 139' ' ' LEU . 20.6 m -108.53 143.66 27.94 Favored Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.493 1.12 . . . . 53.149999999999999 110.368 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . 0.819 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.5 Cg_endo -74.95 155.78 43.18 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.428 1.751 . . . . 75.310000000000002 111.027 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 187' ' ' PHE . . . . . 0.502 ' O ' ' CG2' ' A' ' 191' ' ' THR . 49.3 p90 -69.45 -7.27 36.43 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.541 1.151 . . . . 73.120000000000005 111.024 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.81 -52.91 4.23 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.551 1.157 . . . . 45.43 109.305 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.819 HD12 ' CG ' ' A' ' 186' ' ' PRO . 44.6 mt -68.57 -42.3 78.49 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.515 1.134 . . . . 71.340000000000003 109.285 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 190' ' ' GLN . . . . . 0.426 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.3 pt20 -63.73 -11.09 23.26 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.551 1.157 . . . . 75.439999999999998 110.334 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 191' ' ' THR . . . . . 0.502 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 35.5 p -113.35 6.91 17.49 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.451 1.095 . . . . 61.329999999999998 110.383 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.476 ' CG2' ' N ' ' A' ' 193' ' ' ASN . 7.5 mt -103.79 162.2 4.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.465 1.103 . . . . 74.310000000000002 109.315 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 193' ' ' ASN . . . . . 0.476 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 30.8 p-10 -66.57 74.44 0.1 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.553 1.158 . . . . 75.109999999999999 109.251 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . 0.719 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -79.3 128.58 33.5 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.617 1.198 . . . . 61.030000000000001 109.298 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 195' ' ' LEU . . . . . 0.647 HD12 ' CE ' ' A' ' 173' ' ' MET . 0.3 OUTLIER -68.47 124.8 24.56 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.45 1.094 . . . . 51.340000000000003 109.241 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -109.18 111.18 22.65 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.468 1.105 . . . . 72.319999999999993 110.379 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.921 ' HG3' HD21 ' A' ' 176' ' ' LEU . 35.6 tp10 -87.7 -22.45 24.63 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.547 1.154 . . . . 75.310000000000002 110.278 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . 0.482 ' HB3' HD12 ' A' ' 176' ' ' LEU . 7.3 pt-20 -95.08 22.86 6.16 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.451 1.095 . . . . 74.439999999999998 110.275 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 4.0 t -127.58 143.91 51.12 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.548 1.155 . . . . 74.129999999999995 109.936 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 55.1 mtt180 -58.79 -20.93 54.38 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.537 1.148 . . . . 71.230000000000004 110.29 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -88.77 11.53 68.46 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.517 1.136 . . . . 54.329999999999998 110.97 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 202' ' ' PHE . . . . . 0.848 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.1 OUTLIER -53.45 -45.19 98.64 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.531 0.783 . . . . 71.420000000000002 110.976 179.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 203' ' ' PRO . . . . . 0.594 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.07 -37.89 1.8 Allowed 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.518 1.799 . . . . 70.400000000000006 110.944 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.49 -49.54 72.28 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.506 1.129 . . . . 44.130000000000003 110.367 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -68.86 -41.35 78.53 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.51 1.131 . . . . 74.219999999999999 110.314 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 206' ' ' VAL . . . . . 0.848 HG23 ' O ' ' A' ' 202' ' ' PHE . 69.3 t -64.64 -27.37 42.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.476 1.11 . . . . 75.030000000000001 109.283 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -80.64 -51.1 9.1 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.45 1.094 . . . . 72.439999999999998 110.349 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 87.6 mtt-85 -64.43 -62.31 1.68 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.461 1.101 . . . . 73.430000000000007 110.278 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 209' ' ' ILE . . . . . 0.815 HG22 ' CE1' ' A' ' 210' ' ' PHE . 90.9 mt -46.87 -44.75 7.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.454 1.096 . . . . 75.109999999999999 109.286 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 210' ' ' PHE . . . . . 0.815 ' CE1' HG22 ' A' ' 209' ' ' ILE . 1.3 m-85 -111.92 67.82 0.66 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.521 1.138 . . . . 74.420000000000002 111.066 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 211' ' ' GLN . . . . . 0.528 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.1 OUTLIER -110.7 143.61 40.92 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.508 1.13 . . . . 62.049999999999997 110.267 -179.937 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.456 ' O ' ' N ' ' A' ' 215' ' ' TYR . 23.8 tt0 -49.58 -54.66 16.95 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.403 1.064 . . . . 70.120000000000005 110.273 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.89 -24.29 0.98 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.571 1.169 . . . . 72.120000000000005 110.005 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.528 HG23 ' HG2' ' A' ' 211' ' ' GLN . 40.0 t -96.15 -29.71 3.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.489 1.118 . . . . 71.310000000000002 109.294 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 215' ' ' TYR . . . . . 0.456 ' N ' ' O ' ' A' ' 212' ' ' GLU . 6.3 t80 -64.5 -34.08 77.38 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.477 1.111 . . . . 72.519999999999996 111.006 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp -55.59 -59.88 4.21 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 71.010000000000005 109.326 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 217' ' ' THR . . . . . 1.058 HG22 HD11 ' A' ' 221' ' ' ILE . 99.2 m -58.43 -66.45 0.49 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.523 1.139 . . . . 70.420000000000002 110.386 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 218' ' ' GLN . . . . . 0.821 ' HA ' HD12 ' A' ' 221' ' ' ILE . 28.0 mm-40 -39.44 -40.48 0.83 Allowed 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.527 1.142 . . . . 71.420000000000002 110.313 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 219' ' ' GLN . . . . . 0.449 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 16.9 tp60 -65.96 -46.66 77.32 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.441 1.088 . . . . 70.430000000000007 110.254 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 220' ' ' THR . . . . . 0.456 ' N ' ' O ' ' A' ' 217' ' ' THR . 1.3 m -68.04 -23.1 64.94 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.506 1.129 . . . . 63.299999999999997 110.435 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 221' ' ' ILE . . . . . 1.058 HD11 HG22 ' A' ' 217' ' ' THR . 17.1 mt -78.6 -32.5 16.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 O-C-N 124.508 1.13 . . . . 75.510000000000005 109.33 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 222' ' ' TRP . . . . . 0.973 ' O ' HG22 ' A' ' 225' ' ' THR . 26.5 t90 -71.13 -50.59 31.94 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.539 1.15 . . . . 63.219999999999999 108.038 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.95 -18.04 63.85 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.425 1.078 . . . . 62.149999999999999 109.285 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -92.63 -28.1 16.91 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.47 1.106 . . . . 75.340000000000003 110.28 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.973 HG22 ' O ' ' A' ' 222' ' ' TRP . 6.2 t -62.87 -20.38 65.06 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.453 1.095 . . . . 32.149999999999999 110.362 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 1.8 mtm180 -77.8 -16.46 58.34 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.514 1.134 . . . . 72.239999999999995 110.343 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 227' ' ' ASN . . . . . 0.448 ' O ' ' N ' ' A' ' 231' ' ' ARG . 1.0 OUTLIER -87.15 -41.37 13.82 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.496 1.123 . . . . 72.439999999999998 109.266 179.972 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 8.8 mtt -58.81 -41.06 85.92 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.528 1.142 . . . . 75.219999999999999 111.009 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 229' ' ' VAL . . . . . 0.46 HG13 ' N ' ' A' ' 230' ' ' GLN . 8.3 p -67.19 -48.72 77.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.486 1.116 . . . . 72.219999999999999 109.316 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 230' ' ' GLN . . . . . 0.46 ' N ' HG13 ' A' ' 229' ' ' VAL . 2.6 tp60 -77.54 -2.67 36.78 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.464 1.102 . . . . 73.099999999999994 110.305 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 231' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 227' ' ' ASN . 10.4 tpt180 -92.04 -75.02 0.49 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.535 1.147 . . . . 55.130000000000003 110.324 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -149.54 39.78 0.82 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.477 1.11 . . . . 70.5 110.274 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 233' ' ' PHE . . . . . 0.407 ' O ' HG23 ' A' ' 229' ' ' VAL . 0.1 OUTLIER -151.22 39.15 0.66 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 63.43 110.938 179.964 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.465 HD12 ' H ' ' A' ' 234' ' ' ILE . 2.0 mp -42.16 161.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 O-C-N 124.527 1.142 . . . . 70.409999999999997 109.288 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 235' ' ' ALA . . . . . 0.493 ' HB1' ' C ' ' A' ' 70' ' ' GLY . . . . . . . . 0 C--N 1.325 -0.473 0 O-C-N 124.453 1.096 . . . . 62.039999999999999 109.317 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.975 0 N-CA-C 111.018 -0.833 . . . . 62.009999999999998 111.018 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.02 177.04 9.13 Favored 'Trans proline' 0 C--N 1.36 1.175 0 O-C-N 124.442 1.759 . . . . 71.439999999999998 111.03 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.53 138.73 41.72 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.483 1.114 . . . . 73.430000000000007 109.297 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 37.9 58.47 1.51 Allowed Glycine 0 CA--C 1.53 1.027 0 O-C-N 124.477 1.11 . . . . 63.200000000000003 110.956 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.32 169.56 13.59 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.53 0.782 . . . . 72.25 109.992 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 76' ' ' GLU . 16.8 tp10 -88.48 163.44 15.93 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.537 1.148 . . . . 75.019999999999996 110.288 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.409 ' N ' ' HG3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -131.64 143.87 50.63 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.496 1.123 . . . . 64.099999999999994 110.277 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.41 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 5.8 p -174.65 159.2 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.47 1.106 . . . . 61.310000000000002 109.329 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.404 ' O ' ' C ' ' A' ' 79' ' ' LEU . 55.1 p90 -88.56 24.37 1.99 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.436 1.085 . . . . 74.230000000000004 110.966 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.404 ' C ' ' O ' ' A' ' 78' ' ' PHE . 6.6 tp -40.14 152.77 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.463 1.102 . . . . 74.340000000000003 109.27 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.54 ' HD3' HG23 ' A' ' 106' ' ' ILE . 6.4 ttmt -92.43 -60.29 1.87 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.522 1.139 . . . . 71.219999999999999 109.281 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.557 ' CE1' HD11 ' A' ' 83' ' ' ILE . 0.4 OUTLIER -162.14 138.69 7.95 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.532 1.145 . . . . 72.540000000000006 110.969 179.996 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.628 HG11 ' O ' ' A' ' 128' ' ' ALA . 2.8 p -89.63 160.23 2.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 O-C-N 124.567 1.167 . . . . 73.319999999999993 109.347 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.557 HD11 ' CE1' ' A' ' 81' ' ' PHE . 4.3 mp -118.13 92.46 2.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.499 1.124 . . . . 73.239999999999995 109.33 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.611 HD13 HD12 ' A' ' 125' ' ' LEU . 6.1 mt -70.18 118.73 13.38 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.54 1.15 . . . . 73.25 109.291 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.821 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -143.89 174.53 10.75 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.463 1.102 . . . . 73.219999999999999 109.574 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -110.85 152.1 27.07 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.463 1.102 . . . . 73.219999999999999 109.273 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.09 -18.34 5.33 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.439 1.087 . . . . 70.409999999999997 110.277 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -69.97 -46.35 65.42 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.586 1.179 . . . . 65.239999999999995 109.225 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.435 ' CG ' ' ND2' ' A' ' 178' ' ' ASN . 2.5 m-20 -130.16 43.76 3.07 Favored 'General case' 0 C--N 1.323 -0.557 0 O-C-N 124.497 1.123 . . . . 73.030000000000001 109.319 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.606 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -73.91 -20.85 60.27 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.54 1.15 . . . . 72.310000000000002 110.412 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -81.44 -39.13 25.34 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.568 1.167 . . . . 71.409999999999997 109.301 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -59.86 -50.46 73.7 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 124.535 1.147 . . . . 71.109999999999999 110.261 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 1.053 ' HB2' ' CD2' ' A' ' 138' ' ' LEU . . . -59.93 -35.09 74.17 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.446 1.091 . . . . 61.420000000000002 109.286 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.997 ' HB2' HD13 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -68.66 -44.62 73.72 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.518 1.136 . . . . 64.25 109.306 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.705 ' N ' HD13 ' A' ' 94' ' ' LEU . 8.8 tpt180 -48.94 -31.57 7.56 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.58 1.175 . . . . 62.310000000000002 110.261 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.823 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.1 t -78.64 -65.26 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.557 1.16 . . . . 61.310000000000002 109.288 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.761 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -40.3 -27.35 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.486 1.117 . . . . 75.129999999999995 110.315 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.455 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.3 t-20 -71.75 -60.48 2.21 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.475 1.11 . . . . 73.040000000000006 109.288 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.852 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -61.6 -22.55 65.32 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.542 1.151 . . . . 74.219999999999999 109.339 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.852 ' N ' HD23 ' A' ' 99' ' ' LEU . 26.7 mt -65.59 -50.81 63.73 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.492 1.12 . . . . 74.230000000000004 109.277 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -76.97 55.69 1.14 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.469 1.105 . . . . 71.510000000000005 110.311 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.0 t70 179.71 -63.29 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.489 1.118 . . . . 73.140000000000001 109.299 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.559 ' HB3' ' CD1' ' A' ' 104' ' ' PHE . 64.0 t0 -43.99 -53.71 6.03 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.488 1.117 . . . . 75.319999999999993 109.292 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.683 ' CE1' HG11 ' A' ' 206' ' ' VAL . 0.3 OUTLIER -113.43 -23.87 9.61 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.496 1.123 . . . . 64.120000000000005 111.014 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.98 37.68 4.33 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.509 1.131 . . . . 50.25 111.036 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.54 HG23 ' HD3' ' A' ' 80' ' ' LYS . 8.1 mm -81.97 81.14 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.436 0.727 . . . . 75.129999999999995 109.362 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.516 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -128.21 156.76 76.06 Favored Pre-proline 0 C--N 1.325 -0.459 0 O-C-N 124.537 1.148 . . . . 65.239999999999995 109.276 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.516 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.93 152.89 98.8 Favored 'Cis proline' 0 C--N 1.36 1.141 0 C-N-CA 121.052 -2.479 . . . . 74.140000000000001 111.015 -0.062 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.436 ' O ' ' NE2' ' A' ' 97' ' ' GLN . . . -119.28 110.86 1.95 Allowed Glycine 0 CA--C 1.531 1.043 0 O-C-N 124.513 1.133 . . . . 62.329999999999998 111.018 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.445 ' CD1' ' HA ' ' A' ' 115' ' ' MET . 0.3 OUTLIER -129.02 144.68 37.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.54 0.788 . . . . 72.239999999999995 109.32 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.997 HD13 ' HB2' ' A' ' 94' ' ' LEU . 20.7 pt -97.16 -177.3 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.499 1.124 . . . . 71.329999999999998 109.275 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.509 ' CD1' ' SD ' ' A' ' 115' ' ' MET . 2.2 t80 -81.77 -18.85 42.73 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.464 1.103 . . . . 62.119999999999997 110.964 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -96.44 -2.55 45.2 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.479 1.112 . . . . 73.129999999999995 109.312 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.595 ' HG2' HD11 ' A' ' 111' ' ' ILE . 67.1 mm-40 -110.44 -26.69 9.39 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.465 1.103 . . . . 73.530000000000001 110.328 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.509 ' SD ' ' CD1' ' A' ' 112' ' ' PHE . 1.2 ptp -70.02 135.03 87.4 Favored Pre-proline 0 C--N 1.325 -0.462 0 O-C-N 124.534 1.146 . . . . 50.450000000000003 111.016 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.93 122.04 6.99 Favored 'Trans proline' 0 C--N 1.36 1.163 0 O-C-N 124.51 1.795 . . . . 53.450000000000003 111.004 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -90.73 159.9 16.1 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.495 1.122 . . . . 70.200000000000003 109.591 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -101.73 -9.58 42.93 Favored Glycine 0 CA--C 1.531 1.06 0 O-C-N 124.566 1.167 . . . . 53.420000000000002 110.954 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 22.4 mtp85 -138.26 147.77 44.0 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.526 0.78 . . . . 75.540000000000006 110.314 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -49.56 -42.07 43.28 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.531 1.144 . . . . 72.230000000000004 110.255 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -93.69 138.62 31.71 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.528 1.143 . . . . 73.409999999999997 109.624 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.718 HD13 ' N ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -127.77 36.18 4.38 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.465 1.103 . . . . 71.230000000000004 109.282 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -63.29 -16.03 59.07 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.478 1.111 . . . . 73.230000000000004 110.324 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -86.48 106.48 17.51 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.507 1.129 . . . . 73.549999999999997 109.338 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.643 HD22 ' CG ' ' A' ' 150' ' ' ASN . 1.0 OUTLIER -83.9 -17.36 41.02 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.489 1.118 . . . . 65.030000000000001 109.296 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.407 ' O ' ' N ' ' A' ' 129' ' ' VAL . 10.9 t70 -49.69 -37.49 29.05 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.47 1.106 . . . . 74.209999999999994 109.26 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -50.88 -41.31 58.14 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.551 1.157 . . . . 74.099999999999994 109.335 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.628 ' O ' HG11 ' A' ' 82' ' ' VAL . . . -69.99 -26.44 64.08 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.493 1.12 . . . . 74.420000000000002 109.246 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.662 HG12 ' O ' ' A' ' 129' ' ' VAL . 63.1 t -89.11 14.38 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.509 1.131 . . . . 64.239999999999995 109.281 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -111.55 140.06 46.47 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.464 1.102 . . . . 75.219999999999999 109.272 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . 0.484 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 39.29 77.78 0.06 OUTLIER Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.485 1.116 . . . . 23.550000000000001 110.98 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -163.48 167.02 22.04 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.475 0.75 . . . . 75.219999999999999 110.017 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.76 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -95.67 -36.0 11.38 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.549 1.156 . . . . 71.430000000000007 109.285 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.76 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.1 m-90 -161.57 170.13 20.42 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.505 1.128 . . . . 74.319999999999993 108.039 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 56.2 p -138.78 138.19 37.37 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.573 1.171 . . . . 63.030000000000001 110.41 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.744 ' O ' HD22 ' A' ' 137' ' ' LEU . 39.2 mm -84.35 140.97 15.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.491 1.119 . . . . 63.549999999999997 109.28 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.744 HD22 ' O ' ' A' ' 136' ' ' ILE . 3.3 mm? -128.61 86.97 2.51 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.509 1.131 . . . . 53.530000000000001 109.323 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 1.053 ' CD2' ' HB2' ' A' ' 93' ' ' ALA . 0.3 OUTLIER -62.74 88.06 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.48 1.112 . . . . 74.530000000000001 109.306 -179.99 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.709 HD22 ' O ' ' A' ' 137' ' ' LEU . 0.6 OUTLIER -61.81 116.64 4.99 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.503 1.127 . . . . 64.019999999999996 109.246 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.628 HG23 ' OD1' ' A' ' 178' ' ' ASN . 7.4 m -136.41 169.69 17.26 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.491 1.12 . . . . 71.530000000000001 110.381 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -64.25 -39.74 94.58 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.559 1.162 . . . . 75.519999999999996 110.275 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . 0.441 ' CG ' ' N ' ' A' ' 143' ' ' PHE . 7.9 p30 -89.54 -46.74 8.46 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.45 1.094 . . . . 73.329999999999998 109.279 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.783 ' CE1' HG21 ' A' ' 147' ' ' THR . 7.1 t80 -53.07 -25.94 14.47 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.481 1.113 . . . . 64.129999999999995 110.951 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.705 ' C ' HD13 ' A' ' 144' ' ' LEU . 1.8 tm? -54.46 -68.11 0.21 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.54 1.15 . . . . 75.349999999999994 109.319 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.459 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 28.5 mmm180 -65.94 -14.33 61.38 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.415 1.072 . . . . 61.409999999999997 110.313 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -70.69 -51.87 24.82 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.511 1.132 . . . . 74.230000000000004 109.349 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.783 HG21 ' CE1' ' A' ' 143' ' ' PHE . 4.3 p -92.75 -52.99 4.35 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.513 1.133 . . . . 74.310000000000002 110.422 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.568 ' CH2' ' HB2' ' A' ' 186' ' ' PRO . 20.5 t-105 -41.87 -47.4 4.22 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.565 1.165 . . . . 71.25 107.977 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . 0.459 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 7.4 t -69.85 -44.54 69.66 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.436 1.085 . . . . 52.240000000000002 108.322 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.643 ' CG ' HD22 ' A' ' 125' ' ' LEU . 34.2 t-20 -51.7 -29.52 18.63 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.465 1.103 . . . . 73.349999999999994 109.302 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.564 ' CD1' ' HG ' ' A' ' 157' ' ' LEU . 8.2 m-30 -77.6 -44.94 26.73 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.472 1.108 . . . . 75.319999999999993 111.005 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 42.2 tp60 -41.46 -39.73 1.59 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.437 1.086 . . . . 74.150000000000006 110.256 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -80.78 -34.3 34.27 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.453 1.096 . . . . 74.420000000000002 110.959 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.441 ' N ' ' O ' ' A' ' 151' ' ' PHE . 3.3 m-85 -117.05 87.52 2.72 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.558 1.161 . . . . 75.230000000000004 111.015 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 2.3 t -60.14 -25.17 65.3 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.451 1.095 . . . . 63.100000000000001 110.368 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 54.7 p -58.57 -16.88 17.62 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 124.527 1.142 . . . . 63.32 109.998 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.564 ' HG ' ' CD1' ' A' ' 151' ' ' PHE . 0.2 OUTLIER -75.85 -51.73 11.91 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.451 1.094 . . . . 73.519999999999996 109.316 -179.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' MET . . . . . 0.487 ' CE ' HG21 ' A' ' 161' ' ' VAL . 5.6 mmt -50.04 -32.99 16.79 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.436 1.085 . . . . 63.420000000000002 110.962 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -64.16 -38.6 91.63 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.524 1.14 . . . . 74.450000000000003 109.312 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.663 ' HB2' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -66.19 -33.1 75.0 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.555 1.159 . . . . 73.430000000000007 109.948 -179.962 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . 0.859 ' O ' HD13 ' A' ' 192' ' ' ILE . 48.3 t -59.09 -18.16 13.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.425 1.078 . . . . 61.409999999999997 109.358 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 30.8 m-20 -77.95 -27.71 49.35 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.46 1.1 . . . . 64.109999999999999 109.308 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.559 ' HE ' HD11 ' A' ' 171' ' ' ILE . 21.3 mtp180 68.78 29.06 5.3 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.464 1.102 . . . . 71.140000000000001 110.253 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . 0.404 ' O ' ' O ' ' A' ' 163' ' ' ARG . 8.8 mt-30 -50.75 -177.84 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.527 1.142 . . . . 72.230000000000004 110.315 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -78.93 70.64 5.3 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.577 1.173 . . . . 75.310000000000002 109.567 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.681 ' HA ' HG21 ' A' ' 221' ' ' ILE . 0.1 OUTLIER -123.92 177.47 5.75 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.496 1.122 . . . . 74.219999999999999 109.353 179.974 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' TYR . . . . . . . . . . . . . 49.9 p90 -90.02 29.85 1.16 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.489 1.118 . . . . 75.219999999999999 110.957 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.467 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 3.5 p30 -169.56 108.8 0.42 Allowed 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.435 1.085 . . . . 70.239999999999995 109.29 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.474 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 6.3 m -102.04 164.04 11.92 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.436 1.085 . . . . 73.420000000000002 110.003 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.838 ' O ' HD12 ' A' ' 171' ' ' ILE . 76.0 t -130.5 125.03 58.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 124.459 1.099 . . . . 53.32 109.273 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.838 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.5 mp -131.48 113.75 15.61 Favored Pre-proline 0 C--N 1.326 -0.445 0 O-C-N 124.475 1.109 . . . . 61.039999999999999 109.237 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.664 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.04 111.72 3.39 Favored 'Trans proline' 0 C--N 1.36 1.139 0 O-C-N 124.539 1.81 . . . . 64.430000000000007 110.975 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . 0.823 ' HE1' HG21 ' A' ' 96' ' ' VAL . 4.5 ttt -92.74 152.08 19.69 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.531 1.144 . . . . 72.019999999999996 111.004 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . 0.421 ' N ' ' HG2' ' A' ' 173' ' ' MET . 21.2 mtp180 -110.85 116.66 51.7 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.546 1.154 . . . . 74.510000000000005 110.239 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' PRO . . . . . 0.419 ' C ' HD23 ' A' ' 176' ' ' LEU . 18.3 Cg_endo -75.01 164.61 33.01 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.474 1.776 . . . . 74.439999999999998 111.006 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.879 HD22 ' HB3' ' A' ' 198' ' ' GLU . 0.1 OUTLIER -104.02 -44.4 5.02 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.597 1.186 . . . . 72.200000000000003 109.264 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -72.13 -20.81 61.56 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.409 1.068 . . . . 73.25 109.266 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' ASN . . . . . 0.628 ' OD1' HG23 ' A' ' 140' ' ' THR . 0.6 OUTLIER -110.2 107.49 58.64 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.539 1.149 . . . . 71.409999999999997 109.293 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 118.12 5.15 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.549 1.815 . . . . 72.439999999999998 111.041 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.576 HD13 ' HB2' ' A' ' 184' ' ' ARG . 1.1 tm? -140.42 96.56 7.78 Favored Pre-proline 0 C--N 1.325 -0.475 0 O-C-N 124.505 1.128 . . . . 73.430000000000007 109.28 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.95 168.23 25.3 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.47 1.774 . . . . 72.219999999999999 111.025 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -56.48 -27.69 57.7 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.435 1.084 . . . . 72.129999999999995 110.302 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -61.35 -26.56 67.9 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 124.474 1.109 . . . . 64.400000000000006 110.262 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 184' ' ' ARG . . . . . 0.576 ' HB2' HD13 ' A' ' 180' ' ' LEU . 69.0 mmt-85 -96.4 -24.51 16.1 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.455 1.097 . . . . 60.140000000000001 110.288 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 185' ' ' THR . . . . . 0.507 HG22 ' HD2' ' A' ' 186' ' ' PRO . 18.9 m -74.77 143.94 79.25 Favored Pre-proline 0 C--N 1.325 -0.468 0 O-C-N 124.436 1.085 . . . . 72.129999999999995 110.396 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . 0.743 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -74.94 155.41 43.21 Favored 'Trans proline' 0 C--N 1.36 1.142 0 O-C-N 124.476 1.777 . . . . 75.129999999999995 110.983 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 187' ' ' PHE . . . . . 0.498 ' O ' ' CG2' ' A' ' 191' ' ' THR . 17.1 p90 -69.76 -6.89 35.15 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.461 1.101 . . . . 75.310000000000002 111.035 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . 0.544 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -94.37 -52.96 4.11 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.491 1.12 . . . . 75.430000000000007 109.289 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.743 HD12 ' CG ' ' A' ' 186' ' ' PRO . 51.5 mt -68.45 -42.08 79.31 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.378 1.049 . . . . 74.120000000000005 109.268 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 190' ' ' GLN . . . . . 0.416 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.3 pt20 -64.48 -10.09 23.03 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.485 1.116 . . . . 73.230000000000004 110.327 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 191' ' ' THR . . . . . 0.498 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 39.9 p -115.08 11.12 16.32 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.545 1.153 . . . . 64.150000000000006 110.343 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.859 HD13 ' O ' ' A' ' 161' ' ' VAL . 4.0 mt -125.46 148.82 29.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.457 1.098 . . . . 74.209999999999994 109.255 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 193' ' ' ASN . . . . . 0.663 ' OD1' HD11 ' A' ' 209' ' ' ILE . 54.5 t-20 -47.55 102.64 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.392 1.058 . . . . 60.439999999999998 109.254 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . 0.664 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -99.54 129.84 45.74 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.499 1.124 . . . . 65.409999999999997 109.327 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 195' ' ' LEU . . . . . 0.83 HD23 HD12 ' A' ' 209' ' ' ILE . 0.6 OUTLIER -66.58 136.9 56.3 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.49 1.119 . . . . 73.450000000000003 109.316 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . 0.448 ' CB ' ' HB3' ' A' ' 199' ' ' SER . 31.3 mt-10 -114.93 131.48 56.87 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.463 1.102 . . . . 73.109999999999999 110.325 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.751 ' HG2' HD11 ' A' ' 176' ' ' LEU . 3.4 tt0 -109.47 -23.19 11.64 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.492 1.12 . . . . 61.409999999999997 110.321 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . 0.879 ' HB3' HD22 ' A' ' 176' ' ' LEU . 0.0 OUTLIER -107.09 8.44 30.22 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.483 1.115 . . . . 72.150000000000006 110.269 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . 0.448 ' HB3' ' CB ' ' A' ' 196' ' ' GLU . 28.6 t -99.91 163.49 12.43 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.545 1.153 . . . . 75.040000000000006 109.982 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 200' ' ' ARG . . . . . 0.431 ' NE ' ' HA ' ' A' ' 200' ' ' ARG . 5.8 tpm_? -75.81 -20.83 57.88 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.477 1.111 . . . . 74.019999999999996 110.301 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -99.88 26.26 25.12 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.53 1.143 . . . . 70.409999999999997 111.045 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 202' ' ' PHE . . . . . 0.81 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.2 OUTLIER -60.87 -43.9 93.08 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.483 0.755 . . . . 71.010000000000005 110.983 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 203' ' ' PRO . . . . . 0.616 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -74.96 -37.89 1.85 Allowed 'Trans proline' 0 C--N 1.361 1.19 0 O-C-N 124.447 1.761 . . . . 61.509999999999998 110.944 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.04 -57.99 9.47 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.558 1.161 . . . . 65.420000000000002 110.431 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 205' ' ' GLN . . . . . 0.441 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 1.1 mt-30 -59.57 -45.64 91.25 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.45 1.094 . . . . 74.310000000000002 110.293 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 206' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 202' ' ' PHE . 55.0 t -56.48 -33.8 39.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 O-C-N 124.477 1.11 . . . . 74.430000000000007 109.269 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -73.57 -60.0 2.45 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.496 1.123 . . . . 64.5 110.241 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 80.5 mtt-85 -56.06 -63.38 1.2 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.538 1.149 . . . . 74.150000000000006 110.332 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 209' ' ' ILE . . . . . 0.83 HD12 HD23 ' A' ' 195' ' ' LEU . 25.7 mt -46.45 -62.46 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.554 1.159 . . . . 72.209999999999994 109.339 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 210' ' ' PHE . . . . . 0.781 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.8 m-85 -97.09 68.8 2.29 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.502 1.126 . . . . 73.239999999999995 111.034 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 211' ' ' GLN . . . . . 0.553 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -110.79 144.52 39.65 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.497 1.123 . . . . 74.109999999999999 110.299 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 215' ' ' TYR . 39.6 tt0 -49.21 -55.16 13.41 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.479 1.112 . . . . 64.420000000000002 110.355 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.26 -23.96 1.04 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.452 1.095 . . . . 33.310000000000002 110.005 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.553 HG23 ' HG2' ' A' ' 211' ' ' GLN . 40.6 t -96.25 -29.19 3.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.412 1.07 . . . . 63.520000000000003 109.237 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 215' ' ' TYR . . . . . 0.45 ' N ' ' O ' ' A' ' 212' ' ' GLU . 5.8 t80 -62.98 -32.42 73.76 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.469 1.106 . . . . 73.310000000000002 110.966 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 45.6 mmtt -63.33 -46.95 84.24 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.51 1.131 . . . . 74.409999999999997 109.27 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 217' ' ' THR . . . . . 0.902 HG22 HD11 ' A' ' 221' ' ' ILE . 87.9 m -53.49 -66.45 0.39 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.457 1.098 . . . . 63.140000000000001 110.372 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 218' ' ' GLN . . . . . 0.501 ' HA ' HD12 ' A' ' 221' ' ' ILE . 12.5 mp0 -55.5 -18.54 7.43 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.451 1.094 . . . . 74.420000000000002 110.23 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 219' ' ' GLN . . . . . 0.438 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 23.8 tp60 -84.62 -33.31 23.33 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 124.471 1.107 . . . . 75.209999999999994 110.28 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 220' ' ' THR . . . . . 0.461 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 3.0 m -82.42 -28.93 31.06 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.508 1.13 . . . . 43.310000000000002 110.458 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 221' ' ' ILE . . . . . 0.902 HD11 HG22 ' A' ' 217' ' ' THR . 8.9 mt -75.07 -34.67 32.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.462 1.101 . . . . 53.119999999999997 109.323 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 222' ' ' TRP . . . . . 0.81 ' O ' HG22 ' A' ' 225' ' ' THR . 35.8 t90 -71.51 -57.84 4.05 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.492 1.12 . . . . 72.319999999999993 107.985 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.461 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -52.74 -24.09 8.06 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.522 1.139 . . . . 74.209999999999994 109.239 179.989 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -88.16 -32.9 18.4 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.501 1.126 . . . . 62.119999999999997 110.373 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.81 HG22 ' O ' ' A' ' 222' ' ' TRP . 2.4 t -61.01 -19.43 61.32 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.48 1.113 . . . . 43.200000000000003 110.407 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -77.87 -16.77 58.01 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.455 1.097 . . . . 73.400000000000006 110.214 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 227' ' ' ASN . . . . . 0.407 ' O ' ' N ' ' A' ' 231' ' ' ARG . 1.2 m-80 -86.81 -41.33 14.15 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.464 1.102 . . . . 74.329999999999998 109.239 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 52.7 mtm -58.26 -39.47 79.27 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.579 1.175 . . . . 63.200000000000003 111.027 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 229' ' ' VAL . . . . . 0.457 HG13 ' N ' ' A' ' 230' ' ' GLN . 13.4 p -68.81 -48.86 68.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.538 1.149 . . . . 71.530000000000001 109.295 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 230' ' ' GLN . . . . . 0.457 ' N ' HG13 ' A' ' 229' ' ' VAL . 0.0 OUTLIER -76.88 -1.27 27.6 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.448 1.092 . . . . 70.510000000000005 110.256 -179.942 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 231' ' ' ARG . . . . . 0.407 ' N ' ' O ' ' A' ' 227' ' ' ASN . 12.9 tpp180 -95.06 -77.56 0.47 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.476 1.11 . . . . 63.299999999999997 110.262 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -146.72 43.48 1.17 Allowed 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.444 1.09 . . . . 74.150000000000006 110.323 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -155.0 34.93 0.39 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.403 1.064 . . . . 71.439999999999998 110.953 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 58.8 mt -52.6 153.01 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.469 1.106 . . . . 64.109999999999999 109.289 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.499 0 O-C-N 124.491 1.119 . . . . 52.240000000000002 109.314 179.993 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.992 0 N-CA-C 110.967 -0.853 . . . . 62.420000000000002 110.967 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.89 169.41 22.66 Favored 'Trans proline' 0 C--N 1.36 1.175 0 O-C-N 124.48 1.779 . . . . 44.200000000000003 111.039 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.564 HD22 ' HB1' ' A' ' 235' ' ' ALA . 0.2 OUTLIER -73.19 -59.93 2.48 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.59 1.181 . . . . 72.420000000000002 109.29 179.956 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -162.44 89.47 0.11 Allowed Glycine 0 CA--C 1.53 0.999 0 O-C-N 124.519 1.137 . . . . 73.409999999999997 111.021 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.9 p -110.08 150.16 28.98 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.533 0.784 . . . . 63.100000000000001 110.049 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -39.63 127.92 1.97 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.466 1.104 . . . . 71.109999999999999 110.309 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.533 ' OE1' ' CH2' ' A' ' 222' ' ' TRP . 0.3 OUTLIER -97.44 156.15 16.6 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.513 1.133 . . . . 74.209999999999994 110.324 179.987 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.59 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 7.3 p -176.14 161.8 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.522 1.139 . . . . 74.239999999999995 109.262 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.436 ' N ' HG22 ' A' ' 77' ' ' VAL . 31.9 t80 -86.83 18.25 3.58 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.473 1.108 . . . . 74.239999999999995 110.969 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.413 ' HB2' HG13 ' A' ' 77' ' ' VAL . 3.9 tp -39.31 157.33 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.498 1.124 . . . . 74.420000000000002 109.318 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.852 ' HD3' HG22 ' A' ' 106' ' ' ILE . 4.9 ptmm? -104.69 -51.59 3.04 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.472 1.108 . . . . 71.420000000000002 109.335 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.603 ' HE2' HD11 ' A' ' 136' ' ' ILE . 0.2 OUTLIER -167.51 142.83 3.94 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.479 1.112 . . . . 73.310000000000002 111.043 179.99 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.57 HG22 ' H ' ' A' ' 83' ' ' ILE . 7.4 p -97.98 172.7 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.51 1.131 . . . . 64.340000000000003 109.272 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.883 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.3 mp -129.55 96.87 3.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.481 1.113 . . . . 71.5 109.288 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.465 ' HG ' ' CB ' ' A' ' 128' ' ' ALA . 5.5 mt -70.41 117.62 12.18 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.537 1.148 . . . . 74.519999999999996 109.317 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.765 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -142.22 174.57 10.49 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.559 1.162 . . . . 73.519999999999996 109.622 179.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.565 ' HB2' ' CD1' ' A' ' 143' ' ' PHE . . . -117.0 149.55 40.07 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.492 1.12 . . . . 63.549999999999997 109.282 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.08 -21.34 1.83 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.459 1.099 . . . . 73.420000000000002 110.28 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -66.66 -45.87 77.52 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.543 1.152 . . . . 60.520000000000003 109.304 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.409 ' O ' HD23 ' A' ' 138' ' ' LEU . 5.9 t0 -132.0 44.22 2.93 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.453 1.096 . . . . 74.519999999999996 109.328 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.619 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -74.73 -23.83 58.63 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.466 1.104 . . . . 73.140000000000001 110.44 179.955 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -76.3 -39.04 55.18 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.464 1.103 . . . . 75.099999999999994 109.264 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.409 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 0.1 OUTLIER -61.57 -50.54 72.2 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.482 1.114 . . . . 71.219999999999999 110.285 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 1.047 ' HB2' ' CD2' ' A' ' 138' ' ' LEU . . . -59.71 -27.95 66.9 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.569 1.168 . . . . 63.310000000000002 109.348 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.935 HD22 ' O ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -82.87 -33.38 27.02 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.524 1.14 . . . . 61.310000000000002 109.323 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.624 ' N ' HD13 ' A' ' 94' ' ' LEU . 9.3 tpp180 -57.16 -28.51 62.82 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.517 1.136 . . . . 72.329999999999998 110.368 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.842 HG21 ' HE1' ' A' ' 173' ' ' MET . 1.7 t -84.48 -65.35 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.435 1.085 . . . . 75.519999999999996 109.324 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.587 ' HA ' HD12 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -39.99 -28.12 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.538 1.149 . . . . 63.119999999999997 110.319 179.993 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.442 ' N ' ' O ' ' A' ' 96' ' ' VAL . 2.1 t-20 -69.85 -52.67 22.91 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.504 1.128 . . . . 74.129999999999995 109.252 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.822 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -71.03 -21.58 62.25 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.549 1.155 . . . . 71.340000000000003 109.355 179.981 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.822 ' N ' HD23 ' A' ' 99' ' ' LEU . 25.4 mt -60.15 -58.23 9.44 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.508 1.13 . . . . 70.099999999999994 109.277 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.477 ' HB2' ' CE ' ' A' ' 107' ' ' LYS . 5.6 pt20 -75.28 59.13 1.0 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.534 1.146 . . . . 64.230000000000004 110.336 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -178.2 -64.06 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.439 1.087 . . . . 53.310000000000002 109.241 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -49.73 -50.68 43.19 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.491 1.119 . . . . 73.420000000000002 109.324 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.565 ' CZ ' HG11 ' A' ' 206' ' ' VAL . 2.6 m-85 -114.42 -22.47 9.84 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.494 1.121 . . . . 64.140000000000001 110.997 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.49 44.7 3.93 Favored Glycine 0 CA--C 1.53 1.021 0 O-C-N 124.524 1.14 . . . . 44.409999999999997 110.987 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.852 HG22 ' HD3' ' A' ' 80' ' ' LYS . 3.6 mm -86.97 87.66 2.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.476 0.75 . . . . 73.209999999999994 109.323 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.51 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -132.36 158.5 75.46 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.555 1.159 . . . . 70.140000000000001 109.28 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.51 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.01 167.06 81.6 Favored 'Cis proline' 0 C--N 1.36 1.175 0 C-N-CA 121.033 -2.486 . . . . 73.420000000000002 110.979 0.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.75 129.07 6.06 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.547 1.155 . . . . 74.409999999999997 110.989 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.4 HD11 ' C ' ' A' ' 114' ' ' GLU . 0.0 OUTLIER -148.05 132.4 9.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.502 0.766 . . . . 72.040000000000006 109.318 179.989 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.78 HD13 ' HB2' ' A' ' 94' ' ' LEU . 44.2 pt -91.83 -178.35 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.457 1.098 . . . . 65.200000000000003 109.318 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -81.53 -19.1 42.84 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.522 1.139 . . . . 70.549999999999997 111.006 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -91.54 -3.05 56.92 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.455 1.097 . . . . 74.129999999999995 109.332 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.4 ' C ' HD11 ' A' ' 110' ' ' ILE . 9.7 mm-40 -109.79 -26.75 9.66 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.465 1.103 . . . . 52.25 110.314 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 23.4 tpp -39.93 111.06 0.69 Allowed Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.571 1.169 . . . . 74.299999999999997 111.017 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.99 112.02 3.46 Favored 'Trans proline' 0 C--N 1.36 1.16 0 O-C-N 124.479 1.779 . . . . 75.129999999999995 111.021 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.765 ' CE1' ' CD2' ' A' ' 121' ' ' HIS . 54.2 m-70 -41.97 160.34 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.512 1.132 . . . . 73.530000000000001 109.654 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -103.02 -68.48 0.79 Allowed Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.53 1.144 . . . . 63.229999999999997 110.969 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 17.3 tpp180 -106.31 -73.52 0.68 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.5 0.765 . . . . 75.329999999999998 110.331 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -114.83 -75.11 0.59 Allowed 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.483 1.115 . . . . 72.120000000000005 110.337 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . 0.765 ' CD2' ' CE1' ' A' ' 117' ' ' HIS . 63.6 t-80 -159.42 173.65 15.91 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.49 1.119 . . . . 62.549999999999997 109.567 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.728 ' C ' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -131.17 146.04 52.19 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.568 1.168 . . . . 71.310000000000002 109.299 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -129.09 14.91 6.26 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.494 1.121 . . . . 63.100000000000001 110.304 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -110.24 131.22 55.25 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.507 1.129 . . . . 63.229999999999997 109.287 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.0 -17.19 47.74 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.497 1.123 . . . . 42.5 109.263 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.438 ' O ' ' N ' ' A' ' 129' ' ' VAL . 2.4 t70 -64.44 -22.24 66.9 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.526 1.141 . . . . 75.230000000000004 109.29 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -49.91 -23.48 1.98 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.501 1.126 . . . . 75.120000000000005 109.363 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.465 ' CB ' ' HG ' ' A' ' 84' ' ' LEU . . . -89.3 -33.16 17.03 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.469 1.105 . . . . 62.130000000000003 109.261 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.739 HG12 ' O ' ' A' ' 129' ' ' VAL . 73.6 t -92.94 30.48 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.499 1.124 . . . . 65.420000000000002 109.299 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -135.29 118.89 16.99 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.544 1.152 . . . . 74.329999999999998 109.234 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . 0.561 ' HA2' ' CD1' ' A' ' 222' ' ' TRP . . . 66.59 62.97 4.17 Favored Glycine 0 CA--C 1.531 1.033 0 O-C-N 124.51 1.131 . . . . 73.209999999999994 111.009 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -154.92 -176.87 6.15 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.552 0.796 . . . . 75.540000000000006 110.068 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.746 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -113.23 -32.22 6.36 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.438 1.086 . . . . 73.299999999999997 109.235 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.746 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.4 m-90 -161.48 160.2 28.93 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.489 1.118 . . . . 73.239999999999995 107.997 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.9 p -132.82 131.49 41.1 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.487 1.117 . . . . 63.450000000000003 110.428 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.883 ' HB ' HG23 ' A' ' 83' ' ' ILE . 9.8 mm -84.6 138.64 18.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.524 1.14 . . . . 74.030000000000001 109.334 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.766 HD11 HG13 ' A' ' 170' ' ' VAL . 4.1 mt -130.34 94.5 3.68 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.477 1.111 . . . . 62.229999999999997 109.341 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 1.047 ' CD2' ' HB2' ' A' ' 93' ' ' ALA . 0.5 OUTLIER -62.55 99.63 0.15 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.528 1.142 . . . . 64.230000000000004 109.32 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.583 HD21 ' HB2' ' A' ' 172' ' ' PRO . 0.4 OUTLIER -63.55 116.35 5.54 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.43 1.081 . . . . 64.409999999999997 109.334 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.588 HG22 ' H ' ' A' ' 141' ' ' GLU . 5.8 m -139.4 179.69 6.4 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.559 1.162 . . . . 72.519999999999996 110.397 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.588 ' H ' HG22 ' A' ' 140' ' ' THR . 5.5 mp0 -84.87 -36.67 21.39 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.482 1.114 . . . . 74.150000000000006 110.227 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -88.44 -32.82 18.09 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.494 1.121 . . . . 74.109999999999999 109.308 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.739 ' O ' HG23 ' A' ' 147' ' ' THR . 51.1 t80 -72.44 -36.75 68.63 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.437 1.086 . . . . 72.329999999999998 110.926 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.711 HD13 ' N ' ' A' ' 145' ' ' ARG . 1.5 tm? -54.7 -67.49 0.26 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.533 1.145 . . . . 71.219999999999999 109.32 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.711 ' N ' HD13 ' A' ' 144' ' ' LEU . 0.0 OUTLIER -55.39 -18.4 6.7 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.551 1.157 . . . . 73.420000000000002 110.312 -179.975 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.69 -32.93 25.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.466 1.104 . . . . 64.430000000000007 109.321 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.739 HG23 ' O ' ' A' ' 143' ' ' PHE . 80.8 p -97.39 -7.02 32.76 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.552 1.158 . . . . 44.340000000000003 110.388 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.549 ' CH2' ' HB2' ' A' ' 186' ' ' PRO . 0.1 OUTLIER -94.24 -26.55 16.59 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.951 -1.129 . . . . 74.129999999999995 107.951 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 51.6 t -95.62 -26.39 15.77 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.488 1.117 . . . . 63.439999999999998 108.316 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 9.6 m-20 -77.92 -42.79 31.97 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.506 1.129 . . . . 72.150000000000006 109.347 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.71 ' CE2' HD12 ' A' ' 157' ' ' LEU . 4.0 m-85 -69.39 -51.08 40.11 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 72.450000000000003 110.981 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -46.6 -47.78 19.84 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.518 1.136 . . . . 73.349999999999994 110.266 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -68.83 -22.66 64.22 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.54 1.15 . . . . 72.129999999999995 110.983 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -118.9 91.94 3.68 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.464 1.103 . . . . 73.030000000000001 110.949 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.6 t -60.87 -15.65 32.93 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.537 1.148 . . . . 44.039999999999999 110.372 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 93.0 p -69.86 -20.7 63.4 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.449 1.093 . . . . 70.140000000000001 109.966 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.748 ' O ' HG23 ' A' ' 161' ' ' VAL . 0.0 OUTLIER -86.27 -37.17 18.84 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.563 1.164 . . . . 73.010000000000005 109.279 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' MET . . . . . 0.535 ' CE ' HG11 ' A' ' 161' ' ' VAL . 18.4 mmt -62.95 -11.58 19.67 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.517 1.136 . . . . 71.510000000000005 111.001 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -62.47 -68.48 0.33 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.513 1.133 . . . . 71.200000000000003 109.29 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.467 ' HB2' ' CG2' ' A' ' 170' ' ' VAL . 0.0 OUTLIER -59.19 -34.21 71.86 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.506 1.129 . . . . 74.510000000000005 110.042 179.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . 0.813 ' CG1' ' HB1' ' A' ' 188' ' ' ALA . 87.5 t -55.68 -18.99 5.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.516 1.135 . . . . 71.340000000000003 109.357 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -92.03 35.7 0.98 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.555 1.16 . . . . 74.219999999999999 109.278 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.466 ' CD ' ' CG1' ' A' ' 192' ' ' ILE . 0.1 OUTLIER 40.18 64.31 0.93 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.494 1.121 . . . . 72.299999999999997 110.294 -179.998 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -96.28 -174.78 3.16 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.479 1.112 . . . . 73.329999999999998 110.293 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 31.9 p80 -141.72 55.75 1.5 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.479 1.112 . . . . 73.299999999999997 109.598 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.2 tptm -90.89 -175.46 4.36 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.497 1.123 . . . . 74.129999999999995 109.272 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' TYR . . . . . 1.164 ' CD1' HG22 ' A' ' 221' ' ' ILE . 10.8 m-85 -37.65 -46.86 0.91 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.435 1.084 . . . . 74.349999999999994 110.893 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.435 ' ND2' ' O ' ' A' ' 129' ' ' VAL . 0.6 OUTLIER -112.58 164.11 13.71 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.467 1.104 . . . . 74.439999999999998 109.305 -179.99 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.467 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 5.9 m -124.66 175.11 7.42 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.515 1.135 . . . . 72.409999999999997 110.057 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.803 ' O ' HD12 ' A' ' 171' ' ' ILE . 2.1 t -133.88 122.44 42.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 O-C-N 124.491 1.119 . . . . 75.430000000000007 109.319 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.907 HG12 HG21 ' A' ' 209' ' ' ILE . 1.4 mp -132.72 103.24 13.36 Favored Pre-proline 0 C--N 1.324 -0.506 0 O-C-N 124.583 1.177 . . . . 72.439999999999998 109.254 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.583 ' HB2' HD21 ' A' ' 139' ' ' LEU . 18.3 Cg_endo -74.99 112.65 3.61 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.51 1.795 . . . . 72.109999999999999 111.025 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . 0.842 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.5 ttt -92.92 157.55 16.29 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.443 1.089 . . . . 73.150000000000006 110.961 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . 0.439 ' N ' ' HG2' ' A' ' 173' ' ' MET . 1.4 mpt_? -113.54 120.26 39.96 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.511 1.132 . . . . 75.340000000000003 110.288 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' PRO . . . . . 0.474 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.3 Cg_endo -75.01 154.47 42.46 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.455 1.766 . . . . 70.5 110.963 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.907 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -88.22 -43.21 11.77 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.528 1.143 . . . . 74.219999999999999 109.249 -179.996 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -72.23 -27.15 62.34 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.461 1.101 . . . . 72.310000000000002 109.296 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' ASN . . . . . 0.474 ' CB ' ' HG2' ' A' ' 175' ' ' PRO . 9.8 m-20 -110.33 99.39 40.15 Favored Pre-proline 0 C--N 1.325 -0.483 0 O-C-N 124.484 1.115 . . . . 74.319999999999993 109.279 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -74.97 124.61 8.77 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.493 1.786 . . . . 74.129999999999995 111.058 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.487 HD22 ' HA ' ' A' ' 180' ' ' LEU . 0.4 OUTLIER -136.0 96.34 13.02 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.531 1.145 . . . . 71.010000000000005 109.304 -179.983 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -75.07 171.7 17.79 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.481 1.78 . . . . 73.040000000000006 110.998 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 17.2 ptt180 -59.37 -32.27 69.97 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 65.519999999999996 110.255 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -60.74 -14.82 23.58 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.487 1.117 . . . . 75.299999999999997 110.328 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 184' ' ' ARG . . . . . 0.422 ' HB2' HD13 ' A' ' 180' ' ' LEU . 30.8 mmt180 -113.79 -28.61 7.37 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.48 1.113 . . . . 72.109999999999999 110.232 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 185' ' ' THR . . . . . . . . . . . . . 61.0 m -66.51 139.47 96.1 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.49 1.119 . . . . 71.239999999999995 110.422 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . 0.581 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -74.96 145.4 31.53 Favored 'Trans proline' 0 C--N 1.36 1.132 0 O-C-N 124.488 1.783 . . . . 52.420000000000002 110.997 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 187' ' ' PHE . . . . . 0.479 ' O ' ' CD1' ' A' ' 187' ' ' PHE . 5.2 t80 -59.73 -13.67 11.05 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.512 1.133 . . . . 72.230000000000004 110.985 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . 0.813 ' HB1' ' CG1' ' A' ' 161' ' ' VAL . . . -86.92 -53.77 4.71 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.509 1.131 . . . . 74.430000000000007 109.301 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.928 ' HA ' HD12 ' A' ' 192' ' ' ILE . 23.9 mt -76.57 -11.8 59.92 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.41 1.068 . . . . 74.5 109.261 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 190' ' ' GLN . . . . . 0.499 ' CG ' ' O ' ' A' ' 190' ' ' GLN . 4.7 tt0 -86.81 -0.78 57.03 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.494 1.121 . . . . 53.140000000000001 110.283 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 191' ' ' THR . . . . . 0.401 ' OG1' ' O ' ' A' ' 188' ' ' ALA . 3.4 p -115.72 -30.7 6.05 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.517 1.135 . . . . 74.540000000000006 110.426 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.928 HD12 ' HA ' ' A' ' 189' ' ' LEU . 7.2 mt -65.1 169.36 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.507 1.129 . . . . 74.230000000000004 109.3 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 193' ' ' ASN . . . . . 0.535 ' N ' HG22 ' A' ' 192' ' ' ILE . 5.7 m-20 -76.17 57.32 1.11 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.497 1.123 . . . . 54.439999999999998 109.32 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . 0.477 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -43.07 142.08 1.03 Allowed 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.451 1.094 . . . . 72.299999999999997 109.307 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 195' ' ' LEU . . . . . 0.594 HD12 ' CE ' ' A' ' 173' ' ' MET . 0.4 OUTLIER -88.9 126.1 35.24 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.499 1.125 . . . . 63.420000000000002 109.297 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . 0.404 ' HB3' ' CB ' ' A' ' 199' ' ' SER . 38.7 mt-10 -101.44 130.57 47.7 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.549 1.156 . . . . 72.420000000000002 110.326 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.907 ' HG3' HD21 ' A' ' 176' ' ' LEU . 8.8 tp10 -113.61 -23.94 9.49 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.517 1.135 . . . . 75.129999999999995 110.311 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -103.06 4.03 36.72 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.498 1.124 . . . . 72.010000000000005 110.296 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . 0.404 ' CB ' ' HB3' ' A' ' 196' ' ' GLU . 14.7 t -97.59 174.9 6.42 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.489 1.118 . . . . 70.349999999999994 109.98 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -70.64 -60.36 2.3 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.515 1.134 . . . . 73.200000000000003 110.244 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -78.82 51.34 3.76 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.459 1.099 . . . . 71.409999999999997 110.976 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 202' ' ' PHE . . . . . 0.614 ' CD1' ' C ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -78.39 -47.27 2.0 Allowed Pre-proline 0 C--N 1.325 -0.497 0 O-C-N 124.526 0.78 . . . . 74.150000000000006 110.972 -179.993 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 203' ' ' PRO . . . . . 0.654 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.3 Cg_endo -75.02 -27.44 9.97 Favored 'Trans proline' 0 C--N 1.36 1.145 0 O-C-N 124.444 1.76 . . . . 71.230000000000004 110.99 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.51 -50.77 71.38 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.615 1.197 . . . . 72.540000000000006 110.438 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 205' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 0.2 OUTLIER -58.75 -63.18 1.38 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.518 1.136 . . . . 75.120000000000005 110.31 -179.989 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 206' ' ' VAL . . . . . 0.776 HG21 HD22 ' A' ' 100' ' ' LEU . 2.7 p -38.82 -33.86 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.495 1.122 . . . . 71.200000000000003 109.304 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 207' ' ' GLU . . . . . 0.414 ' N ' ' C ' ' A' ' 205' ' ' GLN . 1.0 OUTLIER -76.39 -65.68 0.9 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.541 1.151 . . . . 71.510000000000005 110.283 -179.961 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 82.9 mtt-85 -47.82 -58.07 4.82 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.53 1.144 . . . . 71.540000000000006 110.276 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 209' ' ' ILE . . . . . 0.907 HG21 HG12 ' A' ' 171' ' ' ILE . 3.3 mt -52.56 -70.75 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.481 1.113 . . . . 73.109999999999999 109.341 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 210' ' ' PHE . . . . . 0.607 ' CD2' HG23 ' A' ' 206' ' ' VAL . 0.7 OUTLIER -84.9 65.28 9.11 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.534 1.146 . . . . 72.319999999999993 111.045 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 211' ' ' GLN . . . . . 0.447 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.2 OUTLIER -110.59 146.65 35.73 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.447 1.092 . . . . 65.109999999999999 110.262 -179.968 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' A' ' 215' ' ' TYR . 60.7 tt0 -48.33 -55.39 10.8 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 73.430000000000007 110.334 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.3 m -48.6 -25.23 1.64 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.544 1.152 . . . . 54.329999999999998 109.995 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.447 HG23 ' HG2' ' A' ' 211' ' ' GLN . 32.8 t -96.21 -26.35 4.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.485 1.116 . . . . 70.200000000000003 109.304 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 215' ' ' TYR . . . . . 0.455 ' N ' ' O ' ' A' ' 212' ' ' GLU . 8.5 t80 -69.27 -33.83 73.82 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.519 1.137 . . . . 75.430000000000007 110.987 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . 0.442 ' O ' ' N ' ' A' ' 220' ' ' THR . 4.2 mmtp -52.18 -54.84 25.92 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.486 1.116 . . . . 71.209999999999994 109.265 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 217' ' ' THR . . . . . 0.485 ' CG2' HD11 ' A' ' 221' ' ' ILE . 1.3 m -54.82 -65.19 0.62 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.478 1.111 . . . . 61.350000000000001 110.38 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 218' ' ' GLN . . . . . 0.657 ' HA ' HD12 ' A' ' 221' ' ' ILE . 3.2 mp0 -48.87 -28.35 3.7 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.472 1.107 . . . . 71.030000000000001 110.284 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 219' ' ' GLN . . . . . 0.417 ' NE2' ' HB2' ' A' ' 223' ' ' LYS . 39.1 tp60 -84.68 -27.75 26.85 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.483 1.115 . . . . 73.230000000000004 110.328 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 220' ' ' THR . . . . . 0.452 ' N ' ' O ' ' A' ' 217' ' ' THR . 1.0 OUTLIER -79.96 -17.41 53.03 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.529 1.143 . . . . 64.049999999999997 110.465 179.923 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 221' ' ' ILE . . . . . 1.164 HG22 ' CD1' ' A' ' 167' ' ' TYR . 7.4 mt -89.21 -45.58 15.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.559 1.162 . . . . 72.5 109.329 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 222' ' ' TRP . . . . . 0.59 ' CH2' ' O ' ' A' ' 77' ' ' VAL . 41.7 t90 -68.57 -18.74 64.4 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.573 1.171 . . . . 72.25 107.982 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.417 ' HB2' ' NE2' ' A' ' 219' ' ' GLN . 0.0 OUTLIER -90.76 -24.12 20.46 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.448 1.093 . . . . 62.049999999999997 109.271 -179.98 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -93.35 -19.45 21.33 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.495 1.122 . . . . 72.239999999999995 110.294 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.525 ' HB ' ' CE1' ' A' ' 167' ' ' TYR . 2.1 t -70.65 -32.4 69.67 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.516 1.135 . . . . 75.140000000000001 110.384 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -75.98 -16.44 59.98 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.48 1.113 . . . . 71.129999999999995 110.3 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 227' ' ' ASN . . . . . 0.443 ' O ' ' N ' ' A' ' 231' ' ' ARG . 0.8 OUTLIER -82.79 -56.79 3.63 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.519 1.137 . . . . 75.019999999999996 109.263 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 20.2 mtm -46.16 -47.61 17.56 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.56 1.162 . . . . 71.310000000000002 110.992 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 229' ' ' VAL . . . . . 0.423 HG13 ' N ' ' A' ' 230' ' ' GLN . 14.7 p -59.05 -47.72 89.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 O-C-N 124.502 1.126 . . . . 63.109999999999999 109.398 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 230' ' ' GLN . . . . . 0.423 ' N ' HG13 ' A' ' 229' ' ' VAL . 0.4 OUTLIER -84.03 9.8 11.57 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.466 1.104 . . . . 70.010000000000005 110.251 179.975 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 231' ' ' ARG . . . . . 0.443 ' N ' ' O ' ' A' ' 227' ' ' ASN . 7.8 tmm_? -108.05 -67.88 0.94 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.454 1.096 . . . . 72.540000000000006 110.305 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -152.43 39.74 0.58 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.515 1.135 . . . . 61.140000000000001 110.367 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -157.88 41.24 0.28 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.521 1.138 . . . . 73.310000000000002 111.024 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.405 ' CG1' ' O ' ' A' ' 229' ' ' VAL . 7.5 mt -60.25 154.68 3.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.445 1.091 . . . . 75.120000000000005 109.243 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 235' ' ' ALA . . . . . 0.564 ' HB1' HD22 ' A' ' 72' ' ' LEU . . . . . . . . 0 C--N 1.325 -0.498 0 O-C-N 124.513 1.133 . . . . 44.32 109.3 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.985 0 N-CA-C 111.03 -0.828 . . . . 52.329999999999998 111.03 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.99 166.06 30.01 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.494 1.786 . . . . 71.019999999999996 110.986 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.627 HD13 ' O ' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -95.13 -41.69 8.97 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.556 1.16 . . . . 73.209999999999994 109.326 179.955 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -157.38 84.94 0.13 Allowed Glycine 0 CA--C 1.529 0.959 0 O-C-N 124.452 1.095 . . . . 73.439999999999998 111.012 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.3 m -143.35 164.4 30.38 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.478 0.752 . . . . 72.299999999999997 110.017 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.405 ' HG3' ' N ' ' A' ' 76' ' ' GLU . 23.4 tp10 -80.38 149.28 30.27 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.541 1.151 . . . . 62.229999999999997 110.237 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.405 ' N ' ' HG3' ' A' ' 75' ' ' GLU . 0.9 OUTLIER -99.79 153.36 19.18 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.511 1.132 . . . . 70.140000000000001 110.322 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.61 ' O ' ' CZ2' ' A' ' 222' ' ' TRP . 3.2 p -176.23 165.0 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 O-C-N 124.531 1.144 . . . . 70.439999999999998 109.257 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.488 ' N ' HG22 ' A' ' 77' ' ' VAL . 5.8 t80 -87.75 26.9 1.22 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.511 1.132 . . . . 75.450000000000003 110.969 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.634 HD11 HG22 ' A' ' 110' ' ' ILE . 4.5 tp -41.03 160.89 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.538 1.149 . . . . 73.340000000000003 109.309 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.722 ' HD3' HG22 ' A' ' 106' ' ' ILE . 6.4 ptmt -111.9 -47.22 3.15 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.529 1.143 . . . . 71.329999999999998 109.336 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.664 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.2 OUTLIER -167.32 139.58 3.31 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.516 1.135 . . . . 74.019999999999996 110.998 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.737 ' CG1' HG22 ' A' ' 135' ' ' THR . 7.3 p -96.72 165.42 2.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.544 1.152 . . . . 64.349999999999994 109.322 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.822 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.3 mp -126.01 97.2 4.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.569 1.168 . . . . 63.450000000000003 109.283 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.697 HD11 ' CB ' ' A' ' 128' ' ' ALA . 10.9 mt -70.88 117.37 12.3 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.525 1.14 . . . . 74.200000000000003 109.341 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.671 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -138.66 174.26 10.72 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.449 1.093 . . . . 70.099999999999994 109.646 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.48 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -124.83 149.08 47.83 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.499 1.125 . . . . 54.530000000000001 109.306 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -44.6 -27.05 0.43 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.436 1.085 . . . . 70.010000000000005 110.262 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 57.3 t0 -66.62 -44.83 80.99 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.542 1.151 . . . . 70.420000000000002 109.309 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.452 ' N ' ' O ' ' A' ' 86' ' ' ALA . 22.9 m-20 -124.01 41.27 3.53 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.515 1.135 . . . . 74.099999999999994 109.296 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.596 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -70.51 -41.11 73.03 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.469 1.106 . . . . 74.120000000000005 110.442 179.947 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -69.92 -31.96 70.0 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.468 1.105 . . . . 74.510000000000005 109.319 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -60.16 -69.45 0.22 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.525 1.141 . . . . 74.140000000000001 110.288 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.827 ' HB2' HD22 ' A' ' 138' ' ' LEU . . . -46.09 -28.87 1.31 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.526 1.141 . . . . 52.210000000000001 109.269 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.498 ' HG ' HD13 ' A' ' 111' ' ' ILE . 0.7 OUTLIER -69.37 -57.63 5.04 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.516 1.135 . . . . 71.129999999999995 109.286 -179.977 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 11.4 tpp180 -41.4 -36.2 0.8 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.457 1.098 . . . . 74.519999999999996 110.347 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.887 HG21 ' HE1' ' A' ' 173' ' ' MET . 1.9 t -77.75 -65.15 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 O-C-N 124.493 1.121 . . . . 74.420000000000002 109.334 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.5 ' N ' HG12 ' A' ' 96' ' ' VAL . 0.1 OUTLIER -45.14 -21.84 0.09 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.52 1.138 . . . . 72.099999999999994 110.309 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.44 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.1 t-20 -78.57 -59.64 2.7 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.519 1.137 . . . . 71.409999999999997 109.3 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.845 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -61.8 -22.11 65.18 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.556 1.16 . . . . 70.129999999999995 109.312 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.845 ' N ' HD23 ' A' ' 99' ' ' LEU . 15.5 mt -64.64 -55.55 19.46 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.534 1.147 . . . . 44.420000000000002 109.252 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -78.82 54.01 1.47 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.506 1.129 . . . . 74.409999999999997 110.287 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -174.78 -67.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.515 1.135 . . . . 72.510000000000005 109.242 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -45.26 -51.86 10.29 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.523 1.14 . . . . 71.239999999999995 109.346 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.404 ' CE2' HG11 ' A' ' 206' ' ' VAL . 4.6 m-85 -113.4 -24.92 9.05 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.41 1.069 . . . . 75.219999999999999 110.942 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.406 ' C ' ' CD ' ' A' ' 107' ' ' LYS . . . 92.59 44.72 3.89 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.538 1.149 . . . . 53.32 111.031 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.722 HG22 ' HD3' ' A' ' 80' ' ' LYS . 8.5 mm -84.35 75.22 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 O-C-N 124.497 0.763 . . . . 72.420000000000002 109.35 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.536 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -119.56 156.38 53.51 Favored Pre-proline 0 C--N 1.326 -0.451 0 O-C-N 124.417 1.073 . . . . 71.209999999999994 109.282 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.536 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.95 161.36 94.99 Favored 'Cis proline' 0 C--N 1.359 1.111 0 C-N-CA 121.001 -2.499 . . . . 62.310000000000002 111.015 -0.048 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -135.91 118.7 1.89 Allowed Glycine 0 CA--C 1.53 0.995 0 O-C-N 124.422 1.076 . . . . 73.219999999999999 111.016 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.634 HG22 HD11 ' A' ' 79' ' ' LEU . 1.3 tt -136.06 149.89 27.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.55 0.794 . . . . 74.519999999999996 109.296 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.671 HD12 ' NE2' ' A' ' 85' ' ' HIS . 33.5 pt -98.11 161.0 3.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.439 1.087 . . . . 73.239999999999995 109.336 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.871 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 2.5 t80 -62.04 -19.21 62.66 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.52 1.138 . . . . 74.340000000000003 111.059 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.401 ' HB2' ' HE1' ' A' ' 85' ' ' HIS . . . -87.33 -11.6 48.96 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.517 1.136 . . . . 62.399999999999999 109.386 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.401 ' C ' HD11 ' A' ' 110' ' ' ILE . 7.7 mm-40 -104.08 -20.88 13.69 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.486 1.117 . . . . 73.409999999999997 110.321 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.471 ' CE ' ' CG2' ' A' ' 82' ' ' VAL . 21.9 tpp -44.57 134.36 4.66 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 124.464 1.102 . . . . 52.030000000000001 110.98 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.02 107.24 2.44 Favored 'Trans proline' 0 C--N 1.36 1.177 0 O-C-N 124.531 1.806 . . . . 54.43 110.992 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 21.0 m-70 -136.16 -175.8 4.11 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.432 1.083 . . . . 74.430000000000007 109.597 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -66.1 -159.32 0.66 Allowed Glycine 0 CA--C 1.53 1.02 0 O-C-N 124.488 1.117 . . . . 63.039999999999999 110.947 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 49.5 ttt-85 -93.56 50.84 1.51 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.496 0.762 . . . . 54.109999999999999 110.271 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -173.19 143.96 1.17 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.483 1.115 . . . . 65.450000000000003 110.287 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . 0.471 ' CG ' ' N ' ' A' ' 122' ' ' LEU . 28.6 t-80 -60.58 167.52 2.61 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.553 1.158 . . . . 72.099999999999994 109.603 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.872 HD22 ' O ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -144.55 119.0 9.64 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.41 1.069 . . . . 72.209999999999994 109.333 -179.996 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.497 HE21 ' ND2' ' A' ' 150' ' ' ASN . 3.7 tp60 -83.7 -13.97 52.82 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.484 1.115 . . . . 70.340000000000003 110.333 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.4 ' C ' ' O ' ' A' ' 123' ' ' GLN . 9.8 m120 -40.51 112.71 0.3 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.493 1.121 . . . . 73.409999999999997 109.294 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.769 ' HB2' HD11 ' A' ' 157' ' ' LEU . 0.1 OUTLIER -81.54 -50.63 9.15 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.476 1.11 . . . . 65.040000000000006 109.291 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.426 ' HA ' ' CG2' ' A' ' 129' ' ' VAL . 0.6 OUTLIER -41.31 -59.02 1.66 Allowed 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.481 1.113 . . . . 73.299999999999997 109.307 -179.996 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -43.64 -46.95 7.54 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.492 1.12 . . . . 71.549999999999997 109.333 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.871 ' HB2' ' CE1' ' A' ' 112' ' ' PHE . . . -61.52 -46.66 89.0 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.427 1.079 . . . . 73.209999999999994 109.268 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.706 ' HA ' HG21 ' A' ' 135' ' ' THR . 35.2 m -92.38 30.94 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 O-C-N 124.525 1.14 . . . . 63.399999999999999 109.309 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.403 ' N ' ' O ' ' A' ' 126' ' ' ASP . 8.9 t30 -148.46 118.48 7.2 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.494 1.121 . . . . 75.540000000000006 109.32 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 102.78 34.15 4.16 Favored Glycine 0 CA--C 1.53 1.028 0 O-C-N 124.515 1.135 . . . . 71.109999999999999 110.928 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . 0.403 ' O ' ' O ' ' A' ' 167' ' ' TYR . 0.7 OUTLIER -163.54 -173.81 3.46 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.503 0.767 . . . . 73.109999999999999 110.025 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' A' ' 80' ' ' LYS . . . -91.09 -68.59 0.78 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.456 1.097 . . . . 74.349999999999994 109.275 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.605 ' CH2' ' HA ' ' A' ' 210' ' ' PHE . 0.9 OUTLIER -121.52 174.86 6.51 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.509 1.131 . . . . 73.409999999999997 108.021 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.737 HG22 ' CG1' ' A' ' 82' ' ' VAL . 2.5 p -143.28 136.0 27.56 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.483 1.114 . . . . 51.409999999999997 110.374 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.822 ' HB ' HG23 ' A' ' 83' ' ' ILE . 14.5 mm -89.5 113.46 25.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.477 1.111 . . . . 71.219999999999999 109.29 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.693 HD11 ' CG1' ' A' ' 170' ' ' VAL . 2.8 mt -99.06 89.65 4.34 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.536 1.147 . . . . 75.239999999999995 109.278 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.827 HD22 ' HB2' ' A' ' 93' ' ' ALA . 2.4 tp -62.2 102.3 0.29 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.472 1.107 . . . . 65.120000000000005 109.286 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.562 HD13 HG23 ' A' ' 185' ' ' THR . 55.2 mt -77.37 121.24 23.5 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.461 1.101 . . . . 63.409999999999997 109.344 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.668 HG23 ' ND2' ' A' ' 178' ' ' ASN . 10.6 m -139.74 162.19 35.73 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.523 1.14 . . . . 70.530000000000001 110.397 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -53.65 -40.86 66.21 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.566 1.166 . . . . 74.430000000000007 110.295 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . 0.418 ' ND2' ' N ' ' A' ' 143' ' ' PHE . 2.5 p-10 -89.76 -52.32 5.05 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.442 1.089 . . . . 72.310000000000002 109.326 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.48 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 6.6 t80 -49.51 -27.64 4.58 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.481 1.113 . . . . 71.420000000000002 110.926 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.708 ' C ' HD13 ' A' ' 144' ' ' LEU . 2.1 tm? -63.0 -67.98 0.38 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.471 1.107 . . . . 60.450000000000003 109.336 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.463 ' CD ' ' C ' ' A' ' 145' ' ' ARG . 0.2 OUTLIER -65.32 -14.7 61.39 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.507 1.129 . . . . 71.310000000000002 110.242 -179.977 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . 0.418 ' N ' ' HD2' ' A' ' 145' ' ' ARG . 21.1 t0 -67.51 -60.64 2.4 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.498 1.124 . . . . 74.409999999999997 109.313 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.517 ' HB ' ' CE1' ' A' ' 151' ' ' PHE . 2.3 p -84.91 -47.52 10.22 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.519 1.137 . . . . 75.219999999999999 110.416 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.475 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 33.0 t-105 -45.7 -30.52 1.61 Allowed 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.517 1.136 . . . . 71.409999999999997 108.084 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . 0.452 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 40.5 t -78.47 -45.68 21.52 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.462 1.101 . . . . 75.319999999999993 108.27 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.497 ' ND2' HE21 ' A' ' 123' ' ' GLN . 17.2 m-80 -67.41 -13.66 62.22 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.475 1.109 . . . . 75.129999999999995 109.289 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.886 ' CE1' HD22 ' A' ' 157' ' ' LEU . 5.4 m-30 -80.62 -51.05 9.17 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.505 1.128 . . . . 70.239999999999995 111.025 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -50.91 -40.36 56.78 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.541 1.151 . . . . 73.340000000000003 110.349 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 51.4 t80 -83.8 -17.37 41.29 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.489 1.118 . . . . 62.399999999999999 111.017 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.429 ' CE2' ' HB3' ' A' ' 156' ' ' SER . 1.3 t80 -136.9 105.7 5.89 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.515 1.134 . . . . 72.109999999999999 110.946 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 4.0 t -78.06 -2.96 39.8 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.411 1.07 . . . . 53.340000000000003 110.461 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . 0.429 ' HB3' ' CE2' ' A' ' 154' ' ' TYR . 10.2 p -44.39 -49.42 9.68 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.474 1.109 . . . . 54.439999999999998 110.032 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.886 HD22 ' CE1' ' A' ' 151' ' ' PHE . 4.4 mp -70.76 -42.47 70.39 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.458 1.099 . . . . 71.209999999999994 109.278 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -50.57 -21.53 1.58 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.512 1.132 . . . . 73.510000000000005 111.002 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' ASN . . . . . 0.437 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 74.1 m-20 -82.87 -32.77 27.26 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.549 1.156 . . . . 73.340000000000003 109.289 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.605 ' HB2' HG21 ' A' ' 170' ' ' VAL . 6.0 m -79.88 -31.56 40.35 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.55 1.156 . . . . 74.040000000000006 110.014 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . 0.589 HG12 HD11 ' A' ' 192' ' ' ILE . 96.5 t -61.28 -18.59 18.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.482 1.114 . . . . 74.200000000000003 109.264 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -66.41 -20.54 66.09 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 124.526 1.141 . . . . 61.030000000000001 109.267 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.553 ' HD3' HG23 ' A' ' 192' ' ' ILE . 15.7 mmm-85 69.03 43.79 1.09 Allowed 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.543 1.152 . . . . 60.520000000000003 110.301 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . 0.437 ' NE2' ' O ' ' A' ' 159' ' ' ASN . 12.3 mt-30 -69.99 176.73 3.55 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.484 1.115 . . . . 62.039999999999999 110.255 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 11.2 m80 -90.69 39.58 0.99 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.523 1.14 . . . . 71.019999999999996 109.607 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -90.74 -178.73 5.34 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.53 1.144 . . . . 73.329999999999998 109.319 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' TYR . . . . . 0.515 ' HB3' HG22 ' A' ' 221' ' ' ILE . 0.4 OUTLIER -85.63 44.46 1.11 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.514 1.133 . . . . 73.150000000000006 110.976 -179.983 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.408 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 7.7 p30 -170.36 124.27 0.71 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.505 1.128 . . . . 60.409999999999997 109.301 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.461 ' O ' ' HA ' ' A' ' 134' ' ' TRP . 2.5 m -125.0 111.52 15.49 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.486 1.116 . . . . 54.520000000000003 110.017 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.776 ' C ' HD12 ' A' ' 171' ' ' ILE . 3.8 t -79.45 112.78 17.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.57 1.168 . . . . 52.109999999999999 109.296 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.776 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -129.15 102.53 18.79 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.524 1.14 . . . . 54.210000000000001 109.264 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.915 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.03 114.8 4.11 Favored 'Trans proline' 0 C--N 1.36 1.164 0 O-C-N 124.479 1.779 . . . . 51.409999999999997 111.056 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . 0.887 ' HE1' HG21 ' A' ' 96' ' ' VAL . 6.1 ttt -80.2 161.55 25.14 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.527 1.142 . . . . 75.230000000000004 110.982 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 195' ' ' LEU . 75.0 mtt-85 -107.63 112.1 62.39 Favored Pre-proline 0 C--N 1.326 -0.435 0 O-C-N 124.528 1.142 . . . . 73.439999999999998 110.259 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 175' ' ' PRO . . . . . 0.727 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -74.98 154.69 42.79 Favored 'Trans proline' 0 C--N 1.36 1.168 0 O-C-N 124.446 1.761 . . . . 72.439999999999998 110.987 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.901 HD11 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -100.36 -45.34 5.61 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.453 1.095 . . . . 45.43 109.312 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . 0.453 ' H ' ' ND2' ' A' ' 177' ' ' ASN . 2.1 p30 -72.73 -25.12 61.1 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 73.120000000000005 109.323 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 178' ' ' ASN . . . . . 0.668 ' ND2' HG23 ' A' ' 140' ' ' THR . 8.1 t-20 -108.75 101.7 44.89 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.507 1.129 . . . . 72.430000000000007 109.211 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.05 117.61 4.96 Favored 'Trans proline' 0 C--N 1.36 1.184 0 O-C-N 124.499 1.789 . . . . 64.400000000000006 111.001 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.482 HD22 ' HA ' ' A' ' 180' ' ' LEU . 0.9 OUTLIER -132.97 96.67 17.57 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.561 1.163 . . . . 61.549999999999997 109.279 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 181' ' ' PRO . . . . . 0.45 ' HG2' ' CG ' ' A' ' 183' ' ' GLU . 18.2 Cg_endo -75.04 164.31 33.54 Favored 'Trans proline' 0 C--N 1.36 1.18 0 O-C-N 124.471 1.774 . . . . 63.420000000000002 110.991 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.04 -38.98 54.79 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.473 1.108 . . . . 73.239999999999995 110.279 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . 0.45 ' CG ' ' HG2' ' A' ' 181' ' ' PRO . 4.4 pt-20 -49.45 -33.16 13.46 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.483 1.115 . . . . 74.239999999999995 110.325 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 184' ' ' ARG . . . . . 0.475 ' HB2' HD13 ' A' ' 180' ' ' LEU . 58.7 mmt-85 -91.83 -21.77 20.47 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.584 1.178 . . . . 73.230000000000004 110.317 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 185' ' ' THR . . . . . 0.562 HG23 HD13 ' A' ' 139' ' ' LEU . 19.4 m -84.36 143.86 42.54 Favored Pre-proline 0 C--N 1.325 -0.468 0 O-C-N 124.452 1.095 . . . . 74.409999999999997 110.412 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . 0.823 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -74.99 156.56 43.04 Favored 'Trans proline' 0 C--N 1.36 1.164 0 O-C-N 124.496 1.787 . . . . 63.420000000000002 111.007 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 187' ' ' PHE . . . . . 0.451 ' O ' ' CG2' ' A' ' 191' ' ' THR . 32.3 p90 -70.03 -7.03 37.71 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.493 1.121 . . . . 74.109999999999999 110.996 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . 0.473 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -94.26 -52.9 4.16 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.46 1.1 . . . . 63.219999999999999 109.23 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.823 HD12 ' CG ' ' A' ' 186' ' ' PRO . 44.2 mt -68.48 -42.09 79.19 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.513 1.133 . . . . 72.049999999999997 109.334 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 190' ' ' GLN . . . . . 0.409 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.4 pt20 -64.01 -9.9 18.67 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.523 1.139 . . . . 75.450000000000003 110.27 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 191' ' ' THR . . . . . 0.451 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 41.4 p -116.56 20.0 14.32 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.451 1.095 . . . . 75.319999999999993 110.38 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.589 HD11 HG12 ' A' ' 161' ' ' VAL . 6.5 mt -120.58 154.43 23.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.478 1.111 . . . . 74.409999999999997 109.285 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 193' ' ' ASN . . . . . 0.486 ' H ' ' NH1' ' A' ' 163' ' ' ARG . 35.4 t30 -64.84 77.47 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.491 1.12 . . . . 64.439999999999998 109.294 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . 0.915 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -73.51 174.78 7.75 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.496 1.123 . . . . 43.130000000000003 109.28 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 195' ' ' LEU . . . . . 0.936 HD23 HD12 ' A' ' 209' ' ' ILE . 0.4 OUTLIER -108.3 150.88 26.73 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.472 1.108 . . . . 71.120000000000005 109.348 179.97 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . 0.512 ' N ' HD13 ' A' ' 195' ' ' LEU . 26.3 mt-10 -141.92 141.4 32.98 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.429 1.08 . . . . 73.120000000000005 110.338 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.901 ' HG3' HD11 ' A' ' 176' ' ' LEU . 1.2 pt-20 -113.21 -28.78 7.5 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.474 1.109 . . . . 72.099999999999994 110.283 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . 0.56 ' CG ' HD12 ' A' ' 176' ' ' LEU . 21.0 pt-20 -88.37 3.01 51.37 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.488 1.117 . . . . 74.010000000000005 110.3 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 5.5 t -97.84 144.47 27.39 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.503 1.127 . . . . 73.349999999999994 110.03 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 4.8 tpm_? -61.87 -17.52 56.82 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.454 1.096 . . . . 71.230000000000004 110.253 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -103.07 19.05 47.63 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.47 1.106 . . . . 64.329999999999998 111.02 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 202' ' ' PHE . . . . . 0.885 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.1 OUTLIER -55.03 -44.34 99.55 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.469 0.747 . . . . 71.310000000000002 111.025 179.969 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 203' ' ' PRO . . . . . 0.597 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.05 -35.01 3.35 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.516 1.798 . . . . 60.049999999999997 110.963 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.98 -48.3 78.74 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.498 1.124 . . . . 62.549999999999997 110.362 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 205' ' ' GLN . . . . . 0.454 ' NE2' ' O ' ' A' ' 194' ' ' ALA . 3.1 mt-30 -71.34 -38.7 71.64 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.443 1.09 . . . . 74.400000000000006 110.267 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 206' ' ' VAL . . . . . 0.885 HG23 ' O ' ' A' ' 202' ' ' PHE . 70.7 t -65.71 -28.96 45.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.544 1.153 . . . . 73.310000000000002 109.327 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 207' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 211' ' ' GLN . 2.8 mt-10 -78.04 -47.37 18.54 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.49 1.119 . . . . 72.510000000000005 110.337 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -68.97 -62.39 1.4 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.497 1.123 . . . . 62.43 110.253 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 209' ' ' ILE . . . . . 0.936 HD12 HD23 ' A' ' 195' ' ' LEU . 59.8 mt -47.92 -58.28 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.491 1.119 . . . . 64.319999999999993 109.328 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 210' ' ' PHE . . . . . 0.785 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.7 m-85 -99.46 66.68 1.48 Allowed 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.547 1.154 . . . . 61.229999999999997 110.996 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 211' ' ' GLN . . . . . 0.543 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.0 OUTLIER -108.5 144.75 35.74 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.543 1.152 . . . . 75.319999999999993 110.321 179.974 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' A' ' 215' ' ' TYR . 29.3 tt0 -48.79 -55.26 12.06 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.575 1.172 . . . . 64.439999999999998 110.243 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.43 -24.85 1.39 Allowed 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.484 1.115 . . . . 74.420000000000002 110.017 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.543 HG23 ' HG2' ' A' ' 211' ' ' GLN . 43.9 t -96.71 -26.66 4.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.431 1.082 . . . . 72.120000000000005 109.277 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 215' ' ' TYR . . . . . 0.488 ' O ' ' CB ' ' A' ' 219' ' ' GLN . 1.8 t80 -69.2 -29.87 67.93 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.481 1.113 . . . . 75.120000000000005 110.98 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 29.8 mmtt -65.13 -66.32 0.56 Allowed 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.502 1.126 . . . . 74.439999999999998 109.322 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 217' ' ' THR . . . . . 0.796 HG22 HD11 ' A' ' 221' ' ' ILE . 10.1 m -44.44 -66.46 0.39 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.453 1.095 . . . . 52.229999999999997 110.376 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 218' ' ' GLN . . . . . 0.946 ' HA ' HD12 ' A' ' 221' ' ' ILE . 6.3 mp0 -47.29 -62.36 1.46 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.54 1.15 . . . . 72.450000000000003 110.285 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 219' ' ' GLN . . . . . 0.488 ' CB ' ' O ' ' A' ' 215' ' ' TYR . 33.8 tp60 -40.01 -46.03 2.02 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.452 1.095 . . . . 75.129999999999995 110.281 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.1 m -66.09 -44.39 84.52 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.463 1.102 . . . . 71.120000000000005 110.4 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 221' ' ' ILE . . . . . 0.946 HD12 ' HA ' ' A' ' 218' ' ' GLN . 15.4 mt -56.19 -24.4 17.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 O-C-N 124.559 1.162 . . . . 60.240000000000002 109.274 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 222' ' ' TRP . . . . . 0.822 ' C ' HH21 ' A' ' 226' ' ' ARG . 73.4 t90 -78.24 -74.09 0.29 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.529 1.143 . . . . 73.209999999999994 108.006 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.43 ' HA ' ' HB2' ' A' ' 226' ' ' ARG . 0.3 OUTLIER -44.28 -26.08 0.29 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.44 1.087 . . . . 75.209999999999994 109.334 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . 0.436 ' N ' ' C ' ' A' ' 222' ' ' TRP . 3.2 mm-40 -58.21 -53.8 54.23 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.521 1.138 . . . . 73.310000000000002 110.263 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.779 HG22 ' O ' ' A' ' 222' ' ' TRP . 6.5 t -66.81 -16.99 64.65 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.482 1.114 . . . . 65.150000000000006 110.375 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 226' ' ' ARG . . . . . 0.822 HH21 ' C ' ' A' ' 222' ' ' TRP . 0.0 OUTLIER -59.75 -34.3 72.79 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.537 1.148 . . . . 73.120000000000005 110.269 -179.933 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 227' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -76.01 -31.37 58.89 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.505 1.128 . . . . 75.400000000000006 109.331 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 228' ' ' MET . . . . . 0.444 ' CE ' ' HA ' ' A' ' 225' ' ' THR . 29.5 mtt -61.88 -46.57 88.85 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.551 1.157 . . . . 64.439999999999998 110.949 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 229' ' ' VAL . . . . . 0.565 HG13 ' O ' ' A' ' 225' ' ' THR . 1.2 m -69.97 -42.11 79.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.511 1.132 . . . . 54.450000000000003 109.259 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 230' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.14 -10.16 59.49 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.523 1.139 . . . . 75.120000000000005 110.306 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 32.3 ttt-85 -88.27 -83.31 0.22 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.567 1.167 . . . . 75.329999999999998 110.266 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -140.95 40.02 1.81 Allowed 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.539 1.149 . . . . 62.420000000000002 110.291 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.25 37.19 0.61 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.467 1.104 . . . . 73.430000000000007 111.006 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -45.39 153.99 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.515 1.134 . . . . 75.019999999999996 109.327 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.476 0 O-C-N 124.472 1.108 . . . . 71.150000000000006 109.264 -179.972 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.03 0 N-CA-C 110.988 -0.845 . . . . 72.200000000000003 110.988 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.97 151.77 40.06 Favored 'Trans proline' 0 C--N 1.359 1.088 0 O-C-N 124.567 1.825 . . . . 72.239999999999995 110.995 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.637 HD13 ' O ' ' A' ' 72' ' ' LEU . 1.4 tm? -94.08 -46.89 6.92 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.489 1.118 . . . . 71.340000000000003 109.311 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -125.57 109.96 1.25 Allowed Glycine 0 CA--C 1.531 1.047 0 O-C-N 124.492 1.12 . . . . 51.32 110.967 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 69.2 p -157.01 159.48 38.05 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.514 0.773 . . . . 45.329999999999998 109.971 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -40.93 124.41 2.15 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.45 1.094 . . . . 73.150000000000006 110.293 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -119.79 129.44 54.46 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.498 1.124 . . . . 62.229999999999997 110.294 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.491 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.5 p -134.24 158.61 42.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.494 1.122 . . . . 70.109999999999999 109.332 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.564 ' CE2' ' HD3' ' A' ' 108' ' ' PRO . 8.5 p90 -89.61 29.35 1.15 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.422 1.076 . . . . 63.450000000000003 110.99 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 5.8 tp -39.9 155.66 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.529 1.143 . . . . 74.140000000000001 109.328 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.814 ' HZ3' HG23 ' A' ' 106' ' ' ILE . 1.4 ttpt -95.69 -58.54 2.08 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.548 1.155 . . . . 72.030000000000001 109.31 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.825 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.2 OUTLIER -165.05 146.69 7.76 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.468 1.105 . . . . 61.340000000000003 111.056 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.635 HG21 ' CE ' ' A' ' 115' ' ' MET . 12.0 p -99.62 151.37 4.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.559 1.162 . . . . 64.430000000000007 109.335 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.864 HG23 ' HB ' ' A' ' 136' ' ' ILE . 4.6 mp -114.77 99.41 8.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.525 1.141 . . . . 74.099999999999994 109.268 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.019 HD11 ' HB1' ' A' ' 128' ' ' ALA . 1.9 mp -73.45 117.46 15.24 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.566 1.166 . . . . 65.200000000000003 109.31 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.792 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -135.58 166.49 23.1 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.531 1.144 . . . . 75.510000000000005 109.611 -179.999 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.453 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -105.03 155.61 18.81 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.566 1.166 . . . . 62.520000000000003 109.341 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -57.49 -17.03 11.4 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.536 1.148 . . . . 45.119999999999997 110.349 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -82.99 -43.16 16.71 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.465 1.103 . . . . 63.520000000000003 109.292 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.463 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -119.1 42.97 2.7 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.525 1.141 . . . . 72.430000000000007 109.306 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.594 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -80.62 -25.97 38.07 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.571 1.169 . . . . 64.310000000000002 110.409 179.979 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.441 ' O ' ' N ' ' A' ' 95' ' ' ARG . 0.8 OUTLIER -79.81 -35.44 38.43 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.477 1.111 . . . . 75.530000000000001 109.334 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.462 ' O ' ' N ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -62.75 -66.89 0.47 Allowed 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.499 1.124 . . . . 44.539999999999999 110.259 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.698 ' HB2' HD22 ' A' ' 138' ' ' LEU . . . -47.31 -36.89 9.92 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.523 1.139 . . . . 53.32 109.302 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.841 HD22 ' O ' ' A' ' 94' ' ' LEU . 0.1 OUTLIER -74.97 -33.39 61.88 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 124.483 1.115 . . . . 64.120000000000005 109.298 -179.966 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 92' ' ' GLU . 11.6 tpt180 -54.09 -46.67 72.13 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.515 1.135 . . . . 73.120000000000005 110.293 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.543 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 0.3 OUTLIER -76.21 -52.39 17.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.415 1.072 . . . . 71.319999999999993 109.327 179.978 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.543 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -48.15 -23.49 0.86 Allowed 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.521 1.138 . . . . 44.439999999999998 110.343 179.951 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -75.65 -38.59 58.72 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.557 1.161 . . . . 73.420000000000002 109.298 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.71 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -83.26 -21.67 33.26 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.515 1.134 . . . . 54.420000000000002 109.318 179.954 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.852 HD22 HG21 ' A' ' 206' ' ' VAL . 51.1 mt -61.97 -51.84 66.44 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.485 1.116 . . . . 74.099999999999994 109.285 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -76.39 55.1 0.97 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.524 1.14 . . . . 73.430000000000007 110.281 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -179.71 -67.43 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.497 1.123 . . . . 74.329999999999998 109.318 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -40.73 -60.96 1.03 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.523 1.139 . . . . 65.120000000000005 109.36 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.48 ' CZ ' HG11 ' A' ' 206' ' ' VAL . 1.3 m-85 -104.25 -19.47 14.1 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.477 1.111 . . . . 43.409999999999997 110.977 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.06 45.18 4.22 Favored Glycine 0 CA--C 1.529 0.945 0 O-C-N 124.493 1.121 . . . . 73.239999999999995 111.042 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.814 HG23 ' HZ3' ' A' ' 80' ' ' LYS . 6.6 mm -85.29 86.36 2.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.436 0.727 . . . . 73.0 109.298 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.529 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -138.06 157.2 73.39 Favored Pre-proline 0 C--N 1.326 -0.454 0 O-C-N 124.475 1.11 . . . . 74.200000000000003 109.322 179.951 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.564 ' HD3' ' CE2' ' A' ' 78' ' ' PHE . 18.0 Cg_endo -75.12 150.17 94.83 Favored 'Cis proline' 0 C--N 1.36 1.141 0 C-N-CA 120.938 -2.526 . . . . 75.420000000000002 110.987 0.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -122.65 137.73 11.44 Favored Glycine 0 CA--C 1.53 1.0 0 O-C-N 124.484 1.115 . . . . 73.349999999999994 110.955 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 1.2 tt -153.72 148.26 13.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.516 0.774 . . . . 73.299999999999997 109.334 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.792 HD12 ' NE2' ' A' ' 85' ' ' HIS . 32.4 pt -101.39 161.45 3.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.482 1.114 . . . . 73.019999999999996 109.272 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -61.55 -19.6 62.33 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.46 1.1 . . . . 73.329999999999998 110.95 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.429 ' HB2' ' HE1' ' A' ' 85' ' ' HIS . . . -87.64 -12.41 45.59 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.536 1.148 . . . . 71.299999999999997 109.304 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -103.83 -17.49 15.03 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.528 1.142 . . . . 64.310000000000002 110.276 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.635 ' CE ' HG21 ' A' ' 82' ' ' VAL . 9.1 ttm -50.84 143.52 14.93 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.523 1.139 . . . . 71.209999999999994 110.996 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.459 ' HD2' ' CG ' ' A' ' 115' ' ' MET . 18.1 Cg_endo -75.03 -10.11 21.02 Favored 'Trans proline' 0 C--N 1.359 1.13 0 O-C-N 124.532 1.806 . . . . 72.25 111.057 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.429 ' CE1' ' O ' ' A' ' 121' ' ' HIS . 15.4 t-160 -50.05 -50.39 47.89 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 124.444 1.09 . . . . 60.310000000000002 109.62 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 107.59 164.2 21.66 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.499 1.124 . . . . 32.450000000000003 110.958 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 43.8 mtp180 -97.26 13.07 30.74 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.537 0.787 . . . . 63.229999999999997 110.254 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -63.52 -45.59 89.92 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.431 1.082 . . . . 73.420000000000002 110.276 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . 0.429 ' O ' ' CE1' ' A' ' 117' ' ' HIS . 21.7 m-70 -156.11 114.98 3.46 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.535 1.147 . . . . 65.430000000000007 109.598 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.774 HD13 ' N ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -110.62 60.11 0.61 Allowed 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.49 1.118 . . . . 75.25 109.297 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -116.52 44.51 1.99 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.466 1.104 . . . . 74.310000000000002 110.286 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 58.2 m-20 -140.94 107.21 5.24 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.529 1.143 . . . . 52.240000000000002 109.286 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.802 HD11 ' HB3' ' A' ' 150' ' ' ASN . 2.9 mt -84.12 -54.05 5.1 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.622 1.202 . . . . 70.099999999999994 109.339 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.474 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 0.2 OUTLIER -40.31 -44.23 1.88 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.49 1.119 . . . . 64.519999999999996 109.278 -179.995 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -50.07 -49.68 50.54 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.477 1.11 . . . . 55.310000000000002 109.362 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 1.019 ' HB1' HD11 ' A' ' 84' ' ' LEU . . . -68.87 -38.56 79.8 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.53 1.144 . . . . 73.209999999999994 109.324 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.712 HG12 ' O ' ' A' ' 129' ' ' VAL . 86.9 t -92.93 30.64 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.462 1.101 . . . . 74.400000000000006 109.288 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.474 ' CB ' ' O ' ' A' ' 126' ' ' ASP . 6.2 t30 -138.47 152.3 48.18 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.437 1.086 . . . . 75.439999999999998 109.296 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 51.35 53.51 27.83 Favored Glycine 0 CA--C 1.53 0.983 0 O-C-N 124.448 1.092 . . . . 31.41 110.982 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 1.2 p -163.4 -179.73 6.74 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.501 0.766 . . . . 74.430000000000007 109.974 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.85 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -104.25 -46.26 4.46 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.524 1.14 . . . . 33.340000000000003 109.29 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.85 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 0.5 OUTLIER -145.51 174.29 11.28 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.567 1.167 . . . . 73.439999999999998 108.042 -179.978 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.447 HG22 ' CG1' ' A' ' 82' ' ' VAL . 2.4 p -139.22 129.18 25.01 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.497 1.123 . . . . 63.299999999999997 110.387 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.864 ' HB ' HG23 ' A' ' 83' ' ' ILE . 15.0 mm -84.4 95.0 3.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.393 1.058 . . . . 52.439999999999998 109.292 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 13.2 mt -82.69 94.19 7.53 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.486 1.116 . . . . 71.420000000000002 109.344 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.698 HD22 ' HB2' ' A' ' 93' ' ' ALA . 3.3 tp -61.3 97.71 0.07 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.513 1.133 . . . . 62.420000000000002 109.345 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.748 HD11 HD13 ' A' ' 189' ' ' LEU . 2.0 tp -70.22 105.75 3.07 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.478 1.112 . . . . 74.129999999999995 109.296 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 4.8 m -133.63 154.88 50.56 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.471 1.107 . . . . 54.43 110.389 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -49.96 -39.1 39.59 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.546 1.154 . . . . 74.019999999999996 110.302 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -89.0 -53.89 4.38 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.53 1.144 . . . . 55.32 109.318 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.59 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 16.8 t80 -51.19 -20.53 1.59 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.521 1.138 . . . . 73.109999999999999 111.044 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.694 ' C ' HD13 ' A' ' 144' ' ' LEU . 2.0 tm? -60.85 -68.06 0.34 Allowed 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.45 1.094 . . . . 70.549999999999997 109.336 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.544 HH11 HD12 ' A' ' 144' ' ' LEU . 2.0 mpt_? -67.52 -12.21 59.81 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.462 1.101 . . . . 75.040000000000006 110.3 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . 0.4 ' O ' ' CG ' ' A' ' 150' ' ' ASN . 27.6 t0 -65.84 -61.45 2.05 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.563 1.164 . . . . 73.430000000000007 109.303 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.666 HG23 ' CZ ' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -88.23 -46.5 9.19 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.554 1.159 . . . . 62.539999999999999 110.407 -179.981 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.519 ' CB ' ' O ' ' A' ' 144' ' ' LEU . 32.1 t-105 -44.52 -34.4 2.09 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.522 1.139 . . . . 61.020000000000003 107.979 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . 0.451 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 42.3 t -77.87 -45.43 24.24 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.502 1.126 . . . . 62.130000000000003 108.304 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.802 ' HB3' HD11 ' A' ' 125' ' ' LEU . 31.1 m-20 -62.51 -16.93 58.41 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.446 1.091 . . . . 74.430000000000007 109.306 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.871 ' CD1' HD21 ' A' ' 157' ' ' LEU . 8.7 m-30 -82.19 -47.8 12.05 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.515 1.135 . . . . 71.409999999999997 111.063 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -48.15 -39.83 21.93 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.499 1.124 . . . . 74.040000000000006 110.291 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -83.96 -23.23 31.18 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.47 1.106 . . . . 74.519999999999996 110.924 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.534 ' CE2' ' HB2' ' A' ' 156' ' ' SER . 5.6 t80 -129.13 97.99 4.78 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.467 1.105 . . . . 63.039999999999999 111.016 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.45 -2.7 57.64 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.523 1.139 . . . . 74.5 110.411 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . 0.534 ' HB2' ' CE2' ' A' ' 154' ' ' TYR . 1.8 m -53.88 -38.23 64.53 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.513 1.133 . . . . 73.219999999999999 110.01 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.871 HD21 ' CD1' ' A' ' 151' ' ' PHE . 2.3 pp -89.58 -27.66 20.08 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.451 1.094 . . . . 75.109999999999999 109.315 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' MET . . . . . 0.427 ' HE2' ' HA ' ' A' ' 158' ' ' MET . 12.4 tpp -54.66 -26.28 32.28 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.487 1.117 . . . . 64.340000000000003 110.972 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' ASN . . . . . 0.424 ' HB3' ' NE2' ' A' ' 164' ' ' GLN . 54.6 m-80 -66.56 -31.17 71.7 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.559 1.162 . . . . 74.120000000000005 109.322 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.462 ' HB3' ' CG2' ' A' ' 170' ' ' VAL . 0.3 OUTLIER -74.86 -28.15 60.55 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.521 1.138 . . . . 75.030000000000001 110.077 179.922 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . 0.771 HG13 HD11 ' A' ' 192' ' ' ILE . 82.4 t -57.39 -17.85 7.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.487 1.117 . . . . 74.310000000000002 109.348 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -91.42 35.71 0.94 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.622 1.201 . . . . 73.299999999999997 109.211 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.457 ' CD ' HG12 ' A' ' 192' ' ' ILE . 0.0 OUTLIER 47.34 32.44 2.22 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.49 1.119 . . . . 70.040000000000006 110.294 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . 0.424 ' NE2' ' HB3' ' A' ' 159' ' ' ASN . 0.2 OUTLIER -56.42 129.01 38.8 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.469 1.106 . . . . 71.420000000000002 110.261 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.612 ' CE1' HG21 ' A' ' 217' ' ' THR . 16.0 t-80 -85.97 48.57 1.63 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.507 1.129 . . . . 74.439999999999998 109.589 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 3.0 tptp -95.63 171.89 8.39 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.506 1.129 . . . . 75.129999999999995 109.204 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' TYR . . . . . 0.787 ' CE2' ' CD1' ' A' ' 222' ' ' TRP . 3.4 t80 -38.45 -64.49 0.42 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.501 1.125 . . . . 64.319999999999993 111.075 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.431 ' ND2' ' CG1' ' A' ' 129' ' ' VAL . 1.2 p-10 -90.78 133.07 35.47 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.428 1.08 . . . . 70.519999999999996 109.271 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.454 ' N ' ' O ' ' A' ' 133' ' ' ALA . 1.8 t -108.78 177.24 4.83 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.569 1.168 . . . . 65.439999999999998 109.98 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.725 ' C ' HD12 ' A' ' 171' ' ' ILE . 3.2 t -137.36 103.36 2.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.498 1.124 . . . . 75.310000000000002 109.279 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.725 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -121.95 99.95 43.57 Favored Pre-proline 0 C--N 1.324 -0.513 0 O-C-N 124.527 1.142 . . . . 62.200000000000003 109.274 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.657 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.3 Cg_endo -75.03 118.85 5.4 Favored 'Trans proline' 0 C--N 1.36 1.178 0 O-C-N 124.444 1.76 . . . . 73.439999999999998 110.98 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . 0.586 ' HB2' HG23 ' A' ' 136' ' ' ILE . 4.1 ttt -89.09 151.64 22.11 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.471 1.107 . . . . 54.329999999999998 110.962 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . 0.555 ' NH2' ' H ' ' A' ' 180' ' ' LEU . 0.2 OUTLIER -105.68 117.52 57.71 Favored Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.469 1.105 . . . . 65.329999999999998 110.286 -179.991 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 175' ' ' PRO . . . . . 0.509 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -75.04 150.0 37.34 Favored 'Trans proline' 0 C--N 1.359 1.112 0 O-C-N 124.515 1.797 . . . . 60.100000000000001 110.99 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.797 HD11 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -88.64 -38.86 14.48 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.528 1.142 . . . . 72.129999999999995 109.331 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -72.78 -26.48 61.55 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.459 1.099 . . . . 74.420000000000002 109.255 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 178' ' ' ASN . . . . . 0.437 ' O ' ' NH2' ' A' ' 174' ' ' ARG . 4.0 m-80 -110.76 103.03 53.9 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.55 1.156 . . . . 60.329999999999998 109.297 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.05 115.65 4.34 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.543 1.812 . . . . 71.140000000000001 110.963 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.555 ' H ' ' NH2' ' A' ' 174' ' ' ARG . 0.4 OUTLIER -116.98 97.09 50.28 Favored Pre-proline 0 C--N 1.325 -0.484 0 O-C-N 124.557 1.161 . . . . 52.229999999999997 109.3 179.969 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 164.51 33.22 Favored 'Trans proline' 0 C--N 1.36 1.181 0 O-C-N 124.467 1.772 . . . . 75.219999999999999 111.016 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 59.4 mtt180 -67.13 -16.64 64.45 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.544 1.152 . . . . 72.310000000000002 110.335 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -74.81 -17.09 60.67 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.512 1.133 . . . . 65.400000000000006 110.342 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -117.41 16.69 14.71 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.525 1.141 . . . . 73.409999999999997 110.357 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 185' ' ' THR . . . . . 0.498 ' OG1' ' CD1' ' A' ' 180' ' ' LEU . 19.1 m -116.86 143.6 31.82 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.456 1.098 . . . . 73.239999999999995 110.435 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . 0.828 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.5 Cg_endo -75.04 155.99 42.77 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.539 1.81 . . . . 73.540000000000006 111.022 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 187' ' ' PHE . . . . . 0.503 ' O ' ' CG2' ' A' ' 191' ' ' THR . 37.9 p90 -69.74 -7.26 37.95 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.516 1.135 . . . . 72.340000000000003 110.956 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.87 -52.74 4.29 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.502 1.126 . . . . 70.299999999999997 109.312 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.875 ' HA ' HD12 ' A' ' 192' ' ' ILE . 43.4 mt -68.45 -42.31 78.99 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.521 1.138 . . . . 73.420000000000002 109.29 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 190' ' ' GLN . . . . . 0.409 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.3 pt20 -63.98 -10.76 23.35 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.46 1.1 . . . . 75.400000000000006 110.344 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 191' ' ' THR . . . . . 0.503 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 35.7 p -113.64 19.92 16.37 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.535 1.147 . . . . 75.239999999999995 110.383 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.875 HD12 ' HA ' ' A' ' 189' ' ' LEU . 28.1 mt -113.28 160.64 12.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 124.486 1.116 . . . . 71.030000000000001 109.262 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 193' ' ' ASN . . . . . 0.44 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 35.7 t30 -76.39 62.88 1.89 Allowed 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.502 1.127 . . . . 71.439999999999998 109.301 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . 0.657 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -56.96 143.41 38.03 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.441 1.088 . . . . 53.109999999999999 109.308 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 195' ' ' LEU . . . . . 0.548 HD12 ' CE ' ' A' ' 173' ' ' MET . 0.7 OUTLIER -80.26 123.49 28.01 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.47 1.106 . . . . 71.450000000000003 109.27 -179.926 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . 0.407 ' O ' ' HA ' ' A' ' 202' ' ' PHE . 14.1 mt-10 -103.43 137.5 41.44 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.453 1.096 . . . . 73.319999999999993 110.294 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.797 ' HG3' HD11 ' A' ' 176' ' ' LEU . 0.6 OUTLIER -113.71 -24.73 9.02 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.552 1.157 . . . . 74.209999999999994 110.292 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . 0.573 ' HG2' HD12 ' A' ' 176' ' ' LEU . 6.5 pt-20 -102.51 21.72 14.75 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.518 1.136 . . . . 62.109999999999999 110.269 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -117.34 162.99 17.02 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 124.513 1.133 . . . . 63.399999999999999 110.014 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 21.5 ttt-85 -64.88 -42.77 94.55 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.499 1.124 . . . . 71.239999999999995 110.316 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -90.9 41.62 2.91 Favored Glycine 0 CA--C 1.531 1.072 0 O-C-N 124.475 1.11 . . . . 71.329999999999998 110.97 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 202' ' ' PHE . . . . . 0.611 ' CD1' ' C ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -77.63 -47.71 2.36 Favored Pre-proline 0 C--N 1.325 -0.495 0 O-C-N 124.555 0.797 . . . . 71.230000000000004 110.974 -179.983 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 203' ' ' PRO . . . . . 0.654 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.5 Cg_endo -75.02 -25.94 11.35 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.528 1.804 . . . . 73.209999999999994 111.053 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 204' ' ' THR . . . . . 0.453 ' O ' ' HB2' ' A' ' 207' ' ' GLU . 0.8 OUTLIER -61.69 -55.45 30.31 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.572 1.17 . . . . 54.030000000000001 110.407 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 205' ' ' GLN . . . . . 0.463 ' HB2' ' CD2' ' A' ' 195' ' ' LEU . 2.1 mt-30 -54.55 -62.43 1.66 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.599 1.187 . . . . 75.109999999999999 110.377 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 206' ' ' VAL . . . . . 0.852 HG21 HD22 ' A' ' 100' ' ' LEU . 3.2 p -40.75 -30.98 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.518 1.136 . . . . 71.439999999999998 109.351 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 207' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 204' ' ' THR . 0.9 OUTLIER -79.56 -65.88 0.94 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.516 1.135 . . . . 72.209999999999994 110.302 179.969 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . 0.429 ' HD3' ' O ' ' A' ' 204' ' ' THR . 4.8 mpt_? -46.13 -58.0 4.01 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.507 1.129 . . . . 74.319999999999993 110.264 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 209' ' ' ILE . . . . . 0.575 HG22 ' CD1' ' A' ' 210' ' ' PHE . 15.3 mt -54.57 -66.43 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 O-C-N 124.474 1.109 . . . . 65.040000000000006 109.26 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 210' ' ' PHE . . . . . 0.583 ' CD2' HG23 ' A' ' 206' ' ' VAL . 0.4 OUTLIER -90.06 65.95 6.64 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.493 1.121 . . . . 65.510000000000005 111.024 -179.986 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 211' ' ' GLN . . . . . 0.434 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.1 OUTLIER -110.31 146.35 35.88 Favored 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.595 1.184 . . . . 72.230000000000004 110.297 -179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.458 ' O ' ' N ' ' A' ' 215' ' ' TYR . 22.8 tt0 -48.88 -55.48 11.6 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 124.441 1.088 . . . . 72.0 110.293 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.41 -24.09 1.14 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.48 1.112 . . . . 74.129999999999995 109.993 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.434 HG23 ' HG2' ' A' ' 211' ' ' GLN . 24.1 t -96.16 -28.46 3.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.559 1.162 . . . . 73.109999999999999 109.297 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 215' ' ' TYR . . . . . 0.458 ' N ' ' O ' ' A' ' 212' ' ' GLU . 12.8 t80 -64.92 -23.41 67.22 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.524 1.14 . . . . 72.209999999999994 111.006 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -66.19 0.58 Allowed 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.525 1.141 . . . . 52.240000000000002 109.264 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 217' ' ' THR . . . . . 0.992 HG22 HD11 ' A' ' 221' ' ' ILE . 25.7 m -41.1 -66.12 0.36 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.514 1.134 . . . . 51.43 110.372 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 218' ' ' GLN . . . . . 0.511 ' HA ' HD12 ' A' ' 221' ' ' ILE . 0.0 OUTLIER -39.66 -53.56 2.15 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.408 1.068 . . . . 61.5 110.292 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 11.8 tp60 -53.92 -53.8 47.63 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.496 1.123 . . . . 64.200000000000003 110.261 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 220' ' ' THR . . . . . 0.428 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 1.3 m -62.87 -19.21 63.92 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.498 1.124 . . . . 64.400000000000006 110.438 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 221' ' ' ILE . . . . . 0.992 HD11 HG22 ' A' ' 217' ' ' THR . 56.3 mt -83.62 -25.36 7.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 O-C-N 124.525 1.141 . . . . 73.310000000000002 109.328 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 222' ' ' TRP . . . . . 0.787 ' CD1' ' CE2' ' A' ' 167' ' ' TYR . 6.9 t90 -78.13 -43.36 29.06 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.54 1.15 . . . . 73.150000000000006 107.999 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.428 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -68.39 -33.57 74.47 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.542 1.151 . . . . 70.019999999999996 109.313 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . 0.414 ' N ' ' HD3' ' A' ' 223' ' ' LYS . 1.8 mm-40 -68.7 -41.22 79.45 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.538 1.149 . . . . 71.200000000000003 110.367 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.566 ' O ' HG13 ' A' ' 229' ' ' VAL . 3.0 t -75.61 -7.89 55.39 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.456 1.098 . . . . 75.430000000000007 110.379 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 12.0 mtp85 -84.82 -20.17 31.35 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.491 1.12 . . . . 74.319999999999993 110.26 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 227' ' ' ASN . . . . . 0.74 ' N ' HD22 ' A' ' 227' ' ' ASN . 0.8 OUTLIER -91.72 -42.71 9.99 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.546 1.154 . . . . 74.329999999999998 109.312 -179.968 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 228' ' ' MET . . . . . 0.409 ' HG3' ' N ' ' A' ' 229' ' ' VAL . 7.2 ptp -60.09 -37.24 79.37 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.503 1.127 . . . . 74.25 111.049 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 229' ' ' VAL . . . . . 0.566 HG13 ' O ' ' A' ' 225' ' ' THR . 32.0 m -75.01 -46.76 39.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 O-C-N 124.438 1.086 . . . . 73.340000000000003 109.37 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 230' ' ' GLN . . . . . 0.408 ' N ' HG23 ' A' ' 229' ' ' VAL . 4.1 tp-100 -69.24 -10.31 57.19 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.472 1.108 . . . . 71.519999999999996 110.28 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -92.61 -81.02 0.36 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.472 1.107 . . . . 75.040000000000006 110.25 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -145.12 56.49 1.25 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.454 1.096 . . . . 71.299999999999997 110.294 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -167.66 176.6 6.32 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.518 1.136 . . . . 70.349999999999994 111.032 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.449 HD12 HD23 ' A' ' 72' ' ' LEU . 5.1 mm -130.8 143.91 39.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.557 1.161 . . . . 75.219999999999999 109.348 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 235' ' ' ALA . . . . . 0.421 ' HB2' HG11 ' A' ' 229' ' ' VAL . . . . . . . . 0 C--N 1.325 -0.462 0 O-C-N 124.522 1.139 . . . . 64.299999999999997 109.316 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.012 0 N-CA-C 111.011 -0.836 . . . . 72.140000000000001 111.011 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.03 170.32 20.67 Favored 'Trans proline' 0 C--N 1.36 1.145 0 O-C-N 124.499 1.789 . . . . 75.219999999999999 111.012 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.409 ' O ' HD13 ' A' ' 72' ' ' LEU . 1.1 tm? -114.65 -49.65 2.81 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.564 1.165 . . . . 63.219999999999999 109.33 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -104.75 -61.25 0.65 Allowed Glycine 0 CA--C 1.53 1.013 0 O-C-N 124.529 1.143 . . . . 42.210000000000001 111.013 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.4 m -42.66 162.72 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.477 0.751 . . . . 53.109999999999999 110.002 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -94.69 148.2 22.52 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.499 1.125 . . . . 74.109999999999999 110.32 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.484 ' OE2' ' CH2' ' A' ' 222' ' ' TRP . 2.8 tt0 -130.55 129.3 42.64 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.52 1.137 . . . . 70.140000000000001 110.319 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.471 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 4.2 p -130.79 154.05 40.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.474 1.109 . . . . 73.129999999999995 109.254 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.411 ' O ' ' C ' ' A' ' 79' ' ' LEU . 20.0 m-85 -88.39 26.88 1.34 Allowed 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.527 1.142 . . . . 74.310000000000002 110.989 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.618 HD23 ' OG ' ' A' ' 132' ' ' SER . 12.4 tp -39.65 152.05 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.497 1.123 . . . . 73.109999999999999 109.337 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.586 ' NZ ' HG23 ' A' ' 106' ' ' ILE . 1.4 ttpt -90.09 -60.4 1.94 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.553 1.158 . . . . 73.25 109.337 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.668 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.6 OUTLIER -161.28 131.61 5.05 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.515 1.134 . . . . 75.409999999999997 111.014 179.968 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.557 HG11 ' HA ' ' A' ' 128' ' ' ALA . 11.6 p -84.73 162.36 2.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 124.463 1.102 . . . . 65.209999999999994 109.29 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.668 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 4.9 mp -125.41 96.25 3.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.48 1.113 . . . . 71.040000000000006 109.274 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.436 ' O ' ' O ' ' A' ' 136' ' ' ILE . 6.8 mt -69.87 123.55 21.77 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.532 1.145 . . . . 74.430000000000007 109.292 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.743 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -146.15 174.46 11.29 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.513 1.133 . . . . 75.299999999999997 109.59 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.468 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -127.91 152.3 48.03 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.509 1.13 . . . . 74.140000000000001 109.366 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -46.31 -24.25 0.46 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.516 1.135 . . . . 75.349999999999994 110.305 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -63.45 -46.52 85.87 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.469 1.106 . . . . 73.209999999999994 109.267 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.449 ' OD1' ' ND2' ' A' ' 178' ' ' ASN . 0.0 OUTLIER -134.91 44.81 2.59 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.435 1.085 . . . . 74.409999999999997 109.307 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.628 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -75.18 -26.58 59.15 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.567 1.167 . . . . 73.310000000000002 110.417 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -82.43 -21.44 35.71 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.576 1.172 . . . . 73.200000000000003 109.314 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.3 -54.89 6.13 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.597 1.185 . . . . 71.319999999999993 110.261 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.734 ' HB2' HD22 ' A' ' 138' ' ' LEU . . . -59.06 -30.48 68.09 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.495 1.122 . . . . 52.140000000000001 109.371 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.783 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -78.62 -51.6 9.65 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.481 1.113 . . . . 62.210000000000001 109.326 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.725 ' N ' HD13 ' A' ' 94' ' ' LEU . 2.2 tmt_? -41.19 -43.19 2.26 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.573 1.17 . . . . 74.549999999999997 110.264 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.55 ' CG1' ' N ' ' A' ' 97' ' ' GLN . 0.3 OUTLIER -75.57 -52.96 16.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.479 1.112 . . . . 73.329999999999998 109.259 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.55 ' N ' ' CG1' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -48.87 -20.89 0.55 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.436 1.085 . . . . 73.400000000000006 110.304 -179.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.41 ' N ' ' C ' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -79.82 -41.2 26.89 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.555 1.16 . . . . 64.120000000000005 109.235 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.706 HD21 ' HZ ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -77.97 -22.09 49.96 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.44 1.088 . . . . 71.209999999999994 109.29 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.705 ' N ' HD23 ' A' ' 99' ' ' LEU . 36.8 mt -67.62 -44.72 77.35 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.513 1.133 . . . . 73.510000000000005 109.299 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -82.04 49.62 1.42 Allowed 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.443 1.089 . . . . 65.120000000000005 110.237 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -174.44 -64.95 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.571 1.169 . . . . 74.140000000000001 109.294 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -41.56 -52.4 3.73 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.495 1.122 . . . . 70.129999999999995 109.241 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -111.03 -30.03 7.66 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.537 1.148 . . . . 71.409999999999997 110.995 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.464 ' O ' ' CD ' ' A' ' 107' ' ' LYS . . . 109.1 26.97 5.01 Favored Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.581 1.176 . . . . 55.420000000000002 110.979 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.586 HG23 ' NZ ' ' A' ' 80' ' ' LYS . 25.4 mm -70.82 95.42 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 O-C-N 124.473 0.749 . . . . 74.310000000000002 109.257 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.506 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -142.02 158.48 61.76 Favored Pre-proline 0 C--N 1.326 -0.451 0 O-C-N 124.487 1.117 . . . . 73.120000000000005 109.313 179.968 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.506 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -75.01 161.68 94.36 Favored 'Cis proline' 0 C--N 1.36 1.171 0 C-N-CA 121.009 -2.496 . . . . 73.530000000000001 111.011 0.057 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -117.29 112.12 2.41 Favored Glycine 0 CA--C 1.529 0.948 0 O-C-N 124.46 1.1 . . . . 73.230000000000004 111.009 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.402 HD11 ' C ' ' A' ' 114' ' ' GLU . 0.1 OUTLIER -135.84 128.81 47.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.44 0.729 . . . . 63.520000000000003 109.289 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.743 HD12 ' NE2' ' A' ' 85' ' ' HIS . 43.4 pt -91.44 -176.59 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 124.528 1.143 . . . . 63.509999999999998 109.306 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -81.67 -19.99 40.5 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.474 1.109 . . . . 52.100000000000001 110.942 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -90.49 -3.45 57.63 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.496 1.122 . . . . 75.140000000000001 109.289 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.402 ' C ' HD11 ' A' ' 110' ' ' ILE . 4.4 mm-40 -110.23 -26.58 9.55 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.577 1.173 . . . . 70.540000000000006 110.306 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 26.8 tpp -38.77 110.88 0.6 Allowed Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.512 1.132 . . . . 73.120000000000005 110.995 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 67.24 5.99 Favored 'Trans proline' 0 C--N 1.36 1.141 0 O-C-N 124.481 1.78 . . . . 63.520000000000003 110.951 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -107.39 12.96 27.48 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.531 1.144 . . . . 73.200000000000003 109.569 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 87.44 -119.6 5.3 Favored Glycine 0 CA--C 1.53 1.0 0 O-C-N 124.482 1.114 . . . . 23.329999999999998 111.038 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.23 142.46 7.21 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.516 0.774 . . . . 64.329999999999998 110.236 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.404 ' HG2' ' N ' ' A' ' 121' ' ' HIS . 0.3 OUTLIER -61.41 -28.52 69.32 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.44 1.087 . . . . 63.130000000000003 110.365 179.945 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . 0.404 ' N ' ' HG2' ' A' ' 120' ' ' GLN . 10.8 t-80 -53.33 96.2 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.481 1.113 . . . . 73.319999999999993 109.55 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.621 HD22 ' C ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -45.63 148.41 0.73 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.484 1.115 . . . . 72.25 109.269 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -77.27 -59.29 2.84 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.477 1.111 . . . . 75.430000000000007 110.386 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -173.16 -175.58 1.22 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.533 1.146 . . . . 74.239999999999995 109.31 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.69 HD13 ' OH ' ' A' ' 154' ' ' TYR . 0.3 OUTLIER -84.47 -50.87 7.36 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.543 1.152 . . . . 74.439999999999998 109.287 -179.945 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.4 ' C ' ' O ' ' A' ' 125' ' ' LEU . 0.7 OUTLIER -40.14 -30.02 0.09 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.557 1.161 . . . . 53.210000000000001 109.36 179.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.434 ' N ' ' C ' ' A' ' 125' ' ' LEU . 1.0 OUTLIER -57.78 -53.42 58.37 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.474 1.109 . . . . 71.510000000000005 109.316 179.919 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.557 ' HA ' HG11 ' A' ' 82' ' ' VAL . . . -67.21 -25.13 65.96 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.573 1.17 . . . . 72.109999999999999 109.298 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.609 ' O ' HG12 ' A' ' 129' ' ' VAL . 67.2 t -89.99 15.62 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.429 1.08 . . . . 73.319999999999993 109.263 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.406 ' O ' ' C ' ' A' ' 131' ' ' GLY . 3.9 m-20 -129.85 165.79 21.3 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.519 1.137 . . . . 74.329999999999998 109.276 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . 0.406 ' C ' ' O ' ' A' ' 130' ' ' ASN . . . 37.15 54.43 1.56 Allowed Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.448 1.093 . . . . 65.400000000000006 111.027 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . 0.618 ' OG ' HD23 ' A' ' 79' ' ' LEU . 7.8 m -163.33 174.23 12.26 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.484 0.755 . . . . 73.230000000000004 110.022 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.871 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -105.45 -28.12 11.03 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.537 1.148 . . . . 62.200000000000003 109.258 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.871 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.1 m-90 -161.95 178.71 8.64 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.974 -1.121 . . . . 74.129999999999995 107.974 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.47 ' OG1' ' HA ' ' A' ' 170' ' ' VAL . 74.8 p -147.64 135.46 21.1 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.464 1.103 . . . . 44.350000000000001 110.359 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.638 ' HB ' HG23 ' A' ' 83' ' ' ILE . 6.9 mm -84.18 97.76 5.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 O-C-N 124.49 1.119 . . . . 73.340000000000003 109.304 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.527 ' O ' HD13 ' A' ' 139' ' ' LEU . 3.0 mm? -77.89 87.41 4.09 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.499 1.125 . . . . 54.439999999999998 109.374 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.734 HD22 ' HB2' ' A' ' 93' ' ' ALA . 2.3 tp -62.07 103.12 0.34 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.514 1.134 . . . . 72.209999999999994 109.318 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.527 HD13 ' O ' ' A' ' 137' ' ' LEU . 0.0 OUTLIER -75.25 106.46 6.78 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.435 1.085 . . . . 74.299999999999997 109.328 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.503 ' O ' ' CB ' ' A' ' 144' ' ' LEU . 2.5 m -135.24 162.64 31.98 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.344 1.027 . . . . 62.119999999999997 110.459 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -63.44 -34.8 78.54 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.507 1.129 . . . . 73.329999999999998 110.227 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . 0.425 ' ND2' ' H ' ' A' ' 142' ' ' ASN . 1.9 p30 -89.35 -53.34 4.59 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.569 1.168 . . . . 71.340000000000003 109.262 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.592 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 31.2 t80 -53.32 -36.88 61.75 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.528 1.143 . . . . 52.219999999999999 110.958 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.699 HD13 ' C ' ' A' ' 144' ' ' LEU . 2.1 tm? -60.81 -68.15 0.33 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.471 1.107 . . . . 73.120000000000005 109.293 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.517 ' N ' HD13 ' A' ' 144' ' ' LEU . 6.8 mmt85 -55.01 -18.97 5.84 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.461 1.101 . . . . 65.25 110.344 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -75.57 -73.12 0.27 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.504 1.128 . . . . 71.310000000000002 109.253 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.51 ' CG2' ' N ' ' A' ' 148' ' ' TRP . 1.2 t -65.79 -52.02 54.25 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.502 1.126 . . . . 72.120000000000005 110.317 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.585 ' HB2' HD22 ' A' ' 144' ' ' LEU . 22.7 t-105 -43.5 -50.99 6.95 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.578 1.174 . . . . 74.219999999999999 107.971 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . 0.404 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 4.6 t -47.31 -45.86 24.74 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.482 1.114 . . . . 75.150000000000006 108.329 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.455 ' N ' ' O ' ' A' ' 147' ' ' THR . 23.3 m120 -64.36 -56.66 12.86 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.458 1.099 . . . . 72.099999999999994 109.316 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 1.004 ' CZ ' HD22 ' A' ' 157' ' ' LEU . 8.6 m-30 -42.93 -38.05 2.08 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.492 1.12 . . . . 73.109999999999999 111.005 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -61.29 -45.02 96.2 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.54 1.15 . . . . 72.140000000000001 110.261 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.433 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 1.7 t80 -56.6 -25.68 53.49 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.518 1.136 . . . . 73.420000000000002 110.986 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.69 ' OH ' HD13 ' A' ' 125' ' ' LEU . 20.3 p90 -163.61 125.43 2.43 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.45 1.094 . . . . 75.530000000000001 110.982 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.517 HG23 ' OD1' ' A' ' 159' ' ' ASN . 6.3 t -70.39 -6.07 32.88 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.505 1.128 . . . . 74.439999999999998 110.47 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 1.6 m -39.51 -63.65 0.55 Allowed 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.493 1.121 . . . . 55.310000000000002 109.948 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 1.004 HD22 ' CZ ' ' A' ' 151' ' ' PHE . 2.9 tt -64.89 -40.28 94.84 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.514 1.133 . . . . 74.439999999999998 109.281 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' MET . . . . . 0.567 ' CE ' HG21 ' A' ' 161' ' ' VAL . 3.4 tpt -58.76 -15.18 11.0 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.494 1.121 . . . . 73.420000000000002 111.027 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' ASN . . . . . 0.517 ' OD1' HG23 ' A' ' 155' ' ' THR . 37.7 m-20 -81.59 -44.89 16.63 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.44 1.087 . . . . 72.150000000000006 109.339 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.63 -20.63 61.26 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.466 1.104 . . . . 70.019999999999996 110.069 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . 0.812 ' O ' HD13 ' A' ' 192' ' ' ILE . 4.4 t -64.21 -18.01 22.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.571 1.17 . . . . 75.200000000000003 109.34 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -86.48 10.23 15.85 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.467 1.104 . . . . 73.299999999999997 109.3 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.61 ' CZ ' HG23 ' A' ' 192' ' ' ILE . 0.7 OUTLIER 53.29 63.63 2.15 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.54 1.15 . . . . 75.540000000000006 110.32 179.97 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . 0.414 ' NE2' ' HB3' ' A' ' 159' ' ' ASN . 19.7 mt-30 -62.35 -174.49 0.06 Allowed 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.552 1.157 . . . . 73.430000000000007 110.222 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -99.77 38.26 1.48 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.52 1.138 . . . . 72.239999999999995 109.567 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -100.9 162.26 13.03 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.586 1.178 . . . . 70.420000000000002 109.284 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' TYR . . . . . 0.527 ' CD1' ' C ' ' A' ' 167' ' ' TYR . 3.2 p90 -66.89 -9.09 34.29 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 124.402 1.064 . . . . 71.140000000000001 111.014 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.438 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 0.1 OUTLIER -112.01 130.13 55.97 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.506 1.129 . . . . 75.349999999999994 109.32 -179.967 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.496 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 1.2 m -128.53 172.93 10.7 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.511 1.132 . . . . 74.219999999999999 109.997 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.503 ' O ' HD13 ' A' ' 171' ' ' ILE . 0.9 OUTLIER -151.95 119.87 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.412 1.07 . . . . 73.129999999999995 109.284 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.61 HG22 ' HB2' ' A' ' 195' ' ' LEU . 11.5 mm -111.29 121.0 41.57 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 124.576 1.173 . . . . 51.399999999999999 109.308 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.723 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.92 106.9 2.36 Favored 'Trans proline' 0 C--N 1.36 1.139 0 O-C-N 124.479 1.779 . . . . 53.409999999999997 110.997 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . 0.589 ' HE2' ' HG2' ' A' ' 197' ' ' GLU . 4.0 ttt -94.22 153.5 18.03 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.481 1.113 . . . . 74.030000000000001 110.989 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . 0.436 ' N ' ' HG2' ' A' ' 173' ' ' MET . 41.8 ttm-85 -114.39 126.28 28.17 Favored Pre-proline 0 C--N 1.326 -0.448 0 O-C-N 124.477 1.11 . . . . 75.150000000000006 110.345 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 175' ' ' PRO . . . . . 0.446 ' C ' HD23 ' A' ' 176' ' ' LEU . 18.3 Cg_endo -75.0 157.49 42.74 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.443 1.76 . . . . 73.239999999999995 111.034 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.944 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.2 OUTLIER -99.58 -50.85 3.93 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.459 1.099 . . . . 62.219999999999999 109.289 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -71.74 -22.13 61.66 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.465 1.103 . . . . 72.120000000000005 109.321 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 178' ' ' ASN . . . . . 0.449 ' ND2' ' OD1' ' A' ' 89' ' ' ASP . 0.4 OUTLIER -107.67 107.79 60.77 Favored Pre-proline 0 C--N 1.325 -0.484 0 O-C-N 124.474 1.109 . . . . 64.030000000000001 109.335 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.96 127.54 10.79 Favored 'Trans proline' 0 C--N 1.36 1.158 0 O-C-N 124.543 1.812 . . . . 64.140000000000001 111.047 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.609 HD13 ' HB2' ' A' ' 184' ' ' ARG . 0.4 OUTLIER -141.27 96.66 7.05 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.524 1.14 . . . . 73.230000000000004 109.274 179.976 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.02 168.96 23.66 Favored 'Trans proline' 0 C--N 1.36 1.166 0 O-C-N 124.495 1.787 . . . . 55.340000000000003 111.021 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . 0.424 ' CB ' ' OE1' ' A' ' 190' ' ' GLN . 0.2 OUTLIER -58.45 -28.42 65.28 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.511 1.132 . . . . 73.450000000000003 110.327 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -62.85 -12.74 26.79 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.425 1.078 . . . . 72.450000000000003 110.339 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 184' ' ' ARG . . . . . 0.609 ' HB2' HD13 ' A' ' 180' ' ' LEU . 39.4 mmt180 -112.87 -28.26 7.81 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.467 1.104 . . . . 75.239999999999995 110.255 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 185' ' ' THR . . . . . 0.561 HG23 ' HD2' ' A' ' 186' ' ' PRO . 31.3 m -80.0 144.13 58.64 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.417 1.073 . . . . 73.129999999999995 110.342 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . 0.715 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.2 Cg_endo -74.98 147.45 34.01 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.59 1.837 . . . . 74.430000000000007 110.995 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 187' ' ' PHE . . . . . 0.506 ' O ' HG23 ' A' ' 191' ' ' THR . 4.4 p90 -63.21 -11.34 20.28 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.489 1.118 . . . . 74.0 111.039 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . 0.675 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -87.96 -54.12 4.39 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.545 1.153 . . . . 73.099999999999994 109.298 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.746 HD23 HG13 ' A' ' 161' ' ' VAL . 24.8 mt -72.61 -19.41 61.47 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.525 1.141 . . . . 70.409999999999997 109.333 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 190' ' ' GLN . . . . . 0.484 ' O ' ' CG ' ' A' ' 190' ' ' GLN . 7.4 tt0 -86.54 -0.52 56.28 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.596 1.185 . . . . 62.299999999999997 110.295 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 191' ' ' THR . . . . . 0.506 HG23 ' O ' ' A' ' 187' ' ' PHE . 69.1 p -130.21 18.59 5.43 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.453 1.095 . . . . 75.0 110.39 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.812 HD13 ' O ' ' A' ' 161' ' ' VAL . 3.1 mt -127.79 154.63 38.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.483 1.114 . . . . 73.099999999999994 109.269 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 193' ' ' ASN . . . . . 0.455 ' ND2' HD11 ' A' ' 209' ' ' ILE . 29.8 t30 -51.52 92.38 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.433 1.083 . . . . 71.319999999999993 109.266 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . 0.723 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -90.79 143.54 26.62 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.546 1.153 . . . . 54.229999999999997 109.343 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 195' ' ' LEU . . . . . 0.61 ' HB2' HG22 ' A' ' 171' ' ' ILE . 0.2 OUTLIER -76.56 150.0 36.57 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 65.299999999999997 109.331 -179.971 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . 0.454 ' H ' HD13 ' A' ' 195' ' ' LEU . 64.1 mt-10 -143.42 132.98 23.58 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.499 1.124 . . . . 65.319999999999993 110.271 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.944 ' HG3' HD21 ' A' ' 176' ' ' LEU . 0.6 OUTLIER -113.86 -16.81 12.17 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 124.487 1.117 . . . . 62.299999999999997 110.248 -179.998 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . 0.834 ' HB3' HD22 ' A' ' 176' ' ' LEU . 0.3 OUTLIER -95.71 5.07 52.3 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.436 1.085 . . . . 73.099999999999994 110.266 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.92 172.91 6.93 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.523 1.139 . . . . 72.109999999999999 110.034 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -85.4 -18.39 33.82 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.468 1.105 . . . . 51.439999999999998 110.279 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -104.42 24.05 29.94 Favored Glycine 0 CA--C 1.53 1.024 0 O-C-N 124.464 1.102 . . . . 63.409999999999997 111.088 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 202' ' ' PHE . . . . . 0.849 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.2 OUTLIER -59.2 -43.01 96.26 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.521 0.777 . . . . 71.510000000000005 110.987 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 203' ' ' PRO . . . . . 0.623 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.2 Cg_endo -75.04 -35.55 3.04 Favored 'Trans proline' 0 C--N 1.36 1.158 0 O-C-N 124.566 1.824 . . . . 71.510000000000005 111.018 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.92 -57.03 12.48 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.527 1.142 . . . . 71.439999999999998 110.433 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 205' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' A' ' 209' ' ' ILE . 3.0 mt-30 -61.92 -48.73 79.15 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.543 1.152 . . . . 73.310000000000002 110.357 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 206' ' ' VAL . . . . . 0.849 HG23 ' O ' ' A' ' 202' ' ' PHE . 92.7 t -57.25 -29.97 33.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 124.473 1.108 . . . . 65.120000000000005 109.284 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -79.42 -41.12 28.37 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.457 1.098 . . . . 74.439999999999998 110.266 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -75.45 -68.09 0.6 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.514 1.134 . . . . 71.140000000000001 110.311 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 209' ' ' ILE . . . . . 0.752 HG22 ' CD1' ' A' ' 210' ' ' PHE . 98.0 mt -40.42 -48.03 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.447 1.092 . . . . 74.109999999999999 109.261 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 210' ' ' PHE . . . . . 0.752 ' CD1' HG22 ' A' ' 209' ' ' ILE . 1.9 m-85 -105.71 75.7 1.15 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.492 1.12 . . . . 65.120000000000005 110.981 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 211' ' ' GLN . . . . . 0.486 ' CG ' ' HB ' ' A' ' 214' ' ' VAL . 10.3 pt20 -111.32 141.7 44.52 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.512 1.132 . . . . 70.230000000000004 110.277 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.565 ' HA ' ' CD2' ' A' ' 215' ' ' TYR . 16.1 tt0 -53.08 -48.38 67.79 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.448 1.093 . . . . 62.25 110.265 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.4 t -52.58 -18.61 1.82 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.421 1.076 . . . . 64.239999999999995 109.969 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.486 ' HB ' ' CG ' ' A' ' 211' ' ' GLN . 2.3 t -97.66 -44.52 12.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 124.534 1.146 . . . . 74.439999999999998 109.276 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 215' ' ' TYR . . . . . 0.565 ' CD2' ' HA ' ' A' ' 212' ' ' GLU . 9.5 m-30 -37.39 -32.36 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.452 1.095 . . . . 75.299999999999997 110.964 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . 0.513 ' N ' ' CD ' ' A' ' 216' ' ' LYS . 5.6 mmtt -68.51 -54.59 15.87 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.482 1.113 . . . . 73.450000000000003 109.324 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 217' ' ' THR . . . . . 0.446 ' N ' ' O ' ' A' ' 214' ' ' VAL . 1.5 m -40.24 -66.41 0.31 Allowed 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.559 1.162 . . . . 70.209999999999994 110.46 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 218' ' ' GLN . . . . . 0.582 ' HA ' HD12 ' A' ' 221' ' ' ILE . 2.8 mp0 -46.76 -59.94 2.72 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.492 1.12 . . . . 74.200000000000003 110.272 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 219' ' ' GLN . . . . . 0.471 ' O ' ' N ' ' A' ' 223' ' ' LYS . 28.9 tp60 -41.34 -61.12 1.09 Allowed 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.556 1.16 . . . . 74.239999999999995 110.357 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.1 m -46.22 -45.94 17.32 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.528 1.142 . . . . 72.25 110.369 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 221' ' ' ILE . . . . . 0.582 HD12 ' HA ' ' A' ' 218' ' ' GLN . 6.5 mt -66.95 -29.59 46.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.46 1.1 . . . . 74.540000000000006 109.334 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 222' ' ' TRP . . . . . 0.484 ' CH2' ' OE2' ' A' ' 76' ' ' GLU . 14.3 t90 -81.63 -19.44 41.78 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.574 1.171 . . . . 74.340000000000003 108.07 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.471 ' N ' ' O ' ' A' ' 219' ' ' GLN . 0.0 OUTLIER -91.86 -20.06 21.85 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.486 1.116 . . . . 63.329999999999998 109.386 179.93 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -89.49 -38.98 13.64 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.526 1.141 . . . . 72.230000000000004 110.276 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.456 ' HA ' ' HE2' ' A' ' 228' ' ' MET . 7.3 t -55.1 -29.77 58.32 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.53 1.144 . . . . 65.219999999999999 110.427 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 226' ' ' ARG . . . . . 0.414 ' O ' HG22 ' A' ' 229' ' ' VAL . 0.6 OUTLIER -72.37 -25.82 61.66 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.465 1.103 . . . . 65.409999999999997 110.25 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 227' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.27 -12.8 59.95 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.468 1.105 . . . . 75.120000000000005 109.289 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 228' ' ' MET . . . . . 0.456 ' HE2' ' HA ' ' A' ' 225' ' ' THR . 45.3 mtm -84.62 -40.33 17.6 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.531 1.144 . . . . 73.340000000000003 110.997 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 229' ' ' VAL . . . . . 0.509 ' HB ' ' HB2' ' A' ' 235' ' ' ALA . 1.3 m -62.69 -44.07 99.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.554 1.159 . . . . 74.420000000000002 109.305 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 230' ' ' GLN . . . . . 0.412 ' N ' ' CG2' ' A' ' 229' ' ' VAL . 0.4 OUTLIER -75.69 -37.13 59.77 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.449 1.093 . . . . 73.230000000000004 110.299 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 7.3 ttt85 -45.37 -80.34 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.512 1.132 . . . . 70.230000000000004 110.276 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -155.23 36.91 0.39 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.49 1.118 . . . . 75.150000000000006 110.25 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 233' ' ' PHE . . . . . 0.401 ' O ' ' O ' ' A' ' 229' ' ' VAL . 0.1 OUTLIER -133.01 -174.88 3.6 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.485 1.115 . . . . 74.430000000000007 110.934 -179.973 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.4 HD13 ' C ' ' A' ' 233' ' ' PHE . 9.1 mm -102.4 159.84 4.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 O-C-N 124.574 1.171 . . . . 63.109999999999999 109.279 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 235' ' ' ALA . . . . . 0.509 ' HB2' ' HB ' ' A' ' 229' ' ' VAL . . . . . . . . 0 C--N 1.326 -0.455 0 O-C-N 124.423 1.077 . . . . 62.25 109.367 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.012 0 N-CA-C 110.993 -0.843 . . . . 52.32 110.993 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.04 -169.85 0.7 Allowed 'Trans proline' 0 C--N 1.36 1.151 0 O-C-N 124.521 1.801 . . . . 64.230000000000004 110.997 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.488 HD22 ' HB3' ' A' ' 235' ' ' ALA . 0.1 OUTLIER -113.54 -65.48 1.18 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.506 1.129 . . . . 62.409999999999997 109.265 -179.943 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -128.18 90.73 0.33 Allowed Glycine 0 CA--C 1.53 1.017 0 O-C-N 124.547 1.155 . . . . 61.229999999999997 110.966 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.9 p -114.07 141.74 47.08 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.437 0.728 . . . . 71.030000000000001 110.001 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.41 ' HG3' ' N ' ' A' ' 76' ' ' GLU . 19.0 tp10 -44.74 153.88 0.15 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.505 1.128 . . . . 74.109999999999999 110.249 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.41 ' N ' ' HG3' ' A' ' 75' ' ' GLU . 1.1 tt0 -118.15 128.13 54.43 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.48 1.113 . . . . 75.040000000000006 110.304 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.468 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 6.3 p -133.95 158.96 42.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 O-C-N 124.445 1.09 . . . . 71.129999999999995 109.32 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.558 ' CG ' ' O ' ' A' ' 78' ' ' PHE . 28.7 t80 -86.63 22.02 2.02 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.492 1.12 . . . . 73.430000000000007 110.937 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.406 ' C ' ' O ' ' A' ' 78' ' ' PHE . 6.6 tp -39.91 151.55 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.519 1.137 . . . . 74.239999999999995 109.198 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.433 ' HD3' HG23 ' A' ' 106' ' ' ILE . 8.3 ttmt -91.04 -60.65 1.85 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.535 1.147 . . . . 75.010000000000005 109.307 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.676 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.3 OUTLIER -161.44 136.46 7.42 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.424 1.078 . . . . 70.310000000000002 110.974 179.966 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.551 HG11 ' HA ' ' A' ' 128' ' ' ALA . 4.0 p -89.36 167.71 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 O-C-N 124.515 1.135 . . . . 70.420000000000002 109.35 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.792 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.2 mp -131.35 96.76 2.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 124.466 1.104 . . . . 62.039999999999999 109.308 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.437 ' HG ' ' CB ' ' A' ' 128' ' ' ALA . 3.1 mt -72.92 118.9 16.43 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.505 1.128 . . . . 70.120000000000005 109.296 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.742 ' HD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -141.18 174.46 10.51 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.425 1.078 . . . . 62.039999999999999 109.529 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.612 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -105.14 156.46 18.07 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.493 1.12 . . . . 71.510000000000005 109.254 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.71 -14.54 21.62 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.517 1.135 . . . . 75.530000000000001 110.317 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -84.52 -46.3 11.74 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.499 1.124 . . . . 75.450000000000003 109.316 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.728 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.5 OUTLIER -112.1 43.72 1.54 Allowed 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.519 1.137 . . . . 74.219999999999999 109.311 179.976 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.601 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -80.09 -22.25 42.41 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.55 1.156 . . . . 72.129999999999995 110.418 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -83.36 -27.21 29.83 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.425 1.078 . . . . 70.299999999999997 109.241 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -70.78 -55.56 8.3 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.529 1.143 . . . . 74.219999999999999 110.363 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.742 ' HB3' ' HD2' ' A' ' 85' ' ' HIS . . . -58.79 -34.74 71.82 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.483 1.114 . . . . 75.409999999999997 109.261 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.983 ' HB2' HD13 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -73.57 -41.6 62.69 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.532 1.145 . . . . 73.120000000000005 109.315 -179.994 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.644 ' N ' HD13 ' A' ' 94' ' ' LEU . 27.0 tpt180 -51.03 -31.17 17.54 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.479 1.112 . . . . 50.039999999999999 110.314 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.813 HG21 ' HE1' ' A' ' 173' ' ' MET . 2.0 t -82.88 -63.69 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 124.437 1.085 . . . . 65.349999999999994 109.221 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.584 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -41.49 -26.27 0.06 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.473 1.108 . . . . 71.430000000000007 110.34 -180.0 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.447 ' N ' ' C ' ' A' ' 96' ' ' VAL . 1.5 t-20 -71.68 -49.69 37.4 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.496 1.123 . . . . 63.340000000000003 109.347 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.845 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -73.79 -22.88 59.67 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.463 1.102 . . . . 73.219999999999999 109.267 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.845 ' N ' HD23 ' A' ' 99' ' ' LEU . 37.2 mt -63.27 -55.26 26.25 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.528 1.143 . . . . 75.129999999999995 109.291 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.67 59.35 1.16 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.459 1.099 . . . . 71.150000000000006 110.224 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.4 t70 175.87 -65.99 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.552 1.158 . . . . 60.43 109.254 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -42.77 -55.07 3.8 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.434 1.084 . . . . 60.030000000000001 109.25 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.592 ' CZ ' HG11 ' A' ' 206' ' ' VAL . 1.9 m-85 -111.92 -20.22 12.09 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.488 1.118 . . . . 71.140000000000001 110.976 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.54 45.92 3.6 Favored Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.512 1.133 . . . . 64.230000000000004 110.997 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.433 HG23 ' HD3' ' A' ' 80' ' ' LYS . 7.2 mm -88.0 90.45 3.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 O-C-N 124.517 0.775 . . . . 74.150000000000006 109.279 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.517 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -137.7 158.24 72.06 Favored Pre-proline 0 C--N 1.324 -0.507 0 O-C-N 124.496 1.122 . . . . 74.329999999999998 109.29 -179.969 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.517 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.2 Cg_endo -74.96 150.3 95.24 Favored 'Cis proline' 0 C--N 1.36 1.14 0 C-N-CA 121.0 -2.5 . . . . 71.409999999999997 110.983 -0.046 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -119.69 132.38 9.44 Favored Glycine 0 CA--C 1.531 1.061 0 O-C-N 124.491 1.12 . . . . 74.519999999999996 110.885 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.453 ' CD1' ' HA ' ' A' ' 115' ' ' MET . 0.4 OUTLIER -151.41 144.09 16.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.581 0.812 . . . . 71.230000000000004 109.255 179.95 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.983 HD13 ' HB2' ' A' ' 94' ' ' LEU . 38.6 pt -97.17 177.02 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 O-C-N 124.528 1.143 . . . . 74.329999999999998 109.273 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.459 ' CD1' ' SD ' ' A' ' 115' ' ' MET . 1.8 t80 -76.13 -18.7 59.03 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.555 1.159 . . . . 75.310000000000002 110.975 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -95.97 -2.32 47.26 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.556 1.16 . . . . 63.210000000000001 109.303 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.427 ' HB2' ' CG1' ' A' ' 111' ' ' ILE . 5.5 mt-10 -111.35 -26.56 9.06 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.458 1.099 . . . . 65.310000000000002 110.234 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.459 ' SD ' ' CD1' ' A' ' 112' ' ' PHE . 1.2 ptp -70.88 134.89 85.6 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.532 1.145 . . . . 75.129999999999995 110.977 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.96 87.17 1.34 Allowed 'Trans proline' 0 C--N 1.36 1.149 0 O-C-N 124.498 1.788 . . . . 72.150000000000006 111.034 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -174.28 121.74 0.28 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.532 1.145 . . . . 75.230000000000004 109.566 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 164.68 145.0 4.24 Favored Glycine 0 CA--C 1.53 1.025 0 O-C-N 124.478 1.112 . . . . 22.350000000000001 111.036 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 77.3 mtt180 -155.65 -176.81 6.14 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.487 0.757 . . . . 64.040000000000006 110.298 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -42.04 -31.67 0.38 Allowed 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.525 1.141 . . . . 64.129999999999995 110.331 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . 0.423 ' NE2' ' O ' ' A' ' 122' ' ' LEU . 0.7 OUTLIER -153.31 135.74 15.05 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.502 1.127 . . . . 71.200000000000003 109.659 179.978 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.423 ' O ' ' NE2' ' A' ' 121' ' ' HIS . 0.4 OUTLIER -68.44 136.27 53.0 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.495 1.122 . . . . 73.219999999999999 109.256 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -73.12 -44.56 60.1 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.486 1.116 . . . . 73.040000000000006 110.291 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -176.47 130.03 0.21 Allowed 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.449 1.093 . . . . 65.129999999999995 109.31 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.774 HD22 ' ND2' ' A' ' 150' ' ' ASN . 0.9 OUTLIER -58.4 -17.63 21.86 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.531 1.144 . . . . 55.25 109.363 179.993 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.404 ' O ' ' N ' ' A' ' 129' ' ' VAL . 0.7 OUTLIER -41.23 -30.01 0.15 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.502 1.126 . . . . 74.409999999999997 109.345 179.928 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.414 ' N ' ' C ' ' A' ' 125' ' ' LEU . 3.8 t0 -44.35 -51.66 8.32 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.484 1.115 . . . . 55.109999999999999 109.266 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.551 ' HA ' HG11 ' A' ' 82' ' ' VAL . . . -66.12 -34.42 78.01 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.514 1.134 . . . . 75.030000000000001 109.288 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.745 ' O ' HG12 ' A' ' 129' ' ' VAL . 70.2 t -92.99 30.64 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.501 1.126 . . . . 71.299999999999997 109.382 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -131.75 130.47 41.93 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.479 1.112 . . . . 73.099999999999994 109.36 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 48.5 72.62 0.43 Allowed Glycine 0 CA--C 1.531 1.063 0 O-C-N 124.488 1.118 . . . . 43.530000000000001 110.985 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.3 m -160.71 167.82 26.11 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.578 0.811 . . . . 74.530000000000001 110.047 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.809 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -100.07 -33.89 10.29 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.428 1.08 . . . . 61.130000000000003 109.317 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.809 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.0 OUTLIER -161.87 151.74 16.66 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.608 1.192 . . . . 71.439999999999998 107.965 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 47.2 p -120.22 145.37 47.08 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.466 1.104 . . . . 73.25 110.419 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.831 ' O ' HD13 ' A' ' 137' ' ' LEU . 20.6 mm -99.25 131.01 47.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.495 1.122 . . . . 62.539999999999999 109.351 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.831 HD13 ' O ' ' A' ' 136' ' ' ILE . 0.4 OUTLIER -124.74 99.65 6.26 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.493 1.121 . . . . 64.319999999999993 109.328 -179.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.728 HD23 ' HB2' ' A' ' 89' ' ' ASP . 0.1 OUTLIER -62.22 90.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.425 1.078 . . . . 73.140000000000001 109.243 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.53 HD11 HD13 ' A' ' 189' ' ' LEU . 0.9 OUTLIER -60.34 103.01 0.2 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.527 1.142 . . . . 71.549999999999997 109.312 179.976 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.604 HG22 ' H ' ' A' ' 141' ' ' GLU . 6.7 m -130.49 179.95 5.63 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.426 1.079 . . . . 52.009999999999998 110.427 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.604 ' H ' HG22 ' A' ' 140' ' ' THR . 33.9 mt-10 -75.54 -39.55 58.11 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.466 1.104 . . . . 75.230000000000004 110.313 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -89.46 -50.85 5.86 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.556 1.16 . . . . 73.200000000000003 109.352 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.612 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 52.9 t80 -50.26 -21.24 1.29 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 71.239999999999995 110.94 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.706 HD13 ' C ' ' A' ' 144' ' ' LEU . 1.8 tm? -64.45 -67.84 0.4 Allowed 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.53 1.143 . . . . 71.140000000000001 109.253 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.619 ' N ' HD13 ' A' ' 144' ' ' LEU . 0.0 OUTLIER -60.18 -15.29 22.81 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.521 1.138 . . . . 74.340000000000003 110.247 -179.957 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -67.5 -64.57 0.83 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.467 1.104 . . . . 72.099999999999994 109.277 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.515 HG23 ' CE2' ' A' ' 151' ' ' PHE . 1.0 OUTLIER -85.43 -48.18 9.25 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.502 1.126 . . . . 34.420000000000002 110.41 179.961 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.622 ' HB2' HD22 ' A' ' 144' ' ' LEU . 26.0 t-105 -42.51 -48.34 5.26 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.577 1.173 . . . . 65.310000000000002 108.022 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . 0.445 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 27.0 t -65.14 -44.98 86.87 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 124.495 1.122 . . . . 53.409999999999997 108.242 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.774 ' ND2' HD22 ' A' ' 125' ' ' LEU . 0.3 OUTLIER -48.13 -41.28 26.12 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.589 1.18 . . . . 75.329999999999998 109.331 -179.978 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.685 ' HE1' HD11 ' A' ' 125' ' ' LEU . 14.4 m-30 -66.99 -35.85 80.86 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.482 1.114 . . . . 64.299999999999997 111.01 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -49.25 -46.44 46.13 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.486 1.116 . . . . 61.329999999999998 110.332 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -85.33 -15.19 44.09 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.532 1.145 . . . . 61.310000000000002 111.04 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -132.9 85.66 2.24 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.501 1.125 . . . . 74.310000000000002 111.036 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.58 -14.25 40.47 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 124.526 1.141 . . . . 75.239999999999995 110.402 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 23.2 m -53.68 -22.89 9.84 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.471 1.107 . . . . 61.100000000000001 109.978 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.562 HD12 ' CE1' ' A' ' 151' ' ' PHE . 0.6 OUTLIER -82.89 -45.89 13.66 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.467 1.105 . . . . 72.409999999999997 109.251 -179.95 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' MET . . . . . 0.544 ' CE ' HG21 ' A' ' 161' ' ' VAL . 26.6 mmt -42.34 -32.74 0.55 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.507 1.129 . . . . 71.510000000000005 111.026 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -65.27 -49.77 68.29 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.524 1.14 . . . . 73.209999999999994 109.313 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.718 ' HB2' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -68.66 -29.04 67.43 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.527 1.142 . . . . 61.450000000000003 109.994 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . 0.544 HG21 ' CE ' ' A' ' 158' ' ' MET . 6.2 t -55.06 -19.49 4.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.543 1.152 . . . . 71.209999999999994 109.344 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . 0.468 ' O ' ' N ' ' A' ' 164' ' ' GLN . 6.6 t-20 -91.05 20.84 4.62 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.539 1.149 . . . . 74.450000000000003 109.321 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.43 ' C ' ' O ' ' A' ' 162' ' ' ASN . 0.5 OUTLIER 35.6 33.55 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.514 1.133 . . . . 75.530000000000001 110.297 -179.956 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . 0.468 ' N ' ' O ' ' A' ' 162' ' ' ASN . 2.6 mt-30 -48.22 176.74 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.49 1.118 . . . . 54.210000000000001 110.291 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.428 ' CD2' ' H ' ' A' ' 165' ' ' HIS . 2.9 p80 -93.42 71.96 4.41 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.425 1.078 . . . . 62.140000000000001 109.586 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.554 ' HG3' ' CD2' ' A' ' 167' ' ' TYR . 2.2 tppt? -123.13 157.12 33.61 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.551 1.157 . . . . 72.439999999999998 109.306 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' TYR . . . . . 0.62 ' CD1' ' N ' ' A' ' 168' ' ' ASN . 45.0 p90 -38.75 -45.94 1.19 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.501 1.126 . . . . 74.420000000000002 110.99 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.666 ' ND2' HG13 ' A' ' 129' ' ' VAL . 1.7 p-10 -99.34 129.92 45.59 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.482 1.114 . . . . 75.319999999999993 109.237 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.483 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 14.0 m -110.73 158.35 18.75 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.457 1.098 . . . . 61.439999999999998 109.968 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.718 HG21 ' HB2' ' A' ' 160' ' ' SER . 42.9 t -116.56 111.35 34.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.481 1.113 . . . . 63.329999999999998 109.323 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.502 HG22 ' HB2' ' A' ' 195' ' ' LEU . 21.9 mm -122.86 93.75 48.06 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.514 1.134 . . . . 60.210000000000001 109.325 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.953 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 17.9 Cg_endo -75.01 107.65 2.53 Favored 'Trans proline' 0 C--N 1.36 1.142 0 O-C-N 124.566 1.824 . . . . 72.310000000000002 110.976 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . 0.813 ' HE1' HG21 ' A' ' 96' ' ' VAL . 4.1 ttt -83.65 152.8 24.59 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.475 1.109 . . . . 65.540000000000006 110.996 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . 0.414 ' N ' ' HG2' ' A' ' 173' ' ' MET . 25.5 mmm-85 -110.88 118.21 48.77 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.453 1.096 . . . . 71.340000000000003 110.32 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 175' ' ' PRO . . . . . 0.644 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.2 Cg_endo -75.0 154.96 42.86 Favored 'Trans proline' 0 C--N 1.36 1.15 0 O-C-N 124.508 1.794 . . . . 71.349999999999994 111.012 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.866 HD21 ' CG ' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -95.58 -38.09 10.56 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 124.53 1.144 . . . . 70.430000000000007 109.372 179.951 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . 0.452 HD22 ' N ' ' A' ' 177' ' ' ASN . 1.4 m-80 -72.8 -22.38 60.83 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.461 1.101 . . . . 75.109999999999999 109.35 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -110.42 108.35 58.44 Favored Pre-proline 0 C--N 1.326 -0.441 0 O-C-N 124.44 1.087 . . . . 51.210000000000001 109.275 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.96 124.06 8.37 Favored 'Trans proline' 0 C--N 1.36 1.149 0 O-C-N 124.5 1.789 . . . . 74.340000000000003 110.987 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -139.94 96.98 8.09 Favored Pre-proline 0 C--N 1.324 -0.525 0 O-C-N 124.49 1.119 . . . . 72.450000000000003 109.354 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.02 155.43 42.82 Favored 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.474 1.776 . . . . 75.340000000000003 111.012 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.2 -28.3 39.9 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 124.541 1.151 . . . . 71.230000000000004 110.232 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -53.55 -29.33 36.5 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.496 1.122 . . . . 74.319999999999993 110.346 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 27.4 mmt180 -99.42 -16.72 18.28 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.492 1.12 . . . . 64.230000000000004 110.282 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 185' ' ' THR . . . . . 0.485 HG22 ' HD2' ' A' ' 186' ' ' PRO . 20.8 m -80.08 144.02 58.12 Favored Pre-proline 0 C--N 1.325 -0.458 0 O-C-N 124.534 1.146 . . . . 72.200000000000003 110.382 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . 0.788 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -74.96 155.58 43.12 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.466 1.771 . . . . 75.439999999999998 110.974 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 187' ' ' PHE . . . . . 0.509 ' O ' ' CG2' ' A' ' 191' ' ' THR . 7.7 p90 -69.44 -7.09 34.71 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.462 1.101 . . . . 72.439999999999998 110.972 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . 0.453 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -94.08 -52.88 4.19 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.484 1.115 . . . . 73.430000000000007 109.314 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.788 HD12 ' CG ' ' A' ' 186' ' ' PRO . 48.3 mt -68.48 -42.28 78.93 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.494 1.121 . . . . 72.329999999999998 109.365 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 190' ' ' GLN . . . . . 0.411 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.2 pt20 -64.04 -10.46 22.15 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 124.45 1.094 . . . . 72.329999999999998 110.306 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 191' ' ' THR . . . . . 0.509 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 33.5 p -113.4 17.74 18.24 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 124.525 1.141 . . . . 72.299999999999997 110.396 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.476 ' CD1' ' O ' ' A' ' 161' ' ' VAL . 4.8 mt -117.57 157.87 18.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.54 1.15 . . . . 52.310000000000002 109.334 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 193' ' ' ASN . . . . . 0.407 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 28.7 t30 -78.58 70.33 4.91 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.551 1.157 . . . . 63.32 109.305 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . 0.953 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -61.76 178.21 0.35 Allowed 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.494 1.121 . . . . 72.299999999999997 109.267 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 195' ' ' LEU . . . . . 0.642 HD23 HD12 ' A' ' 209' ' ' ILE . 0.8 OUTLIER -105.88 122.99 47.25 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.465 1.103 . . . . 74.299999999999997 109.314 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -102.27 141.82 34.5 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.423 1.077 . . . . 74.230000000000004 110.332 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.866 ' CG ' HD21 ' A' ' 176' ' ' LEU . 15.5 tp10 -111.67 -22.27 11.27 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.488 1.118 . . . . 63.130000000000003 110.292 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . 0.403 ' HB3' HD12 ' A' ' 176' ' ' LEU . 2.4 pp20? -106.2 11.24 31.45 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.548 1.155 . . . . 74.439999999999998 110.268 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 32.8 t -94.68 171.5 8.75 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.523 1.139 . . . . 41.130000000000003 110.028 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -77.74 -42.16 35.2 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.511 1.132 . . . . 65.540000000000006 110.34 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -90.33 16.74 56.81 Favored Glycine 0 CA--C 1.53 1.009 0 O-C-N 124.442 1.089 . . . . 63.340000000000003 111.018 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 202' ' ' PHE . . . . . 0.619 ' C ' ' CD1' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -48.75 -47.58 71.89 Favored Pre-proline 0 C--N 1.326 -0.454 0 O-C-N 124.532 0.784 . . . . 61.240000000000002 111.013 -179.991 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 203' ' ' PRO . . . . . 0.642 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.0 Cg_endo -75.04 -28.11 9.38 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.533 1.807 . . . . 74.230000000000004 110.969 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.88 -48.01 80.85 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.412 1.07 . . . . 74.150000000000006 110.439 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 205' ' ' GLN . . . . . 0.473 ' HB2' ' CD2' ' A' ' 195' ' ' LEU . 9.3 mt-30 -60.89 -61.91 2.24 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.477 1.111 . . . . 72.430000000000007 110.299 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 206' ' ' VAL . . . . . 0.693 HG21 ' CD2' ' A' ' 100' ' ' LEU . 2.7 p -39.58 -34.05 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 124.547 1.154 . . . . 74.450000000000003 109.298 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 207' ' ' GLU . . . . . 0.404 ' N ' ' C ' ' A' ' 205' ' ' GLN . 3.2 mm-40 -75.06 -65.06 0.92 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.486 1.116 . . . . 75.140000000000001 110.265 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -49.62 -59.58 3.65 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.567 1.167 . . . . 74.239999999999995 110.337 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 209' ' ' ILE . . . . . 0.731 HG22 ' CD1' ' A' ' 210' ' ' PHE . 64.5 mt -50.04 -68.82 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.436 1.085 . . . . 53.149999999999999 109.335 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 210' ' ' PHE . . . . . 0.731 ' CD1' HG22 ' A' ' 209' ' ' ILE . 0.4 OUTLIER -89.42 66.92 7.57 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.491 1.12 . . . . 73.200000000000003 110.999 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 211' ' ' GLN . . . . . 0.532 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.2 OUTLIER -110.48 148.19 32.58 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.539 1.149 . . . . 61.210000000000001 110.261 -179.992 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.426 ' O ' ' HB3' ' A' ' 215' ' ' TYR . 5.8 tt0 -53.75 -52.38 60.38 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.566 1.166 . . . . 72.420000000000002 110.285 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . 0.405 ' N ' ' HG3' ' A' ' 211' ' ' GLN . 0.6 OUTLIER -50.42 -21.3 1.39 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.449 1.093 . . . . 74.430000000000007 109.97 -179.993 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.532 HG23 ' HG2' ' A' ' 211' ' ' GLN . 21.7 t -95.21 -37.5 7.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.533 1.145 . . . . 74.430000000000007 109.339 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 215' ' ' TYR . . . . . 0.469 ' HH ' ' HZ ' ' A' ' 78' ' ' PHE . 5.1 t80 -51.7 -47.55 63.87 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.43 1.081 . . . . 74.329999999999998 110.967 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 2.8 mtmt -43.17 -55.28 4.01 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.467 1.104 . . . . 65.230000000000004 109.259 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 217' ' ' THR . . . . . 1.09 HG22 HD11 ' A' ' 221' ' ' ILE . 33.9 m -56.11 -66.43 0.43 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.435 1.085 . . . . 73.150000000000006 110.392 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 218' ' ' GLN . . . . . 0.448 ' HA ' HD12 ' A' ' 221' ' ' ILE . 41.5 mm-40 -47.99 -23.53 0.82 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.438 1.086 . . . . 74.439999999999998 110.278 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 219' ' ' GLN . . . . . 0.443 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 19.9 tp60 -82.36 -37.76 25.19 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.51 1.131 . . . . 73.200000000000003 110.312 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 220' ' ' THR . . . . . 0.418 ' HA ' ' CG ' ' A' ' 223' ' ' LYS . 1.2 m -78.57 -21.42 48.67 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.493 1.121 . . . . 65.230000000000004 110.343 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 221' ' ' ILE . . . . . 1.09 HD11 HG22 ' A' ' 217' ' ' THR . 12.7 mt -83.81 -37.17 12.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.477 1.111 . . . . 75.150000000000006 109.346 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 222' ' ' TRP . . . . . 0.941 ' O ' HG22 ' A' ' 225' ' ' THR . 27.3 t90 -66.84 -44.44 81.06 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.548 1.155 . . . . 71.239999999999995 107.963 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.418 ' CG ' ' HA ' ' A' ' 220' ' ' THR . 0.0 OUTLIER -68.13 -23.01 64.84 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.516 1.135 . . . . 63.100000000000001 109.283 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -87.94 -28.86 21.22 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.399 1.062 . . . . 73.219999999999999 110.359 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.941 HG22 ' O ' ' A' ' 222' ' ' TRP . 5.0 t -62.53 -20.13 64.33 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.592 1.182 . . . . 74.450000000000003 110.429 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 1.3 mtm180 -79.77 -16.14 56.12 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.507 1.13 . . . . 61.439999999999998 110.281 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 227' ' ' ASN . . . . . 0.453 ' O ' ' N ' ' A' ' 231' ' ' ARG . 0.9 OUTLIER -86.34 -56.93 3.21 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.421 1.076 . . . . 70.329999999999998 109.325 179.956 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 21.9 ptp -48.87 -40.65 30.48 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.52 1.138 . . . . 74.109999999999999 111.033 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 229' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 233' ' ' PHE . 7.7 p -66.17 -47.8 83.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 124.455 1.097 . . . . 61.240000000000002 109.343 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 230' ' ' GLN . . . . . 0.437 ' N ' HG13 ' A' ' 229' ' ' VAL . 0.6 OUTLIER -81.79 6.34 15.86 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.541 1.151 . . . . 60.140000000000001 110.314 -179.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 231' ' ' ARG . . . . . 0.453 ' N ' ' O ' ' A' ' 227' ' ' ASN . 0.0 OUTLIER -103.92 -67.26 0.9 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.439 1.087 . . . . 54.310000000000002 110.322 179.985 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 232' ' ' GLN . . . . . 0.436 ' HB2' ' CD ' ' A' ' 231' ' ' ARG . 7.0 mt-30 -156.49 44.85 0.41 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.479 1.112 . . . . 72.140000000000001 110.324 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 233' ' ' PHE . . . . . 0.488 ' O ' HG23 ' A' ' 229' ' ' VAL . 0.1 OUTLIER -158.8 47.04 0.32 Allowed 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.536 1.147 . . . . 75.409999999999997 111.031 179.98 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.485 ' CG2' ' N ' ' A' ' 235' ' ' ALA . 1.6 mp -61.73 162.93 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.535 1.147 . . . . 72.400000000000006 109.253 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 235' ' ' ALA . . . . . 0.488 ' HB3' HD22 ' A' ' 72' ' ' LEU . . . . . . . . 0 C--N 1.326 -0.447 0 O-C-N 124.552 1.157 . . . . 63.219999999999999 109.234 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.428 ' N ' ' OD1' ' A' ' 126' ' ' ASP . . . . . . . . 0 CA--C 1.529 0.961 0 N-CA-C 111.004 -0.838 . . . . 74.420000000000002 111.004 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.95 141.04 26.3 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.459 1.768 . . . . 63.130000000000003 110.999 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.756 HD12 ' HB1' ' A' ' 235' ' ' ALA . 0.2 OUTLIER -113.64 -44.02 3.24 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.592 1.183 . . . . 73.109999999999999 109.275 -179.986 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -85.34 70.53 3.07 Favored Glycine 0 CA--C 1.53 0.998 0 O-C-N 124.49 1.119 . . . . 54.020000000000003 111.01 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.456 ' OG ' ' N ' ' A' ' 75' ' ' GLU . 0.9 OUTLIER -128.47 175.9 8.16 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.526 0.78 . . . . 62.420000000000002 110.039 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.456 ' N ' ' OG ' ' A' ' 74' ' ' SER . 10.5 tt0 -38.44 150.28 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.478 1.111 . . . . 72.040000000000006 110.335 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -115.98 151.15 36.0 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.566 1.166 . . . . 74.329999999999998 110.305 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.591 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 9.0 p -162.73 157.75 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.517 1.136 . . . . 74.310000000000002 109.333 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.477 ' CE2' ' OH ' ' A' ' 215' ' ' TYR . 3.3 t80 -87.48 20.73 2.76 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.463 1.102 . . . . 73.329999999999998 111.038 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.407 ' C ' ' O ' ' A' ' 78' ' ' PHE . 6.3 tp -39.31 156.84 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.416 1.072 . . . . 74.409999999999997 109.286 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 1.099 ' NZ ' HG22 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -104.47 -57.28 2.05 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.516 1.135 . . . . 64.340000000000003 109.293 -179.973 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.807 ' CE1' HD11 ' A' ' 83' ' ' ILE . 0.1 OUTLIER -161.92 150.7 15.45 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.559 1.162 . . . . 55.030000000000001 110.945 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.417 ' CG1' HG22 ' A' ' 135' ' ' THR . 3.9 p -103.13 159.48 4.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 124.484 1.115 . . . . 75.329999999999998 109.331 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.832 HG23 ' HB ' ' A' ' 136' ' ' ILE . 4.2 mp -122.36 88.29 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.439 1.087 . . . . 65.109999999999999 109.336 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.055 HD11 ' HB1' ' A' ' 128' ' ' ALA . 5.1 mp -70.01 114.88 8.6 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.452 1.095 . . . . 64.010000000000005 109.245 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.726 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -131.52 174.79 9.74 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.466 1.104 . . . . 74.120000000000005 109.529 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -111.21 157.3 20.25 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.489 1.118 . . . . 75.329999999999998 109.322 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.17 -11.27 19.41 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.426 1.079 . . . . 64.540000000000006 110.225 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -84.25 -40.28 18.23 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.556 1.16 . . . . 64.430000000000007 109.288 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.704 ' HB2' HD12 ' A' ' 138' ' ' LEU . 1.3 p30 -127.25 41.0 3.6 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.409 1.068 . . . . 73.549999999999997 109.303 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.613 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -74.28 -53.61 9.37 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.578 1.174 . . . . 45.130000000000003 110.36 -179.953 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.18 -17.85 21.68 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.476 1.11 . . . . 72.340000000000003 109.252 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -78.84 -55.84 4.85 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.521 1.138 . . . . 75.310000000000002 110.247 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 1.011 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -65.15 -20.24 66.36 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.597 1.185 . . . . 54.149999999999999 109.29 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.623 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -86.13 -52.9 5.38 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.482 1.114 . . . . 73.129999999999995 109.35 179.964 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.617 ' N ' HD13 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -43.47 -36.2 1.91 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.445 1.091 . . . . 65.340000000000003 110.249 179.986 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.59 HG13 ' N ' ' A' ' 97' ' ' GLN . 11.0 p -80.34 -55.84 7.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 124.526 1.141 . . . . 73.219999999999999 109.296 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.627 HE21 HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -47.77 -23.43 0.72 Allowed 'General case' 0 C--N 1.323 -0.547 0 O-C-N 124.493 1.12 . . . . 75.209999999999994 110.323 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.24 -38.91 55.69 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.494 1.121 . . . . 74.230000000000004 109.359 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.741 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -80.66 -23.13 39.86 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.503 1.127 . . . . 71.540000000000006 109.261 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.741 ' N ' HD23 ' A' ' 99' ' ' LEU . 32.5 mt -62.76 -44.38 96.36 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.475 1.11 . . . . 73.310000000000002 109.288 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.522 ' HB2' ' CD ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -85.76 55.44 3.52 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.521 1.138 . . . . 73.420000000000002 110.302 -179.985 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -178.18 -63.46 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.513 1.133 . . . . 44.530000000000001 109.273 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -43.79 -56.04 4.09 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.481 1.113 . . . . 65.430000000000007 109.378 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -109.43 -28.12 9.1 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.496 1.122 . . . . 73.109999999999999 110.998 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 101.02 39.52 3.08 Favored Glycine 0 CA--C 1.53 0.982 0 O-C-N 124.561 1.163 . . . . 61.509999999999998 111.023 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 1.099 HG22 ' NZ ' ' A' ' 80' ' ' LYS . 8.2 mm -83.37 90.05 2.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 O-C-N 124.5 0.765 . . . . 74.420000000000002 109.33 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.522 ' CD ' ' HB2' ' A' ' 101' ' ' GLN . 0.0 OUTLIER -142.72 161.82 47.3 Favored Pre-proline 0 C--N 1.325 -0.484 0 O-C-N 124.48 1.112 . . . . 65.109999999999999 109.332 179.98 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.51 ' HA ' ' CB ' ' A' ' 107' ' ' LYS . 18.6 Cg_endo -74.98 149.43 93.83 Favored 'Cis proline' 0 C--N 1.36 1.177 0 C-N-CA 120.983 -2.507 . . . . 71.439999999999998 111.043 -0.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -121.95 131.07 8.29 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.456 1.098 . . . . 60.509999999999998 111.039 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -142.76 148.01 20.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 O-C-N 124.513 0.772 . . . . 71.549999999999997 109.327 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.726 HD12 ' NE2' ' A' ' 85' ' ' HIS . 32.2 pt -102.09 -177.16 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.477 1.11 . . . . 65.299999999999997 109.259 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.517 ' CD1' ' HG ' ' A' ' 84' ' ' LEU . 2.6 t80 -81.81 -23.21 36.65 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.569 1.168 . . . . 53.409999999999997 110.973 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -86.71 -5.32 59.16 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.465 1.103 . . . . 50.520000000000003 109.329 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -109.44 -26.61 9.89 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.507 1.129 . . . . 74.209999999999994 110.273 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.412 ' CE ' HG21 ' A' ' 82' ' ' VAL . 13.0 ttm -41.84 110.69 0.81 Allowed Pre-proline 0 C--N 1.325 -0.482 0 O-C-N 124.456 1.098 . . . . 72.450000000000003 110.996 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.04 152.65 40.83 Favored 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.481 1.78 . . . . 75.420000000000002 110.985 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.467 ' CG ' ' HA ' ' A' ' 121' ' ' HIS . 7.6 m-70 -124.12 178.26 5.41 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.488 1.118 . . . . 74.340000000000003 109.586 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -109.06 -71.66 0.71 Allowed Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.548 1.155 . . . . 72.140000000000001 110.97 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 23.4 ttp85 -112.6 -36.65 5.15 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.524 0.779 . . . . 74.150000000000006 110.235 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -133.78 145.7 50.03 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.417 1.073 . . . . 53.039999999999999 110.328 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . 0.476 ' O ' ' CD2' ' A' ' 121' ' ' HIS . 0.3 OUTLIER -81.58 128.97 34.49 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.536 1.147 . . . . 74.239999999999995 109.597 -179.976 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.667 HD22 ' C ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -62.64 143.65 57.1 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.543 1.152 . . . . 74.120000000000005 109.241 -179.964 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.2 pp0? -129.83 11.45 5.64 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.479 1.112 . . . . 73.129999999999995 110.325 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -113.88 139.99 48.73 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.473 1.108 . . . . 61.030000000000001 109.335 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.648 ' O ' ' HB3' ' A' ' 128' ' ' ALA . 4.0 pp -69.91 -17.52 63.34 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.456 1.097 . . . . 73.310000000000002 109.25 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.443 ' O ' ' N ' ' A' ' 129' ' ' VAL . 1.7 t70 -42.22 -65.27 0.48 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.582 1.176 . . . . 72.239999999999995 109.298 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -46.49 -40.66 12.81 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.398 1.061 . . . . 72.400000000000006 109.326 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 1.055 ' HB1' HD11 ' A' ' 84' ' ' LEU . . . -58.47 -38.96 78.66 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.501 1.126 . . . . 72.430000000000007 109.294 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.699 ' O ' HG12 ' A' ' 129' ' ' VAL . 77.1 t -90.45 18.41 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.54 1.15 . . . . 74.439999999999998 109.35 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -127.55 152.11 48.03 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.535 1.147 . . . . 64.129999999999995 109.322 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 47.5 56.17 8.56 Favored Glycine 0 CA--C 1.529 0.954 0 O-C-N 124.522 1.139 . . . . 71.329999999999998 111.031 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.9 p -163.76 163.73 23.95 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.473 0.749 . . . . 72.140000000000001 109.979 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.607 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -103.58 -23.78 13.46 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.451 1.094 . . . . 60.329999999999998 109.327 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.607 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.6 m-90 -161.79 157.5 24.27 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.026 -1.102 . . . . 72.5 108.026 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.512 ' HB ' HD13 ' A' ' 84' ' ' LEU . 33.8 p -131.15 127.02 37.17 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.464 1.103 . . . . 50.439999999999998 110.381 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.867 ' O ' HD23 ' A' ' 137' ' ' LEU . 4.3 mm -84.32 141.53 14.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.51 1.132 . . . . 73.329999999999998 109.301 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.867 HD23 ' O ' ' A' ' 136' ' ' ILE . 34.0 mt -134.97 110.66 9.24 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.457 1.098 . . . . 63.420000000000002 109.268 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 1.011 HD21 ' HB2' ' A' ' 93' ' ' ALA . 1.1 mm? -63.06 88.58 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.51 1.131 . . . . 61.219999999999999 109.27 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.51 HD12 ' HA ' ' A' ' 139' ' ' LEU . 6.7 tp -60.43 100.64 0.11 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.538 1.149 . . . . 71.010000000000005 109.304 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.671 HG22 ' H ' ' A' ' 141' ' ' GLU . 11.0 m -129.68 -177.55 4.32 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 72.319999999999993 110.417 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.671 ' H ' HG22 ' A' ' 140' ' ' THR . 59.4 mt-10 -79.24 -35.95 40.71 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 124.485 1.116 . . . . 75.219999999999999 110.31 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 17.6 p30 -89.51 -34.49 16.37 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.503 1.127 . . . . 71.439999999999998 109.295 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.578 ' CE1' HG21 ' A' ' 147' ' ' THR . 6.6 t80 -71.63 -39.34 70.48 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.566 1.166 . . . . 73.420000000000002 111.048 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.8 HD13 ' N ' ' A' ' 145' ' ' ARG . 1.1 tm? -51.32 -67.47 0.25 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.47 1.106 . . . . 73.319999999999993 109.336 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.8 ' N ' HD13 ' A' ' 144' ' ' LEU . 0.0 OUTLIER -54.6 -19.14 5.4 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.56 1.163 . . . . 72.400000000000006 110.321 179.946 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -74.66 -43.13 56.81 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.582 1.177 . . . . 74.530000000000001 109.311 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.578 HG21 ' CE1' ' A' ' 143' ' ' PHE . 9.4 p -93.69 -7.57 43.36 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.453 1.096 . . . . 71.430000000000007 110.445 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.436 ' N ' ' O ' ' A' ' 144' ' ' LEU . 2.7 t-105 -86.53 -27.08 24.2 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.554 1.159 . . . . 62.439999999999998 108.01 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 13.2 t -83.57 -45.16 13.84 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.494 1.121 . . . . 51.200000000000003 108.366 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.535 ' ND2' HD21 ' A' ' 125' ' ' LEU . 0.1 OUTLIER -63.27 -42.49 99.15 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.53 1.144 . . . . 61.32 109.35 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.632 ' CE1' HD12 ' A' ' 157' ' ' LEU . 5.1 m-30 -62.9 -34.66 77.89 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.542 1.151 . . . . 70.329999999999998 111.027 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -55.34 -48.76 73.72 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.515 1.135 . . . . 64.310000000000002 110.268 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.485 ' CG ' ' O ' ' A' ' 153' ' ' PHE . 11.5 t80 -86.78 0.28 55.06 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.476 1.11 . . . . 74.219999999999999 110.978 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.524 ' CE1' ' HB3' ' A' ' 156' ' ' SER . 0.4 OUTLIER -134.13 86.69 2.3 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.512 1.132 . . . . 70.120000000000005 111.003 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -67.26 -16.12 64.09 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.467 1.105 . . . . 71.549999999999997 110.412 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . 0.524 ' HB3' ' CE1' ' A' ' 154' ' ' TYR . 1.8 t -61.85 -22.99 65.98 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.5 1.125 . . . . 63.009999999999998 110.004 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.632 HD12 ' CE1' ' A' ' 151' ' ' PHE . 2.4 mm? -87.93 -26.35 22.74 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.52 1.137 . . . . 52.210000000000001 109.274 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' MET . . . . . 0.509 ' O ' ' CG2' ' A' ' 161' ' ' VAL . 25.2 mmt -66.23 -22.25 66.33 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.563 1.164 . . . . 74.230000000000004 111.041 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' ASN . . . . . 0.454 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 9.9 m-20 -93.88 -17.79 22.66 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.486 1.116 . . . . 73.129999999999995 109.294 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.478 ' HB2' ' CG2' ' A' ' 170' ' ' VAL . 69.4 p -81.2 -34.6 32.17 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.485 1.116 . . . . 71.310000000000002 110.028 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . 0.638 ' O ' HD13 ' A' ' 192' ' ' ILE . 1.5 m -51.07 -21.51 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.601 1.188 . . . . 54.240000000000002 109.267 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . 0.415 ' O ' ' C ' ' A' ' 163' ' ' ARG . 75.1 m-20 -90.09 25.75 2.06 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.538 1.149 . . . . 64.010000000000005 109.297 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 160' ' ' SER . 0.1 OUTLIER 37.91 34.22 0.06 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.478 1.111 . . . . 74.340000000000003 110.313 -179.948 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . 0.454 ' NE2' ' O ' ' A' ' 159' ' ' ASN . 9.4 mt-30 -38.7 126.88 1.52 Allowed 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.495 1.122 . . . . 65.409999999999997 110.339 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 39.5 m-70 -72.03 68.52 0.69 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.56 1.163 . . . . 70.349999999999994 109.654 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.452 ' O ' ' NE2' ' A' ' 218' ' ' GLN . 0.1 OUTLIER -122.54 -174.39 2.9 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.486 1.116 . . . . 72.310000000000002 109.281 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' TYR . . . . . 0.749 ' CE1' ' CD1' ' A' ' 222' ' ' TRP . 8.2 t80 -45.56 -39.6 7.72 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.428 1.08 . . . . 74.010000000000005 110.992 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -128.17 149.02 50.62 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.569 1.168 . . . . 75.400000000000006 109.273 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.426 ' CB ' ' O ' ' A' ' 133' ' ' ALA . 1.5 t -126.56 168.38 14.36 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.502 1.126 . . . . 65.219999999999999 110.034 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.478 ' CG2' ' HB2' ' A' ' 160' ' ' SER . 2.0 t -129.52 117.06 41.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 O-C-N 124.557 1.161 . . . . 73.310000000000002 109.285 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.563 HG22 ' HB2' ' A' ' 195' ' ' LEU . 17.1 mm -124.25 99.91 36.53 Favored Pre-proline 0 C--N 1.326 -0.441 0 O-C-N 124.446 1.091 . . . . 60.439999999999998 109.287 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.877 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.95 106.95 2.37 Favored 'Trans proline' 0 C--N 1.361 1.199 0 O-C-N 124.446 1.761 . . . . 70.140000000000001 111.017 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . 0.529 ' HE1' ' HB2' ' A' ' 197' ' ' GLU . 3.5 ttt -87.77 152.44 22.12 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.442 1.088 . . . . 75.519999999999996 111.017 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . 0.428 ' N ' ' HG2' ' A' ' 173' ' ' MET . 60.0 mtp180 -106.43 123.9 37.39 Favored Pre-proline 0 C--N 1.325 -0.499 0 O-C-N 124.495 1.122 . . . . 74.450000000000003 110.293 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 175' ' ' PRO . . . . . 0.673 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.3 Cg_endo -74.94 155.0 43.19 Favored 'Trans proline' 0 C--N 1.36 1.175 0 O-C-N 124.528 1.804 . . . . 72.219999999999999 110.974 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.975 HD21 ' HG2' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -96.0 -38.0 10.41 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.487 1.117 . . . . 72.530000000000001 109.304 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -72.9 -23.92 60.77 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.438 1.086 . . . . 71.040000000000006 109.336 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -110.38 110.24 58.12 Favored Pre-proline 0 C--N 1.325 -0.491 0 O-C-N 124.518 1.137 . . . . 65.349999999999994 109.313 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.93 115.5 4.31 Favored 'Trans proline' 0 C--N 1.359 1.094 0 O-C-N 124.525 1.802 . . . . 74.120000000000005 111.031 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.5 ' CD1' ' OG1' ' A' ' 185' ' ' THR . 0.7 OUTLIER -118.11 96.98 50.41 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.535 1.147 . . . . 71.549999999999997 109.331 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -75.02 169.38 22.76 Favored 'Trans proline' 0 C--N 1.36 1.173 0 O-C-N 124.479 1.778 . . . . 63.049999999999997 110.996 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 12.3 ptt180 -70.55 -16.06 62.84 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.49 1.119 . . . . 63.32 110.374 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -78.74 -2.41 39.28 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.556 1.16 . . . . 64.329999999999998 110.318 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -128.4 8.04 5.93 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.473 1.108 . . . . 70.319999999999993 110.289 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 185' ' ' THR . . . . . 0.5 ' OG1' ' CD1' ' A' ' 180' ' ' LEU . 19.6 m -110.03 143.69 28.49 Favored Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 124.585 1.178 . . . . 74.510000000000005 110.371 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . 0.709 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -74.95 155.87 43.18 Favored 'Trans proline' 0 C--N 1.36 1.146 0 O-C-N 124.545 1.813 . . . . 64.439999999999998 110.983 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 187' ' ' PHE . . . . . 0.503 ' O ' ' CG2' ' A' ' 191' ' ' THR . 28.9 p90 -69.34 -7.38 36.78 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.488 1.118 . . . . 71.310000000000002 111.008 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -93.76 -53.17 4.13 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.449 1.093 . . . . 64.430000000000007 109.29 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.76 HD22 ' HG3' ' A' ' 172' ' ' PRO . 61.1 mt -68.27 -42.33 79.75 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.484 1.115 . . . . 53.32 109.328 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 190' ' ' GLN . . . . . 0.413 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.3 pt20 -63.77 -11.04 23.15 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.563 1.164 . . . . 65.030000000000001 110.279 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 191' ' ' THR . . . . . 0.503 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 34.4 p -113.0 -3.9 13.97 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.518 1.136 . . . . 71.230000000000004 110.411 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.638 HD13 ' O ' ' A' ' 161' ' ' VAL . 7.9 mt -93.18 157.07 3.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 O-C-N 124.406 1.066 . . . . 64.439999999999998 109.301 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 193' ' ' ASN . . . . . 0.447 ' ND2' ' O ' ' A' ' 193' ' ' ASN . 25.4 t30 -76.97 56.95 1.27 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.417 1.073 . . . . 54.32 109.31 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . 0.877 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -50.99 163.18 0.21 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.58 1.175 . . . . 63.539999999999999 109.364 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 195' ' ' LEU . . . . . 0.638 HD23 ' CD1' ' A' ' 209' ' ' ILE . 0.2 OUTLIER -86.65 127.87 34.96 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 74.420000000000002 109.29 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -108.35 128.84 55.11 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.543 1.152 . . . . 62.299999999999997 110.345 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.975 ' HG2' HD21 ' A' ' 176' ' ' LEU . 5.6 tp10 -109.74 -22.09 12.08 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.482 1.114 . . . . 74.25 110.322 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . 0.537 ' HB3' HD12 ' A' ' 176' ' ' LEU . 2.2 pt-20 -94.82 19.12 10.59 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.495 1.122 . . . . 60.329999999999998 110.279 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -127.59 146.81 50.41 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.51 1.131 . . . . 61.310000000000002 110.001 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 12.6 tpp85 -63.18 -12.16 26.04 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.467 1.104 . . . . 72.439999999999998 110.298 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -93.76 16.43 60.82 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.545 1.153 . . . . 60.310000000000002 111.007 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 202' ' ' PHE . . . . . 0.802 ' O ' HG23 ' A' ' 206' ' ' VAL . 5.3 t80 -67.83 -38.35 14.37 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.533 0.784 . . . . 74.230000000000004 110.986 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 203' ' ' PRO . . . . . 0.701 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.5 Cg_endo -74.98 -30.13 7.52 Favored 'Trans proline' 0 C--N 1.361 1.187 0 O-C-N 124.5 1.789 . . . . 62.350000000000001 111.073 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -64.08 -65.46 0.68 Allowed 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.521 1.138 . . . . 61.030000000000001 110.392 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -51.1 -42.28 60.55 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.423 1.077 . . . . 74.319999999999993 110.244 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 206' ' ' VAL . . . . . 0.802 HG23 ' O ' ' A' ' 202' ' ' PHE . 55.2 t -58.85 -28.41 37.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.487 1.117 . . . . 65.109999999999999 109.331 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -82.88 -47.6 11.66 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.521 1.138 . . . . 64.299999999999997 110.27 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . 0.442 ' N ' ' HD2' ' A' ' 208' ' ' ARG . 1.9 mpt_? -64.25 -64.01 0.99 Allowed 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.459 1.099 . . . . 71.439999999999998 110.278 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 209' ' ' ILE . . . . . 0.71 HG22 ' CD1' ' A' ' 210' ' ' PHE . 54.2 mt -48.35 -53.01 6.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.515 1.135 . . . . 63.439999999999998 109.297 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 210' ' ' PHE . . . . . 0.71 ' CD1' HG22 ' A' ' 209' ' ' ILE . 0.8 OUTLIER -101.84 66.15 1.03 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.526 1.142 . . . . 75.25 111.016 179.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 211' ' ' GLN . . . . . 0.443 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.1 OUTLIER -110.92 146.37 36.69 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.504 1.128 . . . . 75.420000000000002 110.271 179.974 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.452 ' O ' ' N ' ' A' ' 215' ' ' TYR . 63.9 tt0 -48.86 -55.62 11.13 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.503 1.127 . . . . 51.119999999999997 110.275 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -48.24 -24.03 1.06 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.522 1.138 . . . . 73.430000000000007 110.011 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.443 HG23 ' HG2' ' A' ' 211' ' ' GLN . 22.6 t -95.86 -29.02 3.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.493 1.121 . . . . 71.430000000000007 109.281 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 215' ' ' TYR . . . . . 0.477 ' OH ' ' CE2' ' A' ' 78' ' ' PHE . 12.3 t80 -65.1 -20.26 66.39 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 124.535 1.147 . . . . 72.409999999999997 110.922 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . 0.46 ' O ' ' CB ' ' A' ' 220' ' ' THR . 5.9 mmpt? -69.23 -57.3 5.52 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.57 1.169 . . . . 62.43 109.372 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 217' ' ' THR . . . . . . . . . . . . . 1.2 m -47.87 -53.66 15.03 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.505 1.128 . . . . 73.349999999999994 110.41 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 218' ' ' GLN . . . . . 0.452 ' NE2' ' O ' ' A' ' 166' ' ' LYS . 94.5 mm-40 -55.78 -66.94 0.34 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.455 1.097 . . . . 73.150000000000006 110.325 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 219' ' ' GLN . . . . . 0.456 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 40.2 tp60 -54.57 -18.79 4.83 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.547 1.154 . . . . 71.450000000000003 110.304 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 220' ' ' THR . . . . . 0.46 ' CB ' ' O ' ' A' ' 216' ' ' LYS . 2.9 m -83.27 -28.41 29.16 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.565 1.165 . . . . 34.240000000000002 110.399 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 221' ' ' ILE . . . . . 0.442 HG22 ' HB2' ' A' ' 167' ' ' TYR . 14.0 mt -83.81 -17.66 10.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.453 1.096 . . . . 73.209999999999994 109.263 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 222' ' ' TRP . . . . . 0.8 ' O ' HG22 ' A' ' 225' ' ' THR . 7.9 t90 -89.09 -59.63 2.17 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.957 -1.127 . . . . 72.140000000000001 107.957 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.14 -20.45 6.7 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 124.496 1.123 . . . . 73.420000000000002 109.327 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -86.59 -30.3 21.94 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.48 1.113 . . . . 74.129999999999995 110.286 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.8 HG22 ' O ' ' A' ' 222' ' ' TRP . 4.6 t -72.94 -22.8 60.66 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.497 1.123 . . . . 72.129999999999995 110.381 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 10.9 mtm180 -75.56 -14.4 60.39 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.502 1.127 . . . . 71.239999999999995 110.327 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 227' ' ' ASN . . . . . 0.442 ' O ' ' N ' ' A' ' 231' ' ' ARG . 1.0 OUTLIER -85.12 -59.23 2.39 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.478 1.111 . . . . 71.450000000000003 109.238 -179.967 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 20.8 ptp -44.87 -40.52 6.32 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.481 1.113 . . . . 54.140000000000001 111.01 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 229' ' ' VAL . . . . . 0.443 ' CG1' ' N ' ' A' ' 230' ' ' GLN . 0.5 OUTLIER -68.38 -45.55 82.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.467 1.104 . . . . 73.439999999999998 109.314 179.999 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 230' ' ' GLN . . . . . 0.443 ' N ' ' CG1' ' A' ' 229' ' ' VAL . 0.1 OUTLIER -88.87 18.36 4.87 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.478 1.111 . . . . 74.010000000000005 110.292 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 231' ' ' ARG . . . . . 0.442 ' N ' ' O ' ' A' ' 227' ' ' ASN . 14.6 ttt85 -114.91 -50.16 2.78 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 124.59 1.181 . . . . 73.219999999999999 110.34 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 41.6 tt0 -176.05 39.19 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.434 1.084 . . . . 71.310000000000002 110.238 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 233' ' ' PHE . . . . . 0.401 ' O ' ' O ' ' A' ' 229' ' ' VAL . 0.4 OUTLIER -152.13 179.02 8.86 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.466 1.104 . . . . 75.409999999999997 111.014 -179.998 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.473 HD13 ' HA ' ' A' ' 234' ' ' ILE . 23.4 mm -143.63 146.19 21.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.52 1.137 . . . . 65.209999999999994 109.294 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 235' ' ' ALA . . . . . 0.756 ' HB1' HD12 ' A' ' 72' ' ' LEU . . . . . . . . 0 C--N 1.325 -0.483 0 O-C-N 124.488 1.118 . . . . 74.25 109.298 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.038 0 N-CA-C 110.982 -0.847 . . . . 52.030000000000001 110.982 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -74.93 141.45 26.88 Favored 'Trans proline' 0 C--N 1.36 1.147 0 O-C-N 124.54 1.81 . . . . 63.439999999999998 111.079 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.571 ' O ' HD13 ' A' ' 72' ' ' LEU . 0.3 OUTLIER -57.0 -44.33 82.65 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.512 1.133 . . . . 60.219999999999999 109.299 -179.986 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -168.98 112.74 0.49 Allowed Glycine 0 CA--C 1.53 0.985 0 O-C-N 124.5 1.125 . . . . 52.109999999999999 111.023 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -150.14 164.39 35.74 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.517 0.774 . . . . 70.200000000000003 110.039 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.43 ' CG ' ' N ' ' A' ' 76' ' ' GLU . 27.6 tt0 -60.71 156.69 16.29 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.489 1.118 . . . . 71.129999999999995 110.325 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.43 ' N ' ' CG ' ' A' ' 75' ' ' GLU . 0.5 OUTLIER -121.62 149.82 42.62 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.532 1.145 . . . . 71.340000000000003 110.336 179.977 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.554 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 5.9 p -161.23 163.87 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.526 1.142 . . . . 73.239999999999995 109.272 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.479 ' N ' HG22 ' A' ' 77' ' ' VAL . 1.5 t80 -87.36 20.92 2.62 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.486 1.116 . . . . 74.209999999999994 110.985 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.469 ' HB2' HG13 ' A' ' 77' ' ' VAL . 6.5 tp -41.2 160.9 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.445 1.091 . . . . 63.340000000000003 109.341 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.616 ' O ' ' HB3' ' A' ' 133' ' ' ALA . 6.5 ptmt -111.08 -49.58 3.01 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 124.499 1.125 . . . . 75.209999999999994 109.308 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.925 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.2 OUTLIER -165.62 136.69 3.82 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.571 1.169 . . . . 74.010000000000005 111.04 -179.955 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.539 HG22 ' N ' ' A' ' 83' ' ' ILE . 8.0 p -91.09 169.25 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.509 1.131 . . . . 71.299999999999997 109.293 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.925 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 4.7 mp -133.04 96.97 2.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.478 1.111 . . . . 74.239999999999995 109.319 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.843 HD11 ' HB3' ' A' ' 128' ' ' ALA . 8.0 mt -69.59 124.15 23.19 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.468 1.105 . . . . 73.140000000000001 109.348 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.797 ' NE2' HD12 ' A' ' 111' ' ' ILE . 2.8 p80 -146.06 174.72 11.04 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.447 1.092 . . . . 74.049999999999997 109.658 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.467 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -131.8 164.65 25.56 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.442 1.089 . . . . 64.340000000000003 109.336 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -55.62 -17.29 5.33 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.47 1.106 . . . . 72.340000000000003 110.268 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -76.47 -46.53 26.46 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.529 1.143 . . . . 41.439999999999998 109.313 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.442 ' OD2' ' ND2' ' A' ' 178' ' ' ASN . 21.8 m-20 -125.35 45.14 2.64 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.492 1.12 . . . . 60.020000000000003 109.318 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.619 ' HG1' ' CE1' ' A' ' 85' ' ' HIS . 0.9 OUTLIER -75.05 -37.59 61.65 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.466 1.104 . . . . 72.329999999999998 110.378 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.82 -19.99 43.45 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.467 1.104 . . . . 54.439999999999998 109.295 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.42 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -75.46 -59.97 2.51 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.436 1.085 . . . . 74.099999999999994 110.24 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.753 ' HB2' ' CD2' ' A' ' 138' ' ' LEU . . . -60.56 -23.17 64.42 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.581 1.176 . . . . 64.209999999999994 109.287 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.848 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -85.8 -41.42 15.07 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.498 1.123 . . . . 73.549999999999997 109.279 -179.992 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -53.19 -34.78 58.42 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.496 1.122 . . . . 74.420000000000002 110.347 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.589 HG13 ' N ' ' A' ' 97' ' ' GLN . 9.5 p -83.19 -56.08 6.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.49 1.119 . . . . 74.239999999999995 109.308 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.593 ' HA ' HD12 ' A' ' 100' ' ' LEU . 0.1 OUTLIER -47.67 -23.27 0.65 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.466 1.104 . . . . 62.399999999999999 110.273 -179.955 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -77.24 -43.33 33.91 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.472 1.108 . . . . 40.219999999999999 109.308 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.72 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -75.53 -22.28 57.22 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.519 1.137 . . . . 72.340000000000003 109.321 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.72 ' N ' HD23 ' A' ' 99' ' ' LEU . 73.4 mt -65.02 -49.67 69.25 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.483 1.114 . . . . 64.120000000000005 109.326 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -78.7 53.24 1.31 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.527 1.142 . . . . 71.230000000000004 110.321 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -176.91 -66.56 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.526 1.141 . . . . 74.329999999999998 109.336 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -41.54 -48.53 3.96 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.579 1.175 . . . . 74.310000000000002 109.276 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -115.8 -29.96 6.25 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.512 1.132 . . . . 75.409999999999997 110.993 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 106.61 35.92 2.73 Favored Glycine 0 CA--C 1.53 0.972 0 O-C-N 124.474 1.109 . . . . 73.439999999999998 111.011 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.56 HG22 ' HD3' ' A' ' 80' ' ' LYS . 23.5 mm -75.84 87.77 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.539 0.788 . . . . 74.219999999999999 109.3 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.514 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -137.75 158.32 71.87 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.529 1.143 . . . . 71.400000000000006 109.292 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.514 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.4 Cg_endo -74.94 158.25 99.1 Favored 'Cis proline' 0 C--N 1.36 1.177 0 C-N-CA 121.023 -2.49 . . . . 70.219999999999999 111.038 -0.071 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -114.97 134.25 11.52 Favored Glycine 0 CA--C 1.53 1.005 0 O-C-N 124.524 1.14 . . . . 54.25 111.02 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -154.09 128.26 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.531 0.783 . . . . 42.0 109.277 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.797 HD12 ' NE2' ' A' ' 85' ' ' HIS . 44.6 pt -89.68 -171.63 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 124.469 1.105 . . . . 72.409999999999997 109.26 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.557 ' CZ ' ' HB2' ' A' ' 122' ' ' LEU . 2.3 t80 -81.33 -40.01 24.26 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.522 1.139 . . . . 74.109999999999999 111.037 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.5 ' HB2' ' HE1' ' A' ' 85' ' ' HIS . . . -73.97 -4.45 35.27 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.539 1.15 . . . . 72.010000000000005 109.261 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -106.69 -26.57 11.27 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.515 1.135 . . . . 73.420000000000002 110.298 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 31.9 tpp -44.48 110.88 1.1 Allowed Pre-proline 0 C--N 1.326 -0.443 0 O-C-N 124.386 1.054 . . . . 65.519999999999996 110.996 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.9 90.97 1.03 Allowed 'Trans proline' 0 C--N 1.359 1.118 0 O-C-N 124.515 1.797 . . . . 64.109999999999999 111.043 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 3.1 p-80 -115.95 -173.07 2.28 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.554 1.159 . . . . 54.350000000000001 109.594 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -109.64 -128.2 5.53 Favored Glycine 0 CA--C 1.529 0.949 0 O-C-N 124.483 1.114 . . . . 51.299999999999997 111.017 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.4 ' O ' ' C ' ' A' ' 120' ' ' GLN . 4.3 mmm180 -52.48 -69.04 0.12 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.516 0.774 . . . . 75.230000000000004 110.318 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.4 ' C ' ' O ' ' A' ' 119' ' ' ARG . 44.6 mt-30 -39.05 136.31 0.82 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.407 1.067 . . . . 72.409999999999997 110.302 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . 0.48 ' CD2' ' HB2' ' A' ' 123' ' ' GLN . 1.3 p-80 -111.71 42.7 1.67 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.521 1.138 . . . . 62.43 109.571 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.845 ' H ' HD23 ' A' ' 122' ' ' LEU . 0.7 OUTLIER 39.85 53.85 2.59 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.538 1.149 . . . . 74.239999999999995 109.302 179.968 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.48 ' HB2' ' CD2' ' A' ' 121' ' ' HIS . 43.7 tt0 -62.17 -24.55 67.25 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.567 1.167 . . . . 64.329999999999998 110.267 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 30.9 m-80 -118.32 128.09 54.33 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.484 1.115 . . . . 70.120000000000005 109.289 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.865 HD21 HD21 ' A' ' 150' ' ' ASN . 0.1 OUTLIER -56.76 -18.58 13.13 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.466 1.104 . . . . 61.210000000000001 109.336 179.927 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.446 ' H ' HD12 ' A' ' 125' ' ' LEU . 7.7 p-10 -46.54 -25.96 0.79 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.55 1.156 . . . . 73.519999999999996 109.307 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.408 ' N ' ' C ' ' A' ' 125' ' ' LEU . 2.1 t70 -65.27 -55.46 18.27 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.506 1.129 . . . . 73.010000000000005 109.27 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.843 ' HB3' HD11 ' A' ' 84' ' ' LEU . . . -61.02 -15.24 29.74 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.479 1.112 . . . . 61.329999999999998 109.313 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.677 HG21 ' CD2' ' A' ' 157' ' ' LEU . 89.9 t -86.6 10.53 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.496 1.123 . . . . 70.140000000000001 109.258 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 14.5 t30 -127.61 158.97 36.08 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.494 1.121 . . . . 44.25 109.311 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 42.67 55.43 4.64 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 124.489 1.118 . . . . 65.230000000000004 111.028 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -162.53 165.54 25.94 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.532 0.784 . . . . 54.119999999999997 110.036 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.616 ' HB3' ' O ' ' A' ' 80' ' ' LYS . . . -110.08 -25.49 10.19 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.493 1.121 . . . . 74.129999999999995 109.355 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.598 ' CD1' ' O ' ' A' ' 133' ' ' ALA . 4.0 m-90 -158.45 150.61 21.66 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.477 1.111 . . . . 72.230000000000004 108.062 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.845 HG23 ' O ' ' A' ' 169' ' ' SER . 7.0 p -125.94 154.8 42.32 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.529 1.143 . . . . 75.150000000000006 110.411 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.663 ' HB ' HG23 ' A' ' 83' ' ' ILE . 15.7 mm -105.42 91.65 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.461 1.1 . . . . 65.549999999999997 109.263 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.405 ' CB ' ' HA ' ' A' ' 172' ' ' PRO . 0.6 OUTLIER -73.59 87.08 1.63 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.534 1.146 . . . . 70.439999999999998 109.3 179.959 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.753 ' CD2' ' HB2' ' A' ' 93' ' ' ALA . 1.4 tp -62.1 96.2 0.07 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.495 1.122 . . . . 71.140000000000001 109.324 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.504 HD11 HD13 ' A' ' 189' ' ' LEU . 0.1 OUTLIER -71.98 121.46 19.16 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.496 1.122 . . . . 74.430000000000007 109.303 -179.984 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.719 HG22 ' H ' ' A' ' 141' ' ' GLU . 7.0 m -137.9 -173.64 3.56 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.49 1.119 . . . . 63.43 110.394 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.719 ' H ' HG22 ' A' ' 140' ' ' THR . 4.0 mt-10 -84.93 -40.62 16.77 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.473 1.108 . . . . 72.230000000000004 110.317 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . 0.409 ' ND2' ' N ' ' A' ' 143' ' ' PHE . 3.8 p-10 -89.67 -49.67 6.52 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.506 1.129 . . . . 60.140000000000001 109.32 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.749 ' O ' HG23 ' A' ' 147' ' ' THR . 43.1 t80 -50.39 -28.04 7.42 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.473 1.108 . . . . 64.530000000000001 111.008 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.444 HD13 ' C ' ' A' ' 144' ' ' LEU . 3.0 tm? -63.68 -67.85 0.39 Allowed 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.488 1.118 . . . . 62.149999999999999 109.263 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -48.59 -28.75 3.65 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.535 1.147 . . . . 75.239999999999995 110.389 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . 0.541 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 5.3 m-20 -71.48 -71.63 0.26 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.491 1.119 . . . . 71.519999999999996 109.35 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.749 HG23 ' O ' ' A' ' 143' ' ' PHE . 65.7 p -49.08 -55.87 10.83 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.49 1.119 . . . . 72.430000000000007 110.404 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.561 ' CZ2' ' HB3' ' A' ' 186' ' ' PRO . 0.0 OUTLIER -46.39 -31.77 2.82 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.545 1.153 . . . . 74.120000000000005 108.009 -179.963 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . 0.541 ' CB ' ' O ' ' A' ' 146' ' ' ASP . 1.8 t -57.86 -46.21 85.17 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.546 1.154 . . . . 52.049999999999997 108.288 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.865 HD21 HD21 ' A' ' 125' ' ' LEU . 0.8 OUTLIER -67.05 -41.6 86.22 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.525 1.14 . . . . 73.409999999999997 109.288 -179.996 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.879 ' CZ ' HD12 ' A' ' 157' ' ' LEU . 13.1 m-85 -55.34 -21.75 16.43 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.61 1.194 . . . . 75.430000000000007 111.064 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -85.49 -33.01 21.93 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.549 1.156 . . . . 72.519999999999996 110.366 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.525 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 2.5 t80 -110.25 21.19 17.02 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.513 1.133 . . . . 63.43 111.035 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.452 ' N ' ' O ' ' A' ' 150' ' ' ASN . 2.3 t80 -163.75 106.0 0.95 Allowed 'General case' 0 C--N 1.324 -0.541 0 O-C-N 124.52 1.137 . . . . 74.340000000000003 111.011 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 6.3 t -85.92 -10.75 54.72 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.478 1.111 . . . . 72.540000000000006 110.456 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 3.1 t -62.55 -23.11 66.82 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.536 1.148 . . . . 75.120000000000005 110.007 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.879 HD12 ' CZ ' ' A' ' 151' ' ' PHE . 0.2 OUTLIER -77.11 -37.86 53.33 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.526 1.141 . . . . 65.319999999999993 109.302 -179.993 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' MET . . . . . 0.47 ' CE ' ' HA ' ' A' ' 158' ' ' MET . 17.0 mmt -57.0 -35.83 69.67 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.439 1.087 . . . . 70.420000000000002 111.0 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' ASN . . . . . 0.448 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 33.9 m-80 -71.23 -38.01 72.0 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.527 1.142 . . . . 52.340000000000003 109.342 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.633 ' OG ' HG11 ' A' ' 170' ' ' VAL . 1.3 p -67.19 -35.34 79.43 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.496 1.122 . . . . 71.319999999999993 109.995 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . 0.882 ' O ' HD13 ' A' ' 192' ' ' ILE . 64.7 t -58.56 -22.92 21.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.474 1.108 . . . . 73.540000000000006 109.302 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 68.9 m-20 -83.18 -22.71 33.16 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.459 1.1 . . . . 75.129999999999995 109.306 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 54.47 35.16 22.63 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.571 1.169 . . . . 74.409999999999997 110.271 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . 0.448 ' NE2' ' O ' ' A' ' 159' ' ' ASN . 0.8 OUTLIER -52.56 -173.5 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.488 1.117 . . . . 72.340000000000003 110.316 179.944 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 12.2 p-80 -73.21 66.79 0.9 Allowed 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.49 1.119 . . . . 73.239999999999995 109.622 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.32 160.39 26.8 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.485 1.116 . . . . 75.150000000000006 109.308 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' TYR . . . . . 0.74 ' HB3' HG22 ' A' ' 221' ' ' ILE . 4.6 p90 -70.0 -6.12 31.13 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.456 1.098 . . . . 72.239999999999995 110.89 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.516 ' ND2' ' CZ ' ' A' ' 167' ' ' TYR . 0.3 OUTLIER -122.81 137.44 54.93 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 124.493 1.12 . . . . 54.399999999999999 109.31 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.845 ' O ' HG23 ' A' ' 135' ' ' THR . 0.7 OUTLIER -143.01 150.79 40.09 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.552 1.158 . . . . 45.409999999999997 110.024 179.997 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.633 HG11 ' OG ' ' A' ' 160' ' ' SER . 1.0 OUTLIER -126.18 150.5 31.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.474 1.109 . . . . 70.310000000000002 109.287 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.643 HG22 ' HB2' ' A' ' 195' ' ' LEU . 12.1 mm -139.65 112.51 7.71 Favored Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 124.532 1.145 . . . . 75.409999999999997 109.27 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.813 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -75.0 106.9 2.37 Favored 'Trans proline' 0 C--N 1.36 1.183 0 O-C-N 124.548 1.815 . . . . 70.299999999999997 111.034 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . 0.575 ' CE ' HD12 ' A' ' 195' ' ' LEU . 3.9 ttt -96.39 154.0 17.51 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.501 1.126 . . . . 70.129999999999995 110.974 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . 0.442 ' N ' ' HG2' ' A' ' 173' ' ' MET . 57.8 mtm180 -110.66 121.53 40.86 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.476 1.11 . . . . 54.020000000000003 110.319 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 175' ' ' PRO . . . . . 0.473 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.2 Cg_endo -74.97 151.66 39.96 Favored 'Trans proline' 0 C--N 1.36 1.148 0 O-C-N 124.458 1.767 . . . . 72.299999999999997 111.037 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.913 HD21 ' HG3' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -85.15 -43.54 13.75 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.458 1.099 . . . . 72.010000000000005 109.318 -179.996 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -71.82 -28.34 63.52 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.496 1.123 . . . . 53.25 109.28 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 178' ' ' ASN . . . . . 0.67 ' OD1' HG23 ' A' ' 140' ' ' THR . 2.6 m-80 -110.44 99.63 41.57 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.547 1.155 . . . . 73.120000000000005 109.242 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.98 115.09 4.18 Favored 'Trans proline' 0 C--N 1.359 1.122 0 O-C-N 124.512 1.796 . . . . 73.400000000000006 110.99 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.608 HD13 ' HB2' ' A' ' 184' ' ' ARG . 0.6 OUTLIER -122.81 96.91 44.71 Favored Pre-proline 0 C--N 1.324 -0.518 0 O-C-N 124.528 1.143 . . . . 74.519999999999996 109.325 179.964 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 181' ' ' PRO . . . . . 0.444 ' HG2' ' CG ' ' A' ' 183' ' ' GLU . 18.4 Cg_endo -74.99 169.13 23.31 Favored 'Trans proline' 0 C--N 1.36 1.159 0 O-C-N 124.502 1.79 . . . . 62.039999999999999 111.013 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . 0.428 ' CG ' ' N ' ' A' ' 183' ' ' GLU . 23.1 ptt180 -53.1 -39.34 63.32 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.518 1.136 . . . . 63.130000000000003 110.3 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . 0.444 ' CG ' ' HG2' ' A' ' 181' ' ' PRO . 5.4 pt-20 -52.01 -36.09 48.9 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.439 1.087 . . . . 73.299999999999997 110.375 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 184' ' ' ARG . . . . . 0.608 ' HB2' HD13 ' A' ' 180' ' ' LEU . 35.3 mmt180 -89.58 -18.43 26.58 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.427 1.079 . . . . 75.109999999999999 110.278 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 185' ' ' THR . . . . . 0.493 HG22 ' HD2' ' A' ' 186' ' ' PRO . 20.7 m -82.2 143.91 49.61 Favored Pre-proline 0 C--N 1.324 -0.519 0 O-C-N 124.494 1.121 . . . . 60.210000000000001 110.361 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . 0.751 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -74.96 155.15 43.12 Favored 'Trans proline' 0 C--N 1.36 1.134 0 O-C-N 124.5 1.79 . . . . 70.409999999999997 111.022 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 187' ' ' PHE . . . . . 0.505 ' O ' ' CG2' ' A' ' 191' ' ' THR . 23.3 p90 -68.93 -7.09 31.76 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.582 1.176 . . . . 73.140000000000001 111.006 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . 0.567 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -93.92 -53.11 4.12 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.592 1.182 . . . . 62.32 109.283 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.751 HD12 ' CG ' ' A' ' 186' ' ' PRO . 51.7 mt -68.54 -42.36 78.55 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.542 1.151 . . . . 73.209999999999994 109.326 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 190' ' ' GLN . . . . . 0.41 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.2 pt20 -63.62 -11.36 24.46 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.518 1.136 . . . . 72.340000000000003 110.316 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 191' ' ' THR . . . . . 0.505 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 29.1 p -111.81 19.55 17.87 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.48 1.113 . . . . 55.310000000000002 110.396 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.882 HD13 ' O ' ' A' ' 161' ' ' VAL . 5.3 mt -138.21 139.33 42.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 O-C-N 124.5 1.125 . . . . 73.140000000000001 109.306 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 193' ' ' ASN . . . . . 0.505 ' ND2' HD11 ' A' ' 209' ' ' ILE . 12.5 t30 -47.26 97.06 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.525 1.141 . . . . 73.099999999999994 109.315 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . 0.813 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -88.83 141.29 28.62 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.52 1.137 . . . . 45.119999999999997 109.31 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 195' ' ' LEU . . . . . 0.643 ' HB2' HG22 ' A' ' 171' ' ' ILE . 0.2 OUTLIER -61.47 136.09 57.91 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.51 1.131 . . . . 71.200000000000003 109.297 179.991 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -116.54 129.7 56.33 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.459 1.1 . . . . 63.450000000000003 110.349 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.913 ' HG3' HD21 ' A' ' 176' ' ' LEU . 41.6 tp10 -113.16 -29.12 7.4 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.493 1.12 . . . . 71.099999999999994 110.335 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.1 21.24 6.01 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.521 1.138 . . . . 55.32 110.317 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 1.2 t -128.63 145.4 51.16 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.555 1.16 . . . . 62.219999999999999 109.997 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.17 -14.05 44.28 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.475 1.11 . . . . 73.219999999999999 110.258 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -92.82 16.22 60.82 Favored Glycine 0 CA--C 1.531 1.04 0 O-C-N 124.542 1.151 . . . . 51.32 111.004 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 202' ' ' PHE . . . . . 0.81 ' O ' HG23 ' A' ' 206' ' ' VAL . 0.5 OUTLIER -61.15 -41.67 81.97 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.447 0.733 . . . . 74.019999999999996 110.997 -179.996 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 203' ' ' PRO . . . . . 0.642 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.05 -34.71 3.57 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.445 1.76 . . . . 52.100000000000001 111.013 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.09 -55.43 31.12 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.495 1.122 . . . . 61.0 110.407 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -65.51 -40.05 92.55 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.495 1.122 . . . . 73.310000000000002 110.34 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 206' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 202' ' ' PHE . 72.9 t -64.45 -28.83 45.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 124.544 1.153 . . . . 73.120000000000005 109.239 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -83.07 -38.74 22.1 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.5 1.125 . . . . 72.430000000000007 110.305 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 79.3 mtt-85 -74.05 -65.49 0.83 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.545 1.153 . . . . 75.530000000000001 110.354 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 209' ' ' ILE . . . . . 0.645 HG22 ' CD1' ' A' ' 210' ' ' PHE . 90.8 mt -46.26 -50.03 5.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 O-C-N 124.447 1.092 . . . . 71.230000000000004 109.358 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 210' ' ' PHE . . . . . 0.645 ' CD1' HG22 ' A' ' 209' ' ' ILE . 0.9 OUTLIER -100.98 71.82 1.44 Allowed 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.483 1.114 . . . . 72.140000000000001 111.006 179.943 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 211' ' ' GLN . . . . . 0.477 ' CG ' ' HB ' ' A' ' 214' ' ' VAL . 11.1 pt20 -110.9 138.64 47.05 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.49 1.119 . . . . 73.310000000000002 110.261 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.422 ' C ' ' N ' ' A' ' 214' ' ' VAL . 6.8 tt0 -51.49 -50.97 58.87 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.484 1.115 . . . . 63.049999999999997 110.339 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 1.4 t -47.26 -21.55 0.29 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.554 1.159 . . . . 74.0 110.009 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.477 ' HB ' ' CG ' ' A' ' 211' ' ' GLN . 2.0 t -96.95 -43.07 12.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.544 1.153 . . . . 63.119999999999997 109.269 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 215' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -46.0 -40.05 9.95 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.526 1.141 . . . . 64.109999999999999 111.026 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -54.13 -66.31 0.42 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.491 1.119 . . . . 72.310000000000002 109.249 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 217' ' ' THR . . . . . 0.548 HG22 HD11 ' A' ' 221' ' ' ILE . 2.0 m -46.1 -66.54 0.39 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.51 1.131 . . . . 73.120000000000005 110.367 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 218' ' ' GLN . . . . . 0.89 ' HA ' HD12 ' A' ' 221' ' ' ILE . 18.5 mm-40 -39.55 -64.47 0.47 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.561 1.163 . . . . 74.439999999999998 110.284 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 219' ' ' GLN . . . . . 0.416 ' NE2' ' HB2' ' A' ' 223' ' ' LYS . 25.6 tp60 -44.14 -52.42 7.3 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.501 1.126 . . . . 64.030000000000001 110.304 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 220' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.83 -33.03 47.47 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.549 1.156 . . . . 55.340000000000003 110.42 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 221' ' ' ILE . . . . . 0.89 HD12 ' HA ' ' A' ' 218' ' ' GLN . 12.5 mt -74.67 -48.32 34.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.519 1.137 . . . . 71.129999999999995 109.299 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 222' ' ' TRP . . . . . 0.581 ' O ' HG22 ' A' ' 225' ' ' THR . 78.3 t90 -67.32 -17.96 64.98 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.032 -1.099 . . . . 73.010000000000005 108.032 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.416 ' HB2' ' NE2' ' A' ' 219' ' ' GLN . 0.0 OUTLIER -84.63 -49.42 8.56 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.453 1.096 . . . . 61.549999999999997 109.284 -179.994 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -64.06 -35.97 82.47 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.487 1.117 . . . . 75.530000000000001 110.372 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.581 HG22 ' O ' ' A' ' 222' ' ' TRP . 2.3 t -54.62 -30.4 54.69 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.547 1.155 . . . . 75.230000000000004 110.409 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -81.78 -19.05 42.08 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.526 1.142 . . . . 74.230000000000004 110.347 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 227' ' ' ASN . . . . . 0.401 ' O ' ' CG ' ' A' ' 231' ' ' ARG . 1.0 OUTLIER -84.65 -42.53 15.26 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.46 1.1 . . . . 72.040000000000006 109.305 179.928 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 56.0 mtm -59.55 -41.0 89.08 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 124.576 1.172 . . . . 74.120000000000005 110.99 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 229' ' ' VAL . . . . . 0.509 HG13 ' N ' ' A' ' 230' ' ' GLN . 11.3 p -67.69 -51.36 51.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.507 1.129 . . . . 74.329999999999998 109.315 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 230' ' ' GLN . . . . . 0.509 ' N ' HG13 ' A' ' 229' ' ' VAL . 2.5 tp60 -71.04 -7.99 50.26 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.503 1.127 . . . . 74.409999999999997 110.275 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 231' ' ' ARG . . . . . 0.401 ' CG ' ' O ' ' A' ' 227' ' ' ASN . 9.0 mmm180 -88.66 -88.58 0.15 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.485 1.116 . . . . 75.310000000000002 110.255 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -135.61 47.15 2.3 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.469 1.106 . . . . 74.010000000000005 110.342 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -158.15 37.59 0.25 Allowed 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.519 1.137 . . . . 74.129999999999995 110.949 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 5.0 mm -45.48 139.38 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.495 1.122 . . . . 73.420000000000002 109.275 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 235' ' ' ALA . . . . . 0.412 ' HB1' ' O ' ' A' ' 72' ' ' LEU . . . . . . . . 0 C--N 1.326 -0.446 0 O-C-N 124.413 1.071 . . . . 54.149999999999999 109.216 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.978 0 N-CA-C 111.057 -0.817 . . . . 61.100000000000001 111.057 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.469 ' CG ' ' HB3' ' A' ' 74' ' ' SER . 18.1 Cg_endo -74.95 167.43 27.08 Favored 'Trans proline' 0 C--N 1.36 1.156 0 O-C-N 124.475 1.776 . . . . 72.239999999999995 111.037 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.08 -64.73 0.88 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.53 1.144 . . . . 64.219999999999999 109.309 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -126.19 53.75 0.78 Allowed Glycine 0 CA--C 1.529 0.949 0 O-C-N 124.438 1.086 . . . . 33.43 111.029 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.469 ' HB3' ' CG ' ' A' ' 71' ' ' PRO . 0.2 OUTLIER -135.78 174.37 10.69 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.448 0.734 . . . . 65.209999999999994 109.964 -179.922 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -118.07 148.56 42.16 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.553 1.158 . . . . 72.349999999999994 110.294 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -125.92 135.19 51.61 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.544 1.152 . . . . 73.439999999999998 110.262 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.595 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 2.7 p -142.98 158.02 17.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 O-C-N 124.439 1.087 . . . . 75.310000000000002 109.291 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.407 ' CE2' ' HG3' ' A' ' 108' ' ' PRO . 51.3 p90 -89.61 31.33 0.94 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.481 1.113 . . . . 73.409999999999997 111.035 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.488 HD11 HG22 ' A' ' 110' ' ' ILE . 9.3 tp -40.23 139.1 0.77 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.506 1.129 . . . . 71.400000000000006 109.338 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.657 ' HZ1' HD12 ' A' ' 106' ' ' ILE . 2.4 mtpt -76.54 -63.43 1.34 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.492 1.12 . . . . 64.109999999999999 109.29 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.975 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.8 OUTLIER -160.81 127.9 4.21 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.562 1.164 . . . . 71.319999999999993 110.918 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.657 ' CG1' HG22 ' A' ' 135' ' ' THR . 12.3 p -84.55 169.59 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.549 1.155 . . . . 55.340000000000003 109.281 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.975 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 1.7 mp -129.65 94.41 2.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.514 1.134 . . . . 74.120000000000005 109.246 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.831 HD11 ' HB3' ' A' ' 128' ' ' ALA . 3.0 mt -71.71 93.64 1.29 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.473 1.108 . . . . 70.439999999999998 109.299 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.695 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -115.05 174.51 5.94 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.487 1.117 . . . . 74.409999999999997 109.602 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -100.68 164.09 12.03 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.564 1.165 . . . . 54.299999999999997 109.316 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.47 ' CG ' ' O ' ' A' ' 87' ' ' GLU . 13.4 tt0 -71.23 -5.6 33.28 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.496 1.123 . . . . 71.319999999999993 110.3 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -91.06 -45.46 8.68 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.466 1.103 . . . . 63.32 109.296 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.722 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -114.7 44.23 1.79 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.48 1.113 . . . . 63.520000000000003 109.31 179.954 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.607 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -76.91 -34.69 57.7 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.515 1.134 . . . . 61.229999999999997 110.396 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -75.52 -19.54 59.29 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.493 1.121 . . . . 72.340000000000003 109.33 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -78.53 -57.07 3.96 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.444 1.09 . . . . 71.120000000000005 110.336 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.775 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -63.13 -16.46 60.11 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 73.140000000000001 109.3 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.715 HD13 ' N ' ' A' ' 95' ' ' ARG . 0.1 OUTLIER -89.51 -53.75 4.39 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.486 1.116 . . . . 74.230000000000004 109.345 179.976 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.715 ' N ' HD13 ' A' ' 94' ' ' LEU . 20.3 tpp180 -44.1 -29.62 0.64 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.5 1.125 . . . . 72.140000000000001 110.306 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.594 HG13 ' N ' ' A' ' 97' ' ' GLN . 10.6 p -86.13 -56.23 5.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 O-C-N 124.403 1.064 . . . . 71.010000000000005 109.286 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.67 HE21 HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -47.44 -23.74 0.67 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.454 1.096 . . . . 71.349999999999994 110.309 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.75 -39.19 57.58 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.515 1.135 . . . . 74.230000000000004 109.318 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.751 ' C ' HD23 ' A' ' 99' ' ' LEU . 0.0 OUTLIER -83.73 -19.52 35.03 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.505 1.128 . . . . 72.109999999999999 109.344 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.907 HD22 HG11 ' A' ' 206' ' ' VAL . 87.7 mt -79.33 -20.17 48.52 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.477 1.111 . . . . 51.509999999999998 109.234 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.512 ' O ' ' CD ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -89.47 -11.98 41.45 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.475 1.109 . . . . 64.510000000000005 110.247 -179.96 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.468 ' O ' ' C ' ' A' ' 103' ' ' ASP . 29.2 t70 -116.07 -57.21 2.24 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.434 1.084 . . . . 73.150000000000006 109.342 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.542 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 7.2 t0 -34.41 -65.68 0.19 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.516 1.135 . . . . 70.129999999999995 109.347 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.455 ' HE1' HD23 ' A' ' 100' ' ' LEU . 4.3 m-85 -102.63 -31.88 10.16 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 124.475 1.109 . . . . 64.439999999999998 111.02 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.473 ' O ' ' N ' ' A' ' 107' ' ' LYS . . . 108.57 28.47 4.55 Favored Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.488 1.118 . . . . 62.119999999999997 110.987 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.657 HD12 ' HZ1' ' A' ' 80' ' ' LYS . 24.1 mm -65.29 73.89 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.479 0.752 . . . . 70.299999999999997 109.325 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.539 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.8 OUTLIER -127.45 156.34 75.26 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.504 1.127 . . . . 73.420000000000002 109.295 -179.936 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.1 Cg_endo -75.05 132.14 26.57 Favored 'Cis proline' 0 C--N 1.361 1.192 0 C-N-CA 120.98 -2.508 . . . . 74.409999999999997 110.991 0.091 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.434 ' N ' ' HA ' ' A' ' 107' ' ' LYS . . . -107.02 117.19 5.23 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.444 1.09 . . . . 74.230000000000004 110.959 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.488 HG22 HD11 ' A' ' 79' ' ' LEU . 1.0 OUTLIER -131.38 150.3 34.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 O-C-N 124.484 0.756 . . . . 71.319999999999993 109.307 179.957 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.695 HD12 ' NE2' ' A' ' 85' ' ' HIS . 45.3 pt -99.2 -175.56 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.499 1.125 . . . . 72.109999999999999 109.322 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.839 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 0.4 OUTLIER -81.82 -18.7 43.08 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.542 1.151 . . . . 71.319999999999993 111.059 179.994 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.87 -3.61 51.51 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.481 1.113 . . . . 74.129999999999995 109.266 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.422 ' CB ' HG12 ' A' ' 110' ' ' ILE . 3.6 mt-10 -106.82 -24.85 11.93 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.532 1.145 . . . . 63.210000000000001 110.321 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.422 ' HG2' ' CE1' ' A' ' 117' ' ' HIS . 15.0 ttm -55.9 110.97 2.64 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.509 1.13 . . . . 71.439999999999998 110.993 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.08 124.5 8.62 Favored 'Trans proline' 0 C--N 1.361 1.188 0 O-C-N 124.497 1.788 . . . . 64.239999999999995 110.935 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.422 ' CE1' ' HG2' ' A' ' 115' ' ' MET . 30.4 m80 -124.74 176.83 6.33 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.546 1.154 . . . . 75.25 109.685 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -104.74 -157.47 23.43 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.557 1.161 . . . . 45.310000000000002 111.054 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 -38.88 -57.46 1.23 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.498 0.763 . . . . 74.129999999999995 110.258 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -45.33 158.58 0.07 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.466 1.104 . . . . 62.210000000000001 110.295 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -93.15 175.99 6.57 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.465 1.103 . . . . 75.140000000000001 109.689 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.508 ' H ' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -107.64 27.01 9.59 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 124.516 1.135 . . . . 73.409999999999997 109.309 -179.983 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -63.69 -16.94 62.36 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.521 1.138 . . . . 73.219999999999999 110.332 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -78.72 113.19 16.57 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.439 1.087 . . . . 71.040000000000006 109.291 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.788 HD12 ' N ' ' A' ' 126' ' ' ASP . 0.9 OUTLIER -82.31 -17.29 46.31 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.44 1.088 . . . . 64.109999999999999 109.26 -179.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.788 ' N ' HD12 ' A' ' 125' ' ' LEU . 7.4 p-10 -78.85 -14.55 59.18 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.486 1.116 . . . . 73.230000000000004 109.322 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -58.15 -52.59 64.91 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.51 1.131 . . . . 54.0 109.309 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.839 ' HB2' ' CE1' ' A' ' 112' ' ' PHE . . . -67.4 -14.52 63.0 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.48 1.112 . . . . 44.149999999999999 109.304 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.647 HG12 ' O ' ' A' ' 129' ' ' VAL . 52.0 t -87.46 11.67 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.539 1.149 . . . . 61.399999999999999 109.25 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -141.09 124.51 16.67 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.556 1.16 . . . . 63.299999999999997 109.288 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 90.84 41.57 5.29 Favored Glycine 0 CA--C 1.53 0.987 0 O-C-N 124.608 1.193 . . . . 74.010000000000005 111.003 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.77 166.23 24.5 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.491 0.759 . . . . 51.439999999999998 110.021 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.77 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -87.58 -56.46 3.34 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.464 1.102 . . . . 73.209999999999994 109.296 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.77 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 1.8 m-90 -131.21 177.23 7.62 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.973 -1.121 . . . . 71.140000000000001 107.973 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.657 HG22 ' CG1' ' A' ' 82' ' ' VAL . 25.9 p -152.4 132.62 13.58 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.462 1.101 . . . . 62.130000000000003 110.454 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.647 ' O ' HD22 ' A' ' 137' ' ' LEU . 1.3 mp -84.32 140.78 15.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.464 1.102 . . . . 75.129999999999995 109.274 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.647 HD22 ' O ' ' A' ' 136' ' ' ILE . 2.8 mm? -126.73 96.71 4.74 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.609 1.193 . . . . 44.219999999999999 109.283 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.775 HD21 ' HB2' ' A' ' 93' ' ' ALA . 0.1 OUTLIER -62.65 97.85 0.11 Allowed 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.47 1.106 . . . . 74.150000000000006 109.302 179.988 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.609 HD21 HG23 ' A' ' 185' ' ' THR . 3.2 tp -66.84 103.72 1.19 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.577 1.173 . . . . 65.540000000000006 109.321 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.598 ' C ' HD23 ' A' ' 180' ' ' LEU . 2.7 m -121.39 177.85 5.03 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.482 1.114 . . . . 62.420000000000002 110.409 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.483 ' H ' HG22 ' A' ' 140' ' ' THR . 2.2 mp0 -83.83 -35.9 23.88 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.431 1.082 . . . . 75.519999999999996 110.298 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . 0.44 ' OD1' ' N ' ' A' ' 143' ' ' PHE . 15.3 p30 -85.79 -41.92 14.64 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.47 1.106 . . . . 74.340000000000003 109.286 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.52 ' CE1' HG21 ' A' ' 147' ' ' THR . 61.3 t80 -63.67 -21.39 66.36 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.462 1.102 . . . . 70.010000000000005 110.974 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.699 ' C ' HD13 ' A' ' 144' ' ' LEU . 2.0 tm? -63.88 -67.52 0.42 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.504 1.127 . . . . 65.420000000000002 109.337 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 52.6 mmm-85 -56.71 -17.41 8.84 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.558 1.161 . . . . 72.150000000000006 110.292 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.19 -66.5 0.72 Allowed 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.482 1.113 . . . . 74.129999999999995 109.296 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.562 ' HB ' ' CZ ' ' A' ' 151' ' ' PHE . 2.5 p -68.29 -53.94 20.93 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.494 1.121 . . . . 73.099999999999994 110.376 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 3.6 t-105 -43.31 -41.99 4.28 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.482 1.114 . . . . 64.329999999999998 108.025 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . 0.453 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 41.7 t -71.94 -45.43 61.13 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.53 1.144 . . . . 72.329999999999998 108.244 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.434 ' HB3' HD21 ' A' ' 125' ' ' LEU . 27.9 m120 -52.42 -30.83 31.4 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.427 1.079 . . . . 64.329999999999998 109.299 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 1.09 ' CE1' HD12 ' A' ' 157' ' ' LEU . 7.7 m-30 -73.14 -36.11 66.62 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.546 1.153 . . . . 74.099999999999994 110.969 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -65.05 -29.95 70.88 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.519 1.137 . . . . 61.439999999999998 110.317 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -93.64 -32.05 14.23 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.452 1.095 . . . . 73.200000000000003 111.029 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.42 ' CD2' ' HB3' ' A' ' 156' ' ' SER . 1.6 t80 -132.76 97.92 4.18 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.537 1.148 . . . . 75.25 111.037 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 2.9 t -65.64 -10.99 40.86 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.468 1.105 . . . . 73.530000000000001 110.409 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . 0.42 ' HB3' ' CD2' ' A' ' 154' ' ' TYR . 3.4 t -52.02 -36.01 48.67 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 124.46 1.1 . . . . 74.439999999999998 110.042 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 1.09 HD12 ' CE1' ' A' ' 151' ' ' PHE . 1.7 tm? -87.66 -28.92 21.54 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.467 1.105 . . . . 70.5 109.21 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' MET . . . . . 0.769 ' HE2' HG21 ' A' ' 161' ' ' VAL . 1.6 tpt -62.85 -16.52 58.93 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.498 1.124 . . . . 74.530000000000001 110.992 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -90.63 -10.8 41.96 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.546 1.154 . . . . 74.430000000000007 109.311 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.641 ' CB ' HG21 ' A' ' 170' ' ' VAL . 0.7 OUTLIER -81.46 -38.57 26.18 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.529 1.143 . . . . 74.129999999999995 110.008 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . 0.769 HG21 ' HE2' ' A' ' 158' ' ' MET . 4.1 m -59.85 -18.28 15.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.485 1.116 . . . . 71.019999999999996 109.317 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . 0.526 ' N ' HD22 ' A' ' 162' ' ' ASN . 1.0 OUTLIER -63.91 -13.16 43.28 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.521 1.138 . . . . 70.030000000000001 109.258 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.64 ' HG3' HG23 ' A' ' 192' ' ' ILE . 4.8 mmm180 63.02 39.79 9.81 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.467 1.104 . . . . 54.520000000000003 110.344 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -52.51 -174.1 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.553 1.158 . . . . 72.540000000000006 110.333 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -127.34 50.7 1.97 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.49 1.119 . . . . 74.040000000000006 109.618 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.424 ' HA ' HG21 ' A' ' 221' ' ' ILE . 0.7 OUTLIER -98.43 -174.37 2.8 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.55 1.156 . . . . 70.019999999999996 109.344 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' TYR . . . . . 0.603 ' CD1' ' N ' ' A' ' 168' ' ' ASN . 26.4 p90 -54.81 -42.68 72.15 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.543 1.152 . . . . 70.299999999999997 111.024 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.603 ' N ' ' CD1' ' A' ' 167' ' ' TYR . 1.2 p-10 -98.05 134.94 40.44 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.411 1.07 . . . . 73.450000000000003 109.272 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.445 ' N ' ' O ' ' A' ' 133' ' ' ALA . 16.1 m -123.55 146.76 47.87 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.459 1.099 . . . . 63.130000000000003 109.968 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.641 HG21 ' CB ' ' A' ' 160' ' ' SER . 43.5 t -103.33 137.94 29.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 O-C-N 124.44 1.088 . . . . 61.140000000000001 109.314 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.612 HD13 ' O ' ' A' ' 170' ' ' VAL . 15.9 mm -141.86 104.99 5.76 Favored Pre-proline 0 C--N 1.325 -0.463 0 O-C-N 124.542 1.151 . . . . 53.43 109.283 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.755 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.3 Cg_endo -74.96 106.2 2.23 Favored 'Trans proline' 0 C--N 1.36 1.167 0 O-C-N 124.478 1.778 . . . . 72.329999999999998 111.015 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . 0.477 ' HE3' HD12 ' A' ' 195' ' ' LEU . 4.4 ttt -94.06 154.27 17.71 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.437 1.086 . . . . 62.039999999999999 111.034 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . 0.442 ' N ' ' HG2' ' A' ' 173' ' ' MET . 0.5 OUTLIER -113.66 116.46 45.68 Favored Pre-proline 0 C--N 1.325 -0.475 0 O-C-N 124.533 1.145 . . . . 73.420000000000002 110.265 -179.952 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 175' ' ' PRO . . . . . 0.572 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.4 Cg_endo -74.98 153.65 42.0 Favored 'Trans proline' 0 C--N 1.359 1.129 0 O-C-N 124.476 1.777 . . . . 64.019999999999996 110.948 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.837 ' N ' HD13 ' A' ' 176' ' ' LEU . 0.0 OUTLIER -91.25 -39.32 12.15 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.508 1.13 . . . . 72.430000000000007 109.293 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -72.61 -23.38 60.93 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.509 1.13 . . . . 65.140000000000001 109.258 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 178' ' ' ASN . . . . . 0.491 ' OD1' HG23 ' A' ' 140' ' ' THR . 1.1 m-80 -110.75 108.21 57.95 Favored Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.493 1.121 . . . . 73.319999999999993 109.339 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.96 125.23 9.21 Favored 'Trans proline' 0 C--N 1.36 1.134 0 O-C-N 124.511 1.795 . . . . 63.329999999999998 110.971 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.598 HD23 ' C ' ' A' ' 140' ' ' THR . 1.2 tm? -140.68 97.02 7.41 Favored Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.455 1.097 . . . . 72.430000000000007 109.327 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.02 153.77 41.94 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.567 1.825 . . . . 51.340000000000003 111.004 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.44 -29.06 61.19 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.577 1.173 . . . . 74.030000000000001 110.323 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -58.71 -31.62 68.42 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.555 1.159 . . . . 73.049999999999997 110.306 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 184' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 -99.41 13.24 33.95 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.463 1.102 . . . . 64.25 110.298 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 185' ' ' THR . . . . . 0.609 HG23 HD21 ' A' ' 139' ' ' LEU . 46.5 m -106.53 144.13 28.39 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.537 1.148 . . . . 70.040000000000006 110.384 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . 0.683 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -75.04 146.04 32.04 Favored 'Trans proline' 0 C--N 1.361 1.192 0 O-C-N 124.527 1.804 . . . . 74.230000000000004 111.012 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 187' ' ' PHE . . . . . 0.433 ' O ' HG23 ' A' ' 191' ' ' THR . 14.0 p90 -62.4 -11.94 18.64 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.475 1.109 . . . . 72.409999999999997 110.994 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . 0.474 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -87.2 -53.79 4.66 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.586 1.179 . . . . 64.349999999999994 109.23 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.683 HD12 ' CG ' ' A' ' 186' ' ' PRO . 22.4 mt -74.19 -17.67 60.87 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 124.496 1.123 . . . . 73.329999999999998 109.267 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 190' ' ' GLN . . . . . 0.48 ' CG ' ' O ' ' A' ' 190' ' ' GLN . 6.8 tt0 -86.41 0.69 53.54 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.443 1.089 . . . . 60.350000000000001 110.331 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 191' ' ' THR . . . . . 0.433 HG23 ' O ' ' A' ' 187' ' ' PHE . 34.1 p -127.87 16.18 6.86 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.488 1.117 . . . . 71.409999999999997 110.383 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.64 HG23 ' HG3' ' A' ' 163' ' ' ARG . 19.1 mt -117.08 152.12 18.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.481 1.113 . . . . 64.010000000000005 109.335 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 21.9 t30 -61.73 97.86 0.08 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.478 1.111 . . . . 73.310000000000002 109.343 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . 0.755 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -89.39 164.85 14.7 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.465 1.103 . . . . 45.329999999999998 109.28 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 195' ' ' LEU . . . . . 0.756 HD23 HD12 ' A' ' 209' ' ' ILE . 0.3 OUTLIER -103.09 126.4 50.25 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.429 1.081 . . . . 63.530000000000001 109.368 179.952 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -103.54 128.98 50.67 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.503 1.127 . . . . 73.239999999999995 110.289 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.754 ' HG2' HD21 ' A' ' 176' ' ' LEU . 4.2 tt0 -106.75 -30.48 8.92 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.499 1.124 . . . . 63.509999999999998 110.256 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . 0.613 ' HG2' HD12 ' A' ' 176' ' ' LEU . 4.0 pt-20 -92.51 25.24 3.1 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.511 1.132 . . . . 73.209999999999994 110.342 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.24 151.28 51.64 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.561 1.163 . . . . 63.409999999999997 109.987 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 9.9 tpt85 -67.62 -11.88 59.19 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.461 1.101 . . . . 72.219999999999999 110.312 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -93.62 15.37 63.2 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.503 1.127 . . . . 73.109999999999999 110.966 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 202' ' ' PHE . . . . . 0.791 ' CZ ' HD21 ' A' ' 100' ' ' LEU . 8.5 t80 -66.29 -38.84 23.27 Favored Pre-proline 0 C--N 1.325 -0.463 0 O-C-N 124.443 0.731 . . . . 64.400000000000006 111.046 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 203' ' ' PRO . . . . . 0.683 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -74.95 -42.04 0.58 Allowed 'Trans proline' 0 C--N 1.36 1.162 0 O-C-N 124.556 1.819 . . . . 74.140000000000001 110.944 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -48.38 -63.13 1.16 Allowed 'General case' 0 C--N 1.324 -0.536 0 O-C-N 124.529 1.143 . . . . 74.400000000000006 110.406 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 205' ' ' GLN . . . . . 0.448 ' O ' ' N ' ' A' ' 209' ' ' ILE . 7.7 mt-30 -55.46 -55.48 31.22 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.468 1.105 . . . . 64.040000000000006 110.312 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 206' ' ' VAL . . . . . 0.907 HG11 HD22 ' A' ' 100' ' ' LEU . 75.4 t -47.24 -31.07 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.541 1.151 . . . . 70.129999999999995 109.256 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -81.15 -39.05 26.15 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.515 1.134 . . . . 51.119999999999997 110.266 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -77.03 -66.64 0.8 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.475 1.11 . . . . 72.319999999999993 110.34 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 209' ' ' ILE . . . . . 0.756 HD12 HD23 ' A' ' 195' ' ' LEU . 92.9 mt -44.53 -47.23 2.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.487 1.117 . . . . 74.329999999999998 109.301 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 210' ' ' PHE . . . . . 0.713 ' CD1' HG22 ' A' ' 209' ' ' ILE . 0.7 OUTLIER -107.66 66.87 0.67 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.466 1.104 . . . . 75.439999999999998 110.985 179.99 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 211' ' ' GLN . . . . . 0.541 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.4 OUTLIER -110.8 146.3 36.64 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.547 1.154 . . . . 65.349999999999994 110.318 179.953 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.441 ' O ' ' N ' ' A' ' 215' ' ' TYR . 29.6 tt0 -48.85 -55.18 12.4 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.552 1.157 . . . . 52.229999999999997 110.351 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.04 -24.6 1.63 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.449 1.093 . . . . 52.340000000000003 109.995 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.541 HG23 ' HG2' ' A' ' 211' ' ' GLN . 40.3 t -96.22 -26.45 4.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.585 1.178 . . . . 75.310000000000002 109.29 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 215' ' ' TYR . . . . . 0.441 ' N ' ' O ' ' A' ' 212' ' ' GLU . 4.2 t80 -67.46 -34.18 76.66 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.549 1.155 . . . . 73.340000000000003 111.021 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . 0.419 ' O ' ' CB ' ' A' ' 220' ' ' THR . 41.3 mmtt -54.32 -59.45 4.66 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.493 1.121 . . . . 74.319999999999993 109.255 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 217' ' ' THR . . . . . 0.868 HG22 HD11 ' A' ' 221' ' ' ILE . 7.6 m -52.78 -66.51 0.37 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.444 1.09 . . . . 73.549999999999997 110.406 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 218' ' ' GLN . . . . . 0.406 ' HA ' HD12 ' A' ' 221' ' ' ILE . 2.0 mp0 -39.74 -65.33 0.4 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.508 1.13 . . . . 73.319999999999993 110.271 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 219' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -55.51 -30.44 60.69 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.491 1.12 . . . . 65.329999999999998 110.249 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 220' ' ' THR . . . . . 0.432 ' N ' ' O ' ' A' ' 217' ' ' THR . 2.1 m -76.63 -20.59 56.54 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.49 1.119 . . . . 71.530000000000001 110.393 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 221' ' ' ILE . . . . . 0.868 HD11 HG22 ' A' ' 217' ' ' THR . 15.2 mt -90.15 -28.46 5.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.523 1.14 . . . . 61.299999999999997 109.317 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 222' ' ' TRP . . . . . 0.617 ' O ' HG22 ' A' ' 225' ' ' THR . 23.9 t90 -69.62 -29.22 66.66 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.514 1.134 . . . . 75.430000000000007 107.972 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.446 ' HG3' ' N ' ' A' ' 224' ' ' GLU . 0.5 OUTLIER -86.85 -27.91 23.2 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 124.473 1.108 . . . . 71.329999999999998 109.302 -179.976 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . 0.446 ' N ' ' HG3' ' A' ' 223' ' ' LYS . 1.6 mm-40 -80.86 -26.42 36.95 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.5 1.125 . . . . 54.539999999999999 110.273 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.738 ' O ' HG13 ' A' ' 229' ' ' VAL . 6.9 t -72.08 -21.9 61.44 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.488 1.117 . . . . 72.109999999999999 110.413 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 226' ' ' ARG . . . . . 0.42 ' CG ' ' O ' ' A' ' 222' ' ' TRP . 0.7 OUTLIER -80.58 -8.57 59.64 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.517 1.136 . . . . 74.230000000000004 110.261 179.994 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 227' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -91.97 -58.36 2.43 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.492 1.12 . . . . 73.409999999999997 109.273 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 1.4 ptp -52.72 -33.88 49.96 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.505 1.128 . . . . 62.149999999999999 111.04 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 229' ' ' VAL . . . . . 0.738 HG13 ' O ' ' A' ' 225' ' ' THR . 20.4 m -73.38 -53.2 18.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.487 1.117 . . . . 75.230000000000004 109.329 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 230' ' ' GLN . . . . . 0.541 ' N ' HG23 ' A' ' 229' ' ' VAL . 4.6 tp60 -63.74 -13.23 41.78 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.466 1.103 . . . . 72.010000000000005 110.292 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 6.6 mmt180 -90.19 -79.94 0.33 Allowed 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.547 1.154 . . . . 64.420000000000002 110.324 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -148.61 59.9 1.07 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.478 1.111 . . . . 72.25 110.353 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 233' ' ' PHE . . . . . 0.798 ' O ' HD13 ' A' ' 234' ' ' ILE . 0.7 OUTLIER -169.25 -177.93 3.02 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.522 1.138 . . . . 54.439999999999998 110.989 -179.975 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.798 HD13 ' O ' ' A' ' 233' ' ' PHE . 4.8 mm -137.24 140.54 42.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 124.473 1.108 . . . . 63.299999999999997 109.285 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 235' ' ' ALA . . . . . 0.53 ' HB2' HG11 ' A' ' 229' ' ' VAL . . . . . . . . 0 C--N 1.324 -0.514 0 O-C-N 124.495 1.122 . . . . 74.150000000000006 109.27 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.989 0 N-CA-C 110.978 -0.849 . . . . 62.109999999999999 110.978 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.99 142.05 27.4 Favored 'Trans proline' 0 C--N 1.36 1.165 0 O-C-N 124.451 1.764 . . . . 64.25 110.987 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.508 HD22 ' HA ' ' A' ' 72' ' ' LEU . 0.7 OUTLIER -82.56 125.86 31.63 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.456 1.097 . . . . 62.420000000000002 109.355 179.956 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 37.82 85.46 0.01 OUTLIER Glycine 0 CA--C 1.531 1.039 0 O-C-N 124.475 1.109 . . . . 64.319999999999993 111.001 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.45 10.42 15.24 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.543 0.79 . . . . 71.140000000000001 109.953 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -159.81 135.04 8.13 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.534 1.146 . . . . 72.099999999999994 110.282 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -121.58 129.63 52.99 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.531 1.145 . . . . 62.109999999999999 110.34 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.587 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 3.2 p -129.32 164.26 32.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 O-C-N 124.518 1.136 . . . . 73.409999999999997 109.249 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.482 ' CE2' ' OH ' ' A' ' 215' ' ' TYR . 13.7 t80 -88.71 25.41 1.75 Allowed 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.47 1.106 . . . . 72.019999999999996 111.019 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.676 HD11 HG22 ' A' ' 110' ' ' ILE . 4.7 tp -39.79 158.33 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.474 1.109 . . . . 75.0 109.298 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.633 ' NZ ' HG23 ' A' ' 106' ' ' ILE . 6.9 ttpt -104.97 -51.86 2.96 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.597 1.185 . . . . 70.349999999999994 109.261 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.621 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.4 OUTLIER -165.46 132.69 2.91 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.461 1.101 . . . . 75.109999999999999 111.039 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.533 HG22 ' N ' ' A' ' 83' ' ' ILE . 2.7 p -86.25 166.8 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.489 1.118 . . . . 71.319999999999993 109.324 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.766 HG23 ' HB ' ' A' ' 136' ' ' ILE . 5.0 mp -129.64 93.18 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.51 1.132 . . . . 71.519999999999996 109.27 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.913 HD11 ' HB3' ' A' ' 128' ' ' ALA . 5.0 mt -70.16 116.19 10.23 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.513 1.133 . . . . 73.5 109.396 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.596 ' CE1' ' OG1' ' A' ' 90' ' ' THR . 0.0 OUTLIER -134.15 174.36 10.59 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.492 1.12 . . . . 74.450000000000003 109.578 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.454 ' HB2' ' HD2' ' A' ' 143' ' ' PHE . . . -113.22 164.4 13.58 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.609 1.193 . . . . 75.129999999999995 109.263 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.451 ' CG ' ' O ' ' A' ' 87' ' ' GLU . 16.7 tt0 -68.41 -7.64 33.38 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.584 1.177 . . . . 72.549999999999997 110.318 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -89.54 -26.74 20.7 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.522 1.139 . . . . 73.219999999999999 109.286 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.502 ' O ' ' CD2' ' A' ' 138' ' ' LEU . 1.3 m-20 -142.56 44.25 1.62 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.526 1.142 . . . . 74.030000000000001 109.314 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.596 ' OG1' ' CE1' ' A' ' 85' ' ' HIS . 0.7 OUTLIER -76.82 -33.69 57.95 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 124.435 1.085 . . . . 73.040000000000006 110.385 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -73.89 -41.33 62.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.479 1.112 . . . . 54.439999999999998 109.31 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.405 ' C ' ' CD ' ' A' ' 92' ' ' GLU . 4.8 tp10 -58.65 -52.36 66.03 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.566 1.167 . . . . 73.409999999999997 110.355 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.953 ' HB2' ' CD2' ' A' ' 138' ' ' LEU . . . -59.25 -25.79 64.35 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.527 1.142 . . . . 73.129999999999995 109.296 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.952 HD22 ' O ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -82.26 -34.57 28.7 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.533 1.145 . . . . 71.209999999999994 109.321 179.919 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.614 ' N ' HD13 ' A' ' 94' ' ' LEU . 6.0 tpt180 -55.58 -29.6 59.34 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.486 1.116 . . . . 70.5 110.294 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.885 HG21 ' HE1' ' A' ' 173' ' ' MET . 1.7 t -83.1 -65.1 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.547 1.155 . . . . 51.329999999999998 109.33 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.73 ' HG2' HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -40.27 -27.69 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.47 1.106 . . . . 64.030000000000001 110.29 179.995 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.449 ' N ' ' C ' ' A' ' 96' ' ' VAL . 2.0 t-20 -70.53 -54.57 11.65 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.469 1.106 . . . . 72.239999999999995 109.253 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.846 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -67.74 -22.88 65.21 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.464 1.102 . . . . 64.329999999999998 109.334 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.846 ' N ' HD23 ' A' ' 99' ' ' LEU . 28.5 mt -61.43 -57.96 10.09 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.539 1.149 . . . . 73.140000000000001 109.305 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -75.27 59.97 1.06 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.489 1.118 . . . . 74.109999999999999 110.341 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.4 t70 177.99 -65.46 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.528 1.143 . . . . 73.409999999999997 109.298 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.565 ' OD1' ' CE1' ' A' ' 104' ' ' PHE . 9.2 t70 -47.24 -50.26 21.56 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.484 1.115 . . . . 73.120000000000005 109.312 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.566 ' CZ ' HG11 ' A' ' 206' ' ' VAL . 2.0 m-85 -114.55 -26.51 7.88 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.416 1.073 . . . . 64.239999999999995 111.069 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.47 45.92 2.65 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.523 1.139 . . . . 33.140000000000001 110.99 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.633 HG23 ' NZ ' ' A' ' 80' ' ' LYS . 4.9 mm -86.91 84.13 2.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.436 0.727 . . . . 72.239999999999995 109.379 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.538 ' HA ' ' C ' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -132.71 156.7 79.79 Favored Pre-proline 0 C--N 1.325 -0.476 0 O-C-N 124.444 1.09 . . . . 74.040000000000006 109.271 179.999 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.538 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.3 Cg_endo -74.95 152.45 98.23 Favored 'Cis proline' 0 C--N 1.36 1.152 0 C-N-CA 120.948 -2.522 . . . . 70.329999999999998 111.006 -0.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.82 138.34 10.23 Favored Glycine 0 CA--C 1.529 0.921 0 O-C-N 124.531 1.145 . . . . 73.439999999999998 111.038 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.676 HG22 HD11 ' A' ' 79' ' ' LEU . 1.8 tt -156.01 150.54 10.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.415 0.715 . . . . 73.129999999999995 109.338 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.923 HD13 ' HB2' ' A' ' 94' ' ' LEU . 9.8 pt -101.35 168.7 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 124.525 1.141 . . . . 64.319999999999993 109.293 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.505 ' HE1' ' HB2' ' A' ' 128' ' ' ALA . 1.8 t80 -67.18 -19.8 65.63 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.513 1.133 . . . . 74.439999999999998 111.073 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.626 ' HB3' HD12 ' A' ' 111' ' ' ILE . . . -87.2 -14.29 41.54 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.519 1.137 . . . . 64.129999999999995 109.292 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -102.85 -19.11 14.79 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.446 1.091 . . . . 71.040000000000006 110.287 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.461 ' CG ' ' HD2' ' A' ' 116' ' ' PRO . 6.5 ttm -46.56 144.05 3.67 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.512 1.132 . . . . 54.409999999999997 111.042 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.461 ' HD2' ' CG ' ' A' ' 115' ' ' MET . 18.4 Cg_endo -74.94 67.95 5.79 Favored 'Trans proline' 0 C--N 1.359 1.119 0 O-C-N 124.462 1.77 . . . . 62.039999999999999 111.0 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 9.3 t-80 -147.69 139.71 24.2 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.53 1.144 . . . . 75.239999999999995 109.566 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.54 162.29 33.83 Favored Glycine 0 CA--C 1.531 1.049 0 O-C-N 124.379 1.049 . . . . 53.340000000000003 111.0 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -107.0 45.13 1.0 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.631 0.842 . . . . 73.129999999999995 110.284 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -82.29 -53.71 5.82 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.469 1.106 . . . . 74.129999999999995 110.327 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . 0.463 ' O ' ' CG ' ' A' ' 121' ' ' HIS . 8.1 p-80 -157.11 114.14 3.06 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.472 1.108 . . . . 74.109999999999999 109.533 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.436 HD12 ' H ' ' A' ' 122' ' ' LEU . 6.8 mp -56.69 152.25 12.54 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.496 1.122 . . . . 63.020000000000003 109.256 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -123.18 -174.05 2.86 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.509 1.13 . . . . 72.25 110.301 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -42.96 141.75 1.06 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.542 1.151 . . . . 74.120000000000005 109.27 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.773 HD11 ' CD2' ' A' ' 157' ' ' LEU . 0.6 OUTLIER -84.78 -17.46 38.16 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.551 1.157 . . . . 73.310000000000002 109.349 179.955 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.423 ' OD2' ' N ' ' A' ' 127' ' ' ASP . 6.9 p-10 -55.99 -21.57 21.92 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.46 1.1 . . . . 71.420000000000002 109.321 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.423 ' N ' ' OD2' ' A' ' 126' ' ' ASP . 1.0 OUTLIER -53.97 -52.89 59.28 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.455 1.097 . . . . 72.349999999999994 109.275 179.984 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.913 ' HB3' HD11 ' A' ' 84' ' ' LEU . . . -62.94 -26.77 68.98 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.438 1.086 . . . . 74.430000000000007 109.323 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.757 ' HA ' HG21 ' A' ' 135' ' ' THR . 3.0 t -78.26 -0.56 3.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.51 1.131 . . . . 71.430000000000007 109.263 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -126.27 126.02 43.3 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.535 1.147 . . . . 64.329999999999998 109.282 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 87.29 49.65 3.89 Favored Glycine 0 CA--C 1.53 0.978 0 O-C-N 124.489 1.118 . . . . 52.229999999999997 111.002 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . 0.403 ' O ' ' O ' ' A' ' 167' ' ' TYR . 0.3 OUTLIER -163.71 177.39 8.73 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.498 0.763 . . . . 70.209999999999994 109.988 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.81 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -104.42 -25.58 12.76 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.519 1.137 . . . . 71.209999999999994 109.268 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.81 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 4.1 m-90 -160.68 153.67 21.39 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.548 1.155 . . . . 70.140000000000001 107.995 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.757 HG21 ' HA ' ' A' ' 129' ' ' VAL . 2.0 p -123.03 128.13 49.74 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.484 1.115 . . . . 72.150000000000006 110.338 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.766 ' HB ' HG23 ' A' ' 83' ' ' ILE . 23.9 mm -84.19 134.2 27.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.528 1.143 . . . . 74.409999999999997 109.296 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.51 HD23 ' O ' ' A' ' 136' ' ' ILE . 20.0 mt -127.91 97.69 4.89 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 124.49 1.119 . . . . 75.439999999999998 109.307 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.953 ' CD2' ' HB2' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -62.33 99.3 0.13 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.465 1.103 . . . . 65.219999999999999 109.329 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.647 HD11 HD13 ' A' ' 189' ' ' LEU . 0.2 OUTLIER -70.76 105.05 3.06 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.405 1.066 . . . . 74.219999999999999 109.311 -179.977 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.691 HG22 ' H ' ' A' ' 141' ' ' GLU . 13.6 m -132.01 -177.58 4.51 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.498 1.124 . . . . 73.329999999999998 110.357 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.691 ' H ' HG22 ' A' ' 140' ' ' THR . 3.8 mp0 -81.67 -44.44 17.15 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.511 1.132 . . . . 75.129999999999995 110.323 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -82.87 -16.8 46.19 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.536 1.147 . . . . 51.439999999999998 109.327 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.454 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 16.2 t80 -90.06 -19.74 24.02 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.491 1.119 . . . . 71.439999999999998 110.978 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.7 ' C ' HD13 ' A' ' 144' ' ' LEU . 2.0 tm? -61.33 -67.87 0.37 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.537 1.148 . . . . 62.109999999999999 109.298 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.45 ' O ' ' CB ' ' A' ' 149' ' ' CYS . 10.9 mmt85 -62.87 -13.29 32.25 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.5 1.125 . . . . 72.209999999999994 110.253 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -68.84 -53.98 18.36 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.497 1.123 . . . . 71.140000000000001 109.252 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.471 ' HB ' ' CE1' ' A' ' 151' ' ' PHE . 2.7 p -88.66 -50.57 6.17 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.508 1.13 . . . . 65.109999999999999 110.348 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.62 ' CH2' ' CB ' ' A' ' 186' ' ' PRO . 3.4 t-105 -44.02 -32.39 1.15 Allowed 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.496 1.122 . . . . 73.439999999999998 108.004 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . 0.45 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 42.2 t -81.48 -45.48 15.93 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.535 1.147 . . . . 71.450000000000003 108.32 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.601 ' O ' ' CD2' ' A' ' 154' ' ' TYR . 50.5 m-20 -62.99 -14.17 44.41 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.559 1.162 . . . . 73.010000000000005 109.304 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.561 ' CZ ' ' HG ' ' A' ' 157' ' ' LEU . 3.6 m-30 -80.16 -57.21 3.73 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.461 1.1 . . . . 74.450000000000003 110.934 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -47.8 -32.39 5.99 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.466 1.104 . . . . 70.530000000000001 110.253 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.446 ' HB3' ' CD1' ' A' ' 154' ' ' TYR . 0.4 OUTLIER -83.97 -37.08 22.71 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.456 1.097 . . . . 71.340000000000003 110.994 179.973 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.601 ' CD2' ' O ' ' A' ' 150' ' ' ASN . 1.0 OUTLIER -119.16 70.78 0.84 Allowed 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.44 1.088 . . . . 75.019999999999996 111.022 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 11.7 t -43.85 -26.5 0.27 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.544 1.152 . . . . 74.140000000000001 110.4 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . 0.415 ' N ' ' C ' ' A' ' 154' ' ' TYR . 3.0 t -45.07 -44.42 10.27 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.507 1.129 . . . . 70.430000000000007 109.99 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.773 ' CD2' HD11 ' A' ' 125' ' ' LEU . 2.2 tp -69.04 -38.62 79.26 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.55 1.156 . . . . 61.329999999999998 109.31 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' MET . . . . . 0.593 ' O ' HG22 ' A' ' 161' ' ' VAL . 0.0 OUTLIER -62.57 -16.6 57.03 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.455 1.097 . . . . 74.409999999999997 110.991 -179.978 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' ASN . . . . . 0.46 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 82.6 m-20 -93.54 -9.66 37.48 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.425 1.078 . . . . 41.32 109.357 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.948 ' OG ' HG21 ' A' ' 170' ' ' VAL . 1.2 p -82.49 -24.11 34.34 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.5 1.125 . . . . 71.430000000000007 109.965 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . 0.798 ' O ' HD11 ' A' ' 192' ' ' ILE . 3.6 m -69.38 -15.7 19.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.497 1.123 . . . . 73.239999999999995 109.249 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . 0.45 ' CB ' ' OE1' ' A' ' 164' ' ' GLN . 4.6 m120 -65.87 -9.8 32.45 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.524 1.14 . . . . 75.519999999999996 109.326 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.476 ' HD3' HG23 ' A' ' 192' ' ' ILE . 5.3 mmm180 67.87 53.88 0.65 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.471 1.107 . . . . 74.450000000000003 110.313 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . 0.693 ' H ' ' NE2' ' A' ' 164' ' ' GLN . 1.8 mp0 -51.26 -176.55 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.503 1.127 . . . . 51.130000000000003 110.371 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -134.76 19.69 3.54 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.424 1.078 . . . . 74.109999999999999 109.603 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.411 ' HA ' HG21 ' A' ' 221' ' ' ILE . 0.0 OUTLIER -78.71 -155.94 0.09 Allowed 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.488 1.117 . . . . 64.400000000000006 109.274 -179.944 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' TYR . . . . . 0.53 ' CD2' ' OD1' ' A' ' 168' ' ' ASN . 55.3 p90 -88.86 37.41 0.84 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.527 1.142 . . . . 75.299999999999997 110.944 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.53 ' OD1' ' CD2' ' A' ' 167' ' ' TYR . 9.7 m120 -170.09 122.19 0.67 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.495 1.122 . . . . 73.310000000000002 109.333 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.522 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 2.9 m -114.84 173.84 6.27 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.508 1.13 . . . . 61.140000000000001 110.057 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.948 HG21 ' OG ' ' A' ' 160' ' ' SER . 51.1 t -128.53 119.94 51.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.516 1.135 . . . . 64.439999999999998 109.343 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.671 HD13 ' O ' ' A' ' 170' ' ' VAL . 35.2 mm -134.18 93.44 19.62 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 124.485 1.116 . . . . 63.25 109.271 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.818 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.07 107.93 2.6 Favored 'Trans proline' 0 C--N 1.361 1.209 0 O-C-N 124.468 1.773 . . . . 64.099999999999994 110.967 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . 0.885 ' HE1' HG21 ' A' ' 96' ' ' VAL . 5.0 ttt -80.66 160.09 25.13 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.534 1.146 . . . . 64.030000000000001 110.985 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . 0.417 ' N ' ' HG2' ' A' ' 173' ' ' MET . 69.4 mtt180 -116.68 128.44 26.01 Favored Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.513 1.133 . . . . 73.150000000000006 110.292 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 175' ' ' PRO . . . . . 0.646 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.4 Cg_endo -74.98 152.25 40.63 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.566 1.824 . . . . 74.239999999999995 111.013 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.822 ' N ' HD13 ' A' ' 176' ' ' LEU . 0.0 OUTLIER -93.93 -44.54 8.03 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.482 1.114 . . . . 74.409999999999997 109.34 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -72.78 -26.8 61.66 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.479 1.112 . . . . 74.219999999999999 109.361 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 178' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -107.12 103.45 48.06 Favored Pre-proline 0 C--N 1.325 -0.474 0 O-C-N 124.462 1.101 . . . . 74.230000000000004 109.311 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.98 121.33 6.52 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.468 1.772 . . . . 43.229999999999997 110.997 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.478 HD22 ' HA ' ' A' ' 180' ' ' LEU . 0.8 OUTLIER -131.22 98.68 18.39 Favored Pre-proline 0 C--N 1.325 -0.481 0 O-C-N 124.532 1.145 . . . . 52.43 109.35 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 181' ' ' PRO . . . . . 0.447 ' HG2' ' CG ' ' A' ' 183' ' ' GLU . 18.2 Cg_endo -75.01 163.41 35.36 Favored 'Trans proline' 0 C--N 1.359 1.129 0 O-C-N 124.46 1.769 . . . . 60.509999999999998 110.983 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.47 -33.95 66.43 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.528 1.142 . . . . 71.510000000000005 110.278 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . 0.447 ' CG ' ' HG2' ' A' ' 181' ' ' PRO . 2.5 pt-20 -50.0 -23.23 1.91 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.529 1.143 . . . . 73.5 110.306 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 184' ' ' ARG . . . . . 0.458 ' HD3' ' N ' ' A' ' 184' ' ' ARG . 1.9 mpt_? -105.22 -28.75 10.77 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.526 1.141 . . . . 74.239999999999995 110.309 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 185' ' ' THR . . . . . 0.573 HG23 ' CD2' ' A' ' 139' ' ' LEU . 17.7 m -71.2 143.84 88.92 Favored Pre-proline 0 C--N 1.325 -0.481 0 O-C-N 124.522 1.139 . . . . 60.210000000000001 110.44 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . 0.835 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.2 Cg_endo -75.03 155.88 42.83 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.446 1.761 . . . . 44.229999999999997 110.994 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 187' ' ' PHE . . . . . 0.512 ' O ' ' CG2' ' A' ' 191' ' ' THR . 36.3 p90 -69.79 -6.62 33.49 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.509 1.131 . . . . 45.32 111.038 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . 0.755 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -94.61 -53.09 4.02 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.592 1.182 . . . . 52.130000000000003 109.263 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.835 HD12 ' CG ' ' A' ' 186' ' ' PRO . 40.3 mt -68.49 -42.29 78.84 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.496 1.123 . . . . 70.109999999999999 109.278 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 190' ' ' GLN . . . . . 0.402 ' HG2' ' HA ' ' A' ' 187' ' ' PHE . 1.2 pt20 -64.38 -10.12 22.56 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.498 1.124 . . . . 73.340000000000003 110.321 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 191' ' ' THR . . . . . 0.512 ' CG2' ' O ' ' A' ' 187' ' ' PHE . 25.5 p -112.64 12.49 19.78 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.435 1.084 . . . . 71.349999999999994 110.44 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.798 HD11 ' O ' ' A' ' 161' ' ' VAL . 3.1 mt -115.92 154.11 17.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.491 1.12 . . . . 71.120000000000005 109.309 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -65.39 76.28 0.06 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.508 1.13 . . . . 72.439999999999998 109.303 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . 0.818 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -70.78 161.91 30.08 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.533 1.145 . . . . 64.439999999999998 109.336 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 195' ' ' LEU . . . . . 0.677 HD12 ' CE ' ' A' ' 173' ' ' MET . 0.2 OUTLIER -96.57 128.91 43.95 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.561 1.163 . . . . 72.109999999999999 109.271 -179.981 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . 0.433 ' CB ' ' HB2' ' A' ' 199' ' ' SER . 0.7 OUTLIER -118.28 136.71 53.53 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.449 1.093 . . . . 74.010000000000005 110.313 179.994 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.819 ' OE2' HD21 ' A' ' 176' ' ' LEU . 0.7 OUTLIER -103.22 -37.34 7.73 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.434 1.084 . . . . 75.420000000000002 110.308 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . 0.644 ' HG3' HD12 ' A' ' 176' ' ' LEU . 3.4 mt-10 -80.19 -15.2 57.56 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 124.48 1.112 . . . . 73.349999999999994 110.313 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . 0.433 ' HB2' ' CB ' ' A' ' 196' ' ' GLU . 7.5 t -68.21 159.57 30.9 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.527 1.142 . . . . 71.140000000000001 109.941 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -66.67 -48.37 69.55 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.477 1.11 . . . . 74.019999999999996 110.289 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -89.62 29.49 6.23 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.547 1.155 . . . . 65.129999999999995 110.994 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 202' ' ' PHE . . . . . 0.615 ' CD1' ' C ' ' A' ' 202' ' ' PHE . 0.0 OUTLIER -52.33 -47.36 93.01 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.487 0.757 . . . . 73.209999999999994 111.032 179.968 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 203' ' ' PRO . . . . . 0.658 ' HA ' ' CG1' ' A' ' 206' ' ' VAL . 18.2 Cg_endo -75.06 -27.48 9.88 Favored 'Trans proline' 0 C--N 1.36 1.143 0 O-C-N 124.432 1.754 . . . . 74.420000000000002 110.955 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -59.26 -53.9 52.99 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.49 1.118 . . . . 75.409999999999997 110.412 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 205' ' ' GLN . . . . . 0.407 ' O ' ' C ' ' A' ' 206' ' ' VAL . 13.3 mt-30 -56.02 -64.03 0.99 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.512 1.132 . . . . 70.5 110.274 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 206' ' ' VAL . . . . . 0.693 HG21 ' CD2' ' A' ' 100' ' ' LEU . 3.0 p -39.75 -40.43 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.442 1.089 . . . . 74.200000000000003 109.255 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.83 -63.96 0.96 Allowed 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.521 1.138 . . . . 74.140000000000001 110.227 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -54.68 -64.09 0.95 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.498 1.124 . . . . 72.239999999999995 110.305 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 209' ' ' ILE . . . . . 0.674 HD12 HD23 ' A' ' 195' ' ' LEU . 3.7 mt -42.44 -60.64 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 124.506 1.128 . . . . 71.340000000000003 109.336 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 210' ' ' PHE . . . . . 0.617 ' CD2' HG23 ' A' ' 206' ' ' VAL . 0.4 OUTLIER -101.05 70.09 1.33 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.524 1.14 . . . . 61.409999999999997 110.989 179.981 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.71 143.53 41.06 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.492 1.12 . . . . 74.239999999999995 110.331 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 215' ' ' TYR . 19.1 tt0 -49.03 -55.15 12.89 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.513 1.133 . . . . 74.239999999999995 110.322 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -46.38 -25.19 0.6 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.411 1.069 . . . . 71.409999999999997 109.966 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 8.6 t -94.81 -32.92 4.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.484 1.115 . . . . 70.219999999999999 109.341 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 215' ' ' TYR . . . . . 0.556 ' CE1' ' HG3' ' A' ' 80' ' ' LYS . 29.9 t80 -61.25 -19.65 61.94 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.552 1.158 . . . . 73.439999999999998 110.975 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . 0.423 ' N ' ' HD2' ' A' ' 216' ' ' LYS . 3.7 mmmt -62.5 -66.13 0.59 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.523 1.139 . . . . 62.130000000000003 109.33 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 217' ' ' THR . . . . . 0.84 HG22 HD11 ' A' ' 221' ' ' ILE . 1.9 m -48.93 -64.31 0.84 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.501 1.126 . . . . 70.239999999999995 110.379 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 218' ' ' GLN . . . . . 0.658 ' HA ' HD12 ' A' ' 221' ' ' ILE . 7.8 mp0 -43.02 -63.64 0.77 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.478 1.111 . . . . 70.540000000000006 110.279 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 219' ' ' GLN . . . . . 0.446 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 25.2 tp60 -50.41 -29.92 11.27 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.467 1.104 . . . . 61.210000000000001 110.29 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 220' ' ' THR . . . . . 0.406 ' HB ' ' O ' ' A' ' 217' ' ' THR . 0.9 OUTLIER -79.27 -29.77 42.71 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.531 1.144 . . . . 72.420000000000002 110.417 179.971 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 221' ' ' ILE . . . . . 0.84 HD11 HG22 ' A' ' 217' ' ' THR . 14.1 mt -76.83 -27.66 16.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.593 1.183 . . . . 71.209999999999994 109.301 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 222' ' ' TRP . . . . . 0.753 ' O ' HG22 ' A' ' 225' ' ' THR . 23.0 t90 -77.94 -55.3 5.42 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.564 1.165 . . . . 72.549999999999997 108.002 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -20.91 22.86 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.518 1.136 . . . . 71.400000000000006 109.34 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . . . . . . . . . 81.5 mt-10 -86.58 -46.19 10.36 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.559 1.162 . . . . 70.239999999999995 110.352 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.753 HG22 ' O ' ' A' ' 222' ' ' TRP . 4.3 t -53.42 -19.78 3.91 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.501 1.126 . . . . 73.530000000000001 110.402 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 226' ' ' ARG . . . . . 0.409 ' CG ' ' O ' ' A' ' 222' ' ' TRP . 0.1 OUTLIER -78.13 -31.74 50.0 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.418 1.073 . . . . 64.099999999999994 110.322 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 227' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -66.61 -44.07 83.09 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.481 1.113 . . . . 44.530000000000001 109.273 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 228' ' ' MET . . . . . 0.462 ' O ' ' N ' ' A' ' 232' ' ' GLN . 26.6 mtt -56.48 -72.01 0.08 Allowed 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.552 1.158 . . . . 63.549999999999997 110.968 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 229' ' ' VAL . . . . . 0.455 ' O ' ' C ' ' A' ' 230' ' ' GLN . 5.1 m -40.81 -47.02 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.534 1.146 . . . . 75.310000000000002 109.308 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 230' ' ' GLN . . . . . 0.455 ' C ' ' O ' ' A' ' 229' ' ' VAL . 0.0 OUTLIER -33.97 -72.4 0.05 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.456 1.097 . . . . 72.140000000000001 110.27 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -134.04 51.57 2.12 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.476 1.11 . . . . 63.43 110.281 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 232' ' ' GLN . . . . . 0.462 ' N ' ' O ' ' A' ' 228' ' ' MET . 53.3 mt-30 -155.44 -41.44 0.08 Allowed 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.474 1.109 . . . . 63.509999999999998 110.346 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 233' ' ' PHE . . . . . 0.437 ' C ' ' HA ' ' A' ' 229' ' ' VAL . 0.5 OUTLIER -136.15 53.1 1.95 Allowed 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.539 1.149 . . . . 73.239999999999995 111.052 179.977 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 3.6 tt -50.48 157.39 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.485 1.115 . . . . 74.439999999999998 109.311 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.439 0 O-C-N 124.467 1.104 . . . . 52.119999999999997 109.318 179.992 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.954 0 N-CA-C 110.956 -0.858 . . . . 51.039999999999999 110.956 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.454 ' HG2' ' CB ' ' A' ' 74' ' ' SER . 18.2 Cg_endo -75.0 150.6 38.41 Favored 'Trans proline' 0 C--N 1.361 1.199 0 O-C-N 124.509 1.794 . . . . 73.150000000000006 111.04 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.644 HD13 ' O ' ' A' ' 72' ' ' LEU . 0.3 OUTLIER -67.96 -48.15 66.64 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.441 1.088 . . . . 72.209999999999994 109.305 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -117.45 70.56 0.3 Allowed Glycine 0 CA--C 1.53 1.022 0 O-C-N 124.461 1.1 . . . . 73.099999999999994 111.037 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.454 ' CB ' ' HG2' ' A' ' 71' ' ' PRO . 2.1 p -69.93 169.81 12.48 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.469 0.747 . . . . 75.409999999999997 109.959 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -56.6 121.14 9.03 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.444 1.09 . . . . 75.450000000000003 110.305 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -114.23 132.96 55.94 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.499 1.124 . . . . 71.439999999999998 110.317 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 2.8 p -134.59 151.83 32.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.419 1.074 . . . . 55.329999999999998 109.321 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -89.19 31.09 0.9 Allowed 'General case' 0 C--N 1.324 -0.528 0 O-C-N 124.563 1.164 . . . . 73.200000000000003 111.032 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 24.6 tp -39.73 147.12 0.09 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.488 1.117 . . . . 52.210000000000001 109.28 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.44 ' CD ' ' O ' ' A' ' 107' ' ' LYS . 0.5 OUTLIER -89.82 -62.74 1.4 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.555 1.16 . . . . 75.109999999999999 109.321 179.945 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 1.076 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.9 OUTLIER -165.5 129.94 2.37 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.568 1.168 . . . . 51.539999999999999 110.992 179.953 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.676 ' CG1' HG22 ' A' ' 135' ' ' THR . 11.0 p -85.37 166.9 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.48 1.112 . . . . 75.049999999999997 109.298 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 1.076 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 1.7 mp -128.26 92.76 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.482 1.114 . . . . 65.430000000000007 109.311 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.899 HD11 ' HB3' ' A' ' 128' ' ' ALA . 3.3 mt -70.53 98.93 1.54 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.556 1.16 . . . . 72.340000000000003 109.216 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.631 ' CD2' ' HB3' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -120.32 174.4 6.54 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.448 1.093 . . . . 73.209999999999994 109.639 179.895 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.714 ' HB2' ' CD1' ' A' ' 143' ' ' PHE . . . -111.84 164.22 13.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.473 1.108 . . . . 62.43 109.263 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.442 ' O ' ' CG ' ' A' ' 87' ' ' GLU . 14.4 tt0 -68.27 -8.78 42.36 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.488 1.118 . . . . 65.040000000000006 110.267 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -80.37 -38.45 30.39 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.516 1.135 . . . . 72.510000000000005 109.344 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.564 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -137.7 44.23 2.22 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.482 1.114 . . . . 44.109999999999999 109.349 -179.961 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.596 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.6 OUTLIER -77.62 -30.09 52.15 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.465 1.103 . . . . 75.219999999999999 110.403 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.78 -25.53 61.2 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.555 1.159 . . . . 63.310000000000002 109.291 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.484 ' CG ' ' ND2' ' A' ' 177' ' ' ASN . 0.2 OUTLIER -76.62 -58.4 3.31 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.476 1.11 . . . . 73.040000000000006 110.277 -179.976 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.99 ' HB2' HD21 ' A' ' 138' ' ' LEU . . . -54.88 -19.56 6.87 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.479 1.112 . . . . 43.439999999999998 109.353 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.818 HD22 ' O ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -89.8 -50.07 6.26 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.501 1.125 . . . . 73.299999999999997 109.234 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.695 ' N ' HD13 ' A' ' 94' ' ' LEU . 38.4 tpt85 -46.8 -31.48 3.05 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.53 1.144 . . . . 75.129999999999995 110.326 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.588 HG13 ' N ' ' A' ' 97' ' ' GLN . 10.9 p -83.16 -55.85 6.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.525 1.141 . . . . 75.310000000000002 109.284 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.769 HE21 HG23 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -47.61 -24.08 0.81 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.497 1.123 . . . . 72.200000000000003 110.315 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.402 ' O ' ' HG3' ' A' ' 101' ' ' GLN . 0.9 OUTLIER -75.48 -38.56 59.47 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.464 1.102 . . . . 63.140000000000001 109.345 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.737 ' C ' HD23 ' A' ' 99' ' ' LEU . 0.0 OUTLIER -84.63 -19.3 33.16 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.418 1.074 . . . . 74.510000000000005 109.353 179.951 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.873 HD22 HG11 ' A' ' 206' ' ' VAL . 90.3 mt -79.76 -20.22 46.84 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.465 1.103 . . . . 52.119999999999997 109.243 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.535 ' O ' ' HD3' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -88.98 -11.93 42.92 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.523 1.14 . . . . 73.150000000000006 110.324 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.467 ' O ' ' C ' ' A' ' 103' ' ' ASP . 30.6 t70 -116.2 -57.15 2.24 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.426 1.078 . . . . 74.140000000000001 109.304 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.537 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 51.5 t0 -34.78 -64.78 0.24 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.528 1.142 . . . . 71.329999999999998 109.321 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.534 ' CZ ' ' OD1' ' A' ' 103' ' ' ASP . 4.4 m-85 -104.08 -32.31 9.25 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.508 1.13 . . . . 70.5 110.959 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.482 ' O ' ' N ' ' A' ' 107' ' ' LYS . . . 109.51 27.08 4.85 Favored Glycine 0 CA--C 1.529 0.939 0 O-C-N 124.581 1.175 . . . . 61.350000000000001 110.974 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.521 HG22 ' CE1' ' A' ' 81' ' ' PHE . 28.4 mm -63.98 75.63 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.408 0.711 . . . . 74.109999999999999 109.358 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.535 ' HD3' ' O ' ' A' ' 101' ' ' GLN . 0.3 OUTLIER -129.07 157.14 76.84 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.493 1.121 . . . . 74.319999999999993 109.317 -179.927 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.532 ' HA ' ' HB3' ' A' ' 107' ' ' LYS . 18.4 Cg_endo -75.04 132.0 26.11 Favored 'Cis proline' 0 C--N 1.36 1.166 0 C-N-CA 120.953 -2.52 . . . . 72.150000000000006 110.983 0.02 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.442 ' N ' ' HA ' ' A' ' 107' ' ' LYS . . . -105.17 116.67 5.33 Favored Glycine 0 CA--C 1.53 0.986 0 O-C-N 124.54 1.15 . . . . 75.010000000000005 111.009 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -129.69 148.26 33.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.503 0.766 . . . . 75.349999999999994 109.332 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.769 HG23 HE21 ' A' ' 97' ' ' GLN . 41.8 pt -98.73 -175.76 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.515 1.134 . . . . 62.030000000000001 109.328 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.709 ' HE1' ' HB2' ' A' ' 128' ' ' ALA . 0.6 OUTLIER -82.14 -18.55 42.49 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.526 1.141 . . . . 74.040000000000006 110.93 -179.986 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -94.49 -3.08 50.62 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.559 1.162 . . . . 52.439999999999998 109.352 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -104.65 -26.63 12.24 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.501 1.126 . . . . 55.25 110.317 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 4.8 ttm -48.28 141.14 9.09 Favored Pre-proline 0 C--N 1.326 -0.444 0 O-C-N 124.511 1.132 . . . . 72.129999999999995 110.984 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.94 -66.61 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.191 0 O-C-N 124.562 1.822 . . . . 72.430000000000007 111.071 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 37.2 t-80 -41.61 160.99 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.543 1.152 . . . . 71.510000000000005 109.574 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 82.99 63.41 1.74 Allowed Glycine 0 CA--C 1.531 1.059 0 O-C-N 124.546 1.154 . . . . 63.549999999999997 111.004 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 4.3 tmm_? -60.6 -39.97 90.11 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.536 0.786 . . . . 75.340000000000003 110.302 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -103.29 -66.78 0.92 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.525 1.141 . . . . 75.319999999999993 110.331 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . 0.502 ' CG ' ' N ' ' A' ' 122' ' ' LEU . 3.0 t-80 -171.0 164.38 7.53 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.428 1.08 . . . . 71.030000000000001 109.634 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.676 HD22 ' O ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -148.25 143.14 26.78 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.438 1.086 . . . . 53.020000000000003 109.347 179.984 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 16.4 pm0 -121.96 8.5 9.89 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.505 1.128 . . . . 74.510000000000005 110.26 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 34.4 m-20 -89.38 105.24 17.67 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.519 1.137 . . . . 60.200000000000003 109.287 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.734 HD21 ' ND2' ' A' ' 150' ' ' ASN . 1.6 mm? -58.52 -32.31 68.72 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 124.535 1.147 . . . . 75.340000000000003 109.318 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.478 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 7.6 t70 -54.96 -19.74 7.43 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.537 1.148 . . . . 75.450000000000003 109.271 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.666 ' OD2' HD23 ' A' ' 122' ' ' LEU . 51.2 m-20 -59.25 -70.32 0.16 Allowed 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.517 1.136 . . . . 73.209999999999994 109.308 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.899 ' HB3' HD11 ' A' ' 84' ' ' LEU . . . -74.66 -17.48 60.68 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.534 1.147 . . . . 50.539999999999999 109.304 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.783 HG21 HD11 ' A' ' 157' ' ' LEU . 86.9 t -93.07 30.8 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.456 1.098 . . . . 74.310000000000002 109.302 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.478 ' CB ' ' O ' ' A' ' 126' ' ' ASP . 23.5 t30 -147.47 133.37 19.1 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 124.445 1.091 . . . . 72.409999999999997 109.244 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 71.82 55.51 7.27 Favored Glycine 0 CA--C 1.53 1.005 0 O-C-N 124.474 1.109 . . . . 64.120000000000005 111.018 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.46 173.8 12.68 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.444 0.732 . . . . 45.149999999999999 109.992 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.79 ' HB3' ' CE3' ' A' ' 134' ' ' TRP . . . -101.73 -30.76 11.13 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.487 1.117 . . . . 72.439999999999998 109.287 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.79 ' CE3' ' HB3' ' A' ' 133' ' ' ALA . 2.5 m-90 -158.86 177.15 11.47 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.953 -1.129 . . . . 75.150000000000006 107.953 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.676 HG22 ' CG1' ' A' ' 82' ' ' VAL . 25.3 p -151.45 124.02 8.43 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.479 1.112 . . . . 54.420000000000002 110.435 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 1.01 ' O ' HD23 ' A' ' 137' ' ' LEU . 1.1 mp -84.09 140.66 15.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 O-C-N 124.533 1.146 . . . . 64.409999999999997 109.304 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 1.01 HD23 ' O ' ' A' ' 136' ' ' ILE . 9.0 mt -131.17 100.66 5.28 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.577 1.173 . . . . 71.019999999999996 109.26 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.99 HD21 ' HB2' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -62.67 107.21 0.91 Allowed 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.533 1.145 . . . . 74.230000000000004 109.31 179.985 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.53 HD13 ' HA ' ' A' ' 139' ' ' LEU . 0.5 OUTLIER -68.91 108.63 3.56 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.495 1.122 . . . . 73.329999999999998 109.241 -179.977 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.756 HG23 ' OD1' ' A' ' 178' ' ' ASN . 2.8 m -123.87 162.06 24.06 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.431 1.082 . . . . 70.340000000000003 110.395 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -62.37 -37.81 87.13 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.534 1.146 . . . . 72.140000000000001 110.248 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . 0.445 ' ND2' ' N ' ' A' ' 143' ' ' PHE . 2.3 p-10 -89.67 -52.9 4.77 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.519 1.137 . . . . 73.400000000000006 109.279 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.714 ' CD1' ' HB2' ' A' ' 86' ' ' ALA . 49.7 t80 -49.13 -24.5 1.68 Allowed 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.534 1.147 . . . . 74.430000000000007 111.02 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.646 ' C ' HD13 ' A' ' 144' ' ' LEU . 2.2 tm? -58.16 -68.37 0.26 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.514 1.134 . . . . 61.140000000000001 109.26 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.602 ' N ' HD13 ' A' ' 144' ' ' LEU . 0.6 OUTLIER -57.64 -16.67 11.24 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.46 1.1 . . . . 74.349999999999994 110.298 -179.984 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -75.17 -38.12 60.98 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.485 1.115 . . . . 74.120000000000005 109.324 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.541 ' O ' ' CG ' ' A' ' 151' ' ' PHE . 2.3 p -101.14 -7.61 23.0 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.437 1.086 . . . . 72.310000000000002 110.449 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.425 ' HA ' ' CE3' ' A' ' 148' ' ' TRP . 1.0 OUTLIER -94.68 -25.14 16.85 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.959 -1.126 . . . . 74.150000000000006 107.959 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 42.7 t -88.57 -45.46 9.87 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.502 1.126 . . . . 62.420000000000002 108.253 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.734 ' ND2' HD21 ' A' ' 125' ' ' LEU . 0.1 OUTLIER -61.83 -54.2 45.46 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.441 1.088 . . . . 62.109999999999999 109.316 -179.954 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.541 ' CG ' ' O ' ' A' ' 147' ' ' THR . 4.9 m-30 -53.41 -52.88 57.95 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.507 1.129 . . . . 64.5 110.95 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -39.39 -48.69 1.95 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.518 1.137 . . . . 62.219999999999999 110.334 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -81.33 -28.23 34.62 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.372 1.045 . . . . 70.030000000000001 111.03 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.431 ' N ' ' O ' ' A' ' 151' ' ' PHE . 4.5 m-85 -113.6 86.57 2.42 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 124.464 1.103 . . . . 73.340000000000003 111.035 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . 0.413 ' O ' ' N ' ' A' ' 158' ' ' MET . 1.1 t -61.25 -14.14 23.85 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.481 1.113 . . . . 72.049999999999997 110.36 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 12.5 t -46.64 -34.56 5.15 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.464 1.103 . . . . 72.040000000000006 109.993 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.783 HD11 HG21 ' A' ' 129' ' ' VAL . 0.4 OUTLIER -88.44 -29.32 20.27 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.403 1.064 . . . . 72.329999999999998 109.267 -179.992 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' MET . . . . . 0.456 ' HA ' ' CE ' ' A' ' 158' ' ' MET . 23.1 mmt -62.07 -24.25 66.99 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.491 1.12 . . . . 75.319999999999993 110.984 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' ASN . . . . . 0.45 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 24.8 p30 -92.92 -19.37 21.71 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.466 1.104 . . . . 64.230000000000004 109.289 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.601 ' HB2' HG21 ' A' ' 170' ' ' VAL . 1.4 m -81.29 -34.31 32.07 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.522 1.139 . . . . 72.310000000000002 110.017 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . 0.585 ' O ' HD11 ' A' ' 192' ' ' ILE . 7.6 m -60.65 -17.98 16.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.584 1.177 . . . . 75.340000000000003 109.346 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . 0.429 ' CB ' ' HG3' ' A' ' 164' ' ' GLN . 49.3 m-20 -66.94 -10.37 48.39 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.53 1.144 . . . . 75.430000000000007 109.299 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.477 ' CD ' HG12 ' A' ' 192' ' ' ILE . 21.6 mtp180 65.06 18.67 11.58 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.442 1.089 . . . . 75.150000000000006 110.285 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 159' ' ' ASN . 28.4 mt-30 -45.94 171.82 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.511 1.132 . . . . 74.439999999999998 110.291 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 15.7 p80 -86.14 59.24 5.52 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.467 1.104 . . . . 72.299999999999997 109.579 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.551 ' HG3' ' CD1' ' A' ' 167' ' ' TYR . 0.8 OUTLIER -107.96 144.06 35.77 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.493 1.121 . . . . 71.439999999999998 109.284 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' TYR . . . . . 0.593 ' CE2' ' OD1' ' A' ' 168' ' ' ASN . 16.2 p90 -38.42 -47.59 1.27 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.462 1.101 . . . . 70.319999999999993 110.932 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.593 ' OD1' ' CE2' ' A' ' 167' ' ' TYR . 2.0 p-10 -92.67 132.09 37.2 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.533 1.146 . . . . 74.120000000000005 109.235 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.485 ' HB3' ' CD1' ' A' ' 134' ' ' TRP . 13.9 t -124.04 145.13 49.43 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.45 1.093 . . . . 63.520000000000003 110.003 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.831 ' O ' HD12 ' A' ' 171' ' ' ILE . 4.8 t -106.21 123.72 61.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.518 1.136 . . . . 64.340000000000003 109.292 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.831 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.6 mp -131.37 109.61 14.95 Favored Pre-proline 0 C--N 1.325 -0.474 0 O-C-N 124.452 1.095 . . . . 63.539999999999999 109.309 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.645 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.4 Cg_endo -74.99 110.68 3.16 Favored 'Trans proline' 0 C--N 1.36 1.16 0 O-C-N 124.49 1.784 . . . . 63.329999999999998 111.035 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . 0.683 ' CE ' HD12 ' A' ' 195' ' ' LEU . 4.0 ttt -94.83 156.66 16.27 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 124.455 1.097 . . . . 54.450000000000003 110.973 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . 0.441 ' N ' ' HG2' ' A' ' 173' ' ' MET . 17.0 mmt85 -111.9 118.85 45.72 Favored Pre-proline 0 C--N 1.325 -0.458 0 O-C-N 124.528 1.142 . . . . 71.540000000000006 110.256 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 175' ' ' PRO . . . . . 0.478 ' HG2' ' CB ' ' A' ' 178' ' ' ASN . 18.3 Cg_endo -74.95 152.03 40.5 Favored 'Trans proline' 0 C--N 1.359 1.127 0 O-C-N 124.502 1.791 . . . . 73.319999999999993 110.997 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.609 ' CD1' ' N ' ' A' ' 176' ' ' LEU . 0.1 OUTLIER -85.26 -44.13 13.14 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.536 1.147 . . . . 71.150000000000006 109.353 179.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . 0.484 ' ND2' ' CG ' ' A' ' 92' ' ' GLU . 4.9 p30 -71.14 -28.05 64.0 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.524 1.14 . . . . 54.329999999999998 109.259 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 178' ' ' ASN . . . . . 0.756 ' OD1' HG23 ' A' ' 140' ' ' THR . 1.4 m-80 -110.79 98.58 38.51 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.48 1.113 . . . . 60.140000000000001 109.27 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.97 116.36 4.57 Favored 'Trans proline' 0 C--N 1.36 1.133 0 O-C-N 124.556 1.819 . . . . 74.209999999999994 111.012 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.544 HD13 ' HB2' ' A' ' 184' ' ' ARG . 0.5 OUTLIER -127.57 96.45 32.92 Favored Pre-proline 0 C--N 1.325 -0.48 0 O-C-N 124.5 1.125 . . . . 72.109999999999999 109.312 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.97 171.67 17.87 Favored 'Trans proline' 0 C--N 1.36 1.162 0 O-C-N 124.509 1.794 . . . . 73.109999999999999 111.031 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 -60.04 -23.69 63.94 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.48 1.113 . . . . 71.230000000000004 110.346 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -68.85 -15.49 63.51 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.443 1.089 . . . . 72.439999999999998 110.31 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 184' ' ' ARG . . . . . 0.544 ' HB2' HD13 ' A' ' 180' ' ' LEU . 35.0 mmt180 -111.1 -28.45 8.29 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.462 1.101 . . . . 72.209999999999994 110.36 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 185' ' ' THR . . . . . 0.497 HG23 ' HD2' ' A' ' 186' ' ' PRO . 54.1 m -72.86 143.72 84.68 Favored Pre-proline 0 C--N 1.326 -0.456 0 O-C-N 124.407 1.067 . . . . 74.010000000000005 110.413 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . 0.563 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.3 Cg_endo -75.01 148.39 35.18 Favored 'Trans proline' 0 C--N 1.36 1.17 0 O-C-N 124.503 1.791 . . . . 72.040000000000006 110.977 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 187' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -60.85 -12.4 10.83 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.453 1.096 . . . . 74.299999999999997 111.05 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . 0.701 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -88.56 -53.93 4.41 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.474 1.109 . . . . 53.450000000000003 109.391 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.563 HD12 ' CG ' ' A' ' 186' ' ' PRO . 37.1 mt -74.4 -14.91 60.92 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.51 1.131 . . . . 64.430000000000007 109.321 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 190' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -85.66 -11.4 53.91 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.56 1.163 . . . . 75.329999999999998 110.31 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 191' ' ' THR . . . . . . . . . . . . . 21.9 p -113.87 1.47 14.77 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.556 1.16 . . . . 64.109999999999999 110.385 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.701 HD12 ' O ' ' A' ' 188' ' ' ALA . 3.1 mt -99.37 163.74 2.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.465 1.103 . . . . 73.319999999999993 109.299 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 193' ' ' ASN . . . . . 0.49 ' N ' ' CG2' ' A' ' 192' ' ' ILE . 13.5 t-20 -66.65 73.41 0.09 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.539 1.149 . . . . 61.25 109.306 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . 0.645 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -66.69 143.66 56.83 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.592 1.182 . . . . 63.409999999999997 109.293 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 195' ' ' LEU . . . . . 0.683 HD12 ' CE ' ' A' ' 173' ' ' MET . 0.2 OUTLIER -84.66 129.98 34.77 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.529 1.143 . . . . 71.420000000000002 109.266 179.995 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -104.88 117.4 33.95 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.531 1.145 . . . . 71.200000000000003 110.336 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.482 ' HG2' ' CD2' ' A' ' 176' ' ' LEU . 1.3 tt0 -101.82 -33.23 9.89 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.533 1.146 . . . . 72.340000000000003 110.285 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . 0.469 ' HB3' ' CD1' ' A' ' 176' ' ' LEU . 0.0 OUTLIER -90.0 23.04 2.93 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.527 1.142 . . . . 63.539999999999999 110.303 -179.979 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -128.57 147.34 50.7 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.492 1.12 . . . . 73.219999999999999 110.009 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.81 -19.5 65.88 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.459 1.099 . . . . 63.039999999999999 110.264 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -89.13 21.27 28.71 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 124.448 1.093 . . . . 64.5 110.988 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 202' ' ' PHE . . . . . 0.826 ' O ' HG23 ' A' ' 206' ' ' VAL . 5.6 t80 -65.21 -39.32 34.75 Favored Pre-proline 0 C--N 1.325 -0.485 0 O-C-N 124.509 0.77 . . . . 75.439999999999998 110.977 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 203' ' ' PRO . . . . . 0.686 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.3 Cg_endo -75.05 -38.71 1.45 Allowed 'Trans proline' 0 C--N 1.359 1.116 0 O-C-N 124.505 1.792 . . . . 72.530000000000001 110.956 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -50.9 -59.9 3.65 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 124.483 1.114 . . . . 75.200000000000003 110.387 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 205' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -59.02 -47.55 84.8 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.484 1.115 . . . . 73.129999999999995 110.313 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 206' ' ' VAL . . . . . 0.873 HG11 HD22 ' A' ' 100' ' ' LEU . 82.6 t -57.27 -29.69 33.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.463 1.102 . . . . 71.409999999999997 109.257 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.08 -35.75 49.02 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.521 1.138 . . . . 74.420000000000002 110.365 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 64.8 mtt-85 -81.26 -68.23 0.71 Allowed 'General case' 0 C--N 1.327 -0.412 0 O-C-N 124.459 1.1 . . . . 50.200000000000003 110.299 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 209' ' ' ILE . . . . . 0.827 HG22 ' CE1' ' A' ' 210' ' ' PHE . 73.3 mt -41.47 -43.32 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.527 1.142 . . . . 64.439999999999998 109.313 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 210' ' ' PHE . . . . . 0.827 ' CE1' HG22 ' A' ' 209' ' ' ILE . 1.5 m-85 -112.02 66.89 0.64 Allowed 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.538 1.148 . . . . 71.329999999999998 110.962 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -110.65 147.39 34.39 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.537 1.148 . . . . 75.219999999999999 110.286 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.449 ' O ' ' N ' ' A' ' 215' ' ' TYR . 27.9 tt0 -49.14 -55.52 12.07 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.537 1.148 . . . . 72.420000000000002 110.274 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -48.38 -23.93 1.08 Allowed 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.437 1.086 . . . . 61.409999999999997 109.976 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . . . . . . . . . 13.4 t -95.9 -29.31 3.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.449 1.093 . . . . 63.119999999999997 109.28 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 215' ' ' TYR . . . . . 0.449 ' N ' ' O ' ' A' ' 212' ' ' GLU . 17.2 t80 -63.78 -33.89 76.67 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.619 1.199 . . . . 74.129999999999995 111.059 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 51.3 mmtt -57.33 -66.32 0.48 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.548 1.155 . . . . 72.430000000000007 109.253 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 217' ' ' THR . . . . . 1.084 HG22 HD11 ' A' ' 221' ' ' ILE . 17.3 m -45.3 -66.56 0.38 Allowed 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.497 1.123 . . . . 63.009999999999998 110.378 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 218' ' ' GLN . . . . . 0.638 ' HA ' HD12 ' A' ' 221' ' ' ILE . 2.1 mp0 -42.01 -45.7 3.94 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.473 1.108 . . . . 74.329999999999998 110.32 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 219' ' ' GLN . . . . . 0.444 ' NE2' ' O ' ' A' ' 219' ' ' GLN . 18.9 tp60 -62.85 -39.41 94.31 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.504 1.127 . . . . 75.420000000000002 110.315 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 220' ' ' THR . . . . . 0.46 ' O ' ' CG ' ' A' ' 224' ' ' GLU . 1.0 OUTLIER -77.66 -17.71 57.44 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.57 1.169 . . . . 71.129999999999995 110.418 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 221' ' ' ILE . . . . . 1.084 HD11 HG22 ' A' ' 217' ' ' THR . 35.2 mt -83.64 -40.28 15.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.477 1.111 . . . . 61.340000000000003 109.301 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 222' ' ' TRP . . . . . 1.011 ' O ' HG22 ' A' ' 225' ' ' THR . 27.7 t90 -64.11 -54.98 25.35 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.546 1.153 . . . . 75.120000000000005 108.042 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -20.23 52.64 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.485 1.116 . . . . 71.540000000000006 109.318 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . 0.46 ' CG ' ' O ' ' A' ' 220' ' ' THR . 79.6 mt-10 -91.97 -26.41 18.41 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.543 1.152 . . . . 74.310000000000002 110.302 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 1.011 HG22 ' O ' ' A' ' 222' ' ' TRP . 5.9 t -63.25 -21.22 66.1 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.542 1.151 . . . . 70.109999999999999 110.467 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -76.92 -17.06 59.17 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.428 1.08 . . . . 63.32 110.253 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 227' ' ' ASN . . . . . 0.403 ' O ' ' N ' ' A' ' 231' ' ' ARG . 1.0 OUTLIER -86.81 -42.83 12.97 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.456 1.097 . . . . 74.420000000000002 109.295 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 228' ' ' MET . . . . . . . . . . . . . 10.7 mtt -58.16 -40.59 81.78 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.518 1.136 . . . . 64.319999999999993 110.998 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 229' ' ' VAL . . . . . 0.461 HG13 ' N ' ' A' ' 230' ' ' GLN . 11.4 p -67.25 -49.44 72.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.504 1.127 . . . . 74.120000000000005 109.293 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 230' ' ' GLN . . . . . 0.461 ' N ' HG13 ' A' ' 229' ' ' VAL . 2.7 tp60 -74.76 -4.6 38.51 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.473 1.108 . . . . 64.340000000000003 110.29 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 231' ' ' ARG . . . . . 0.403 ' N ' ' O ' ' A' ' 227' ' ' ASN . 16.8 tpp85 -90.99 -81.68 0.31 Allowed 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.472 1.108 . . . . 53.539999999999999 110.302 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -143.22 41.84 1.51 Allowed 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.498 1.124 . . . . 54.140000000000001 110.267 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 233' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -151.25 41.49 0.73 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.46 1.1 . . . . 75.310000000000002 111.022 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 5.1 mm -46.66 142.78 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.47 1.106 . . . . 74.230000000000004 109.295 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.482 0 O-C-N 124.431 1.082 . . . . 53.140000000000001 109.286 179.977 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.958 0 N-CA-C 111.009 -0.837 . . . . 54.420000000000002 111.009 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.03 141.28 26.36 Favored 'Trans proline' 0 C--N 1.361 1.221 0 O-C-N 124.457 1.767 . . . . 73.430000000000007 110.928 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.443 HD22 ' HA ' ' A' ' 72' ' ' LEU . 0.5 OUTLIER -48.7 -72.28 0.05 Allowed 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.535 1.147 . . . . 72.200000000000003 109.278 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -136.35 106.41 0.56 Allowed Glycine 0 CA--C 1.53 0.981 0 O-C-N 124.486 1.116 . . . . 63.340000000000003 111.011 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 87.3 p -134.53 165.62 24.77 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.513 0.772 . . . . 71.230000000000004 110.043 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -72.49 154.04 41.05 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.416 1.073 . . . . 74.209999999999994 110.313 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.18 141.41 39.96 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.514 1.134 . . . . 74.430000000000007 110.312 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.516 ' O ' ' CH2' ' A' ' 222' ' ' TRP . 6.4 p -149.56 157.42 6.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.424 1.078 . . . . 71.329999999999998 109.312 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.413 ' O ' ' C ' ' A' ' 79' ' ' LEU . 26.8 m-85 -87.95 23.5 2.04 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.531 1.144 . . . . 74.25 111.034 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.667 HD11 HG22 ' A' ' 110' ' ' ILE . 12.5 tp -39.63 155.26 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.52 1.137 . . . . 70.510000000000005 109.278 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.756 ' NZ ' ' H ' ' A' ' 107' ' ' LYS . 27.4 ttpt -100.49 -60.61 1.49 Allowed 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.497 1.123 . . . . 64.109999999999999 109.312 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 1.228 ' CZ ' HD11 ' A' ' 83' ' ' ILE . 0.2 OUTLIER -156.99 132.83 9.48 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.487 1.117 . . . . 65.319999999999993 111.038 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.886 ' CG1' HG22 ' A' ' 135' ' ' THR . 7.2 p -96.8 168.47 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.528 1.142 . . . . 55.229999999999997 109.368 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 1.228 HD11 ' CZ ' ' A' ' 81' ' ' PHE . 4.2 mp -130.67 101.32 5.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.529 1.143 . . . . 64.140000000000001 109.326 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.115 HD11 ' HB1' ' A' ' 128' ' ' ALA . 3.7 mp -75.73 124.28 27.01 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 124.504 1.127 . . . . 75.25 109.317 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.824 ' NE2' HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -146.27 174.4 11.37 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.455 1.097 . . . . 72.299999999999997 109.614 -179.99 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.44 ' O ' ' N ' ' A' ' 90' ' ' THR . . . -115.82 164.3 14.59 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.508 1.13 . . . . 71.430000000000007 109.338 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -57.45 -17.28 12.41 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.532 1.145 . . . . 71.530000000000001 110.255 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -78.56 -45.56 21.51 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.536 1.148 . . . . 74.409999999999997 109.31 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.877 ' HB2' HD23 ' A' ' 138' ' ' LEU . 0.9 OUTLIER -121.63 44.14 2.64 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.452 1.095 . . . . 73.420000000000002 109.269 -179.973 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.596 ' HA ' ' CD2' ' A' ' 85' ' ' HIS . 0.8 OUTLIER -77.63 -48.24 17.32 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.493 1.12 . . . . 73.420000000000002 110.371 -179.958 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -67.84 -19.45 65.05 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.471 1.107 . . . . 62.310000000000002 109.332 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.03 -56.93 5.67 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.458 1.099 . . . . 72.430000000000007 110.298 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 1.038 ' HB1' ' CG2' ' A' ' 83' ' ' ILE . . . -68.4 -22.77 64.61 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.527 1.142 . . . . 61.229999999999997 109.268 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.672 HD23 ' O ' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -82.68 -34.06 27.51 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 124.552 1.157 . . . . 71.439999999999998 109.378 179.927 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -67.3 -34.56 77.63 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.466 1.104 . . . . 73.239999999999995 110.274 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.578 HG13 ' N ' ' A' ' 97' ' ' GLN . 8.5 p -81.44 -55.29 8.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.554 1.159 . . . . 75.430000000000007 109.267 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.578 ' N ' HG13 ' A' ' 96' ' ' VAL . 0.0 OUTLIER -49.5 -20.95 0.82 Allowed 'General case' 0 C--N 1.326 -0.419 0 O-C-N 124.476 1.11 . . . . 74.140000000000001 110.35 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.493 ' O ' ' CG ' ' A' ' 101' ' ' GLN . 0.8 OUTLIER -78.94 -36.08 42.24 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.481 1.113 . . . . 70.340000000000003 109.287 -179.93 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.735 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -85.82 -20.0 29.82 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.52 1.137 . . . . 74.450000000000003 109.326 179.965 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.833 HD22 HG11 ' A' ' 206' ' ' VAL . 56.7 mt -78.98 -21.99 46.26 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.509 1.131 . . . . 70.219999999999999 109.323 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.621 ' HB2' ' CG ' ' A' ' 107' ' ' LYS . 0.2 OUTLIER -82.58 -15.15 53.3 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.497 1.123 . . . . 75.319999999999993 110.302 -179.99 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.494 ' O ' ' C ' ' A' ' 103' ' ' ASP . 13.3 t70 -116.09 -58.01 2.15 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.548 1.155 . . . . 60.219999999999999 109.284 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.551 ' CB ' ' O ' ' A' ' 99' ' ' LEU . 28.1 t0 -32.31 -66.81 0.12 Allowed 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.478 1.111 . . . . 63.409999999999997 109.265 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.509 ' HE1' HD23 ' A' ' 100' ' ' LEU . 5.2 m-85 -102.12 -29.66 11.61 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.448 1.093 . . . . 65.010000000000005 110.98 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 107' ' ' LYS . . . 109.59 16.67 10.64 Favored Glycine 0 CA--C 1.531 1.054 0 O-C-N 124.526 1.141 . . . . 4.1200000000000001 110.982 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.667 ' HA ' ' HZ1' ' A' ' 80' ' ' LYS . 36.8 mm -54.45 85.78 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.488 0.757 . . . . 62.340000000000003 109.259 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.756 ' H ' ' NZ ' ' A' ' 80' ' ' LYS . 4.5 mtmp? -138.57 154.91 73.72 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.48 1.113 . . . . 71.099999999999994 109.292 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 107' ' ' LYS . 18.5 Cg_endo -74.99 128.87 17.23 Favored 'Cis proline' 0 C--N 1.36 1.155 0 C-N-CA 121.041 -2.483 . . . . 73.030000000000001 111.034 -0.053 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.507 ' N ' ' HA ' ' A' ' 107' ' ' LYS . . . -105.93 122.91 7.29 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.597 1.186 . . . . 44.329999999999998 111.023 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.667 HG22 HD11 ' A' ' 79' ' ' LEU . 8.0 tt -144.74 157.38 14.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 O-C-N 124.469 0.746 . . . . 75.030000000000001 109.282 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.824 HD12 ' NE2' ' A' ' 85' ' ' HIS . 28.7 pt -93.66 -178.54 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.533 1.145 . . . . 72.109999999999999 109.373 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 1.228 ' CE1' ' HB2' ' A' ' 128' ' ' ALA . 0.9 OUTLIER -82.03 -22.76 36.28 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.458 1.099 . . . . 71.400000000000006 110.993 179.988 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -88.07 -3.36 58.9 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.499 1.124 . . . . 54.43 109.311 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.408 ' C ' HD11 ' A' ' 110' ' ' ILE . 19.8 mm-40 -107.45 -26.03 11.14 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.53 1.144 . . . . 73.140000000000001 110.335 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 3.8 ttm -45.64 138.54 5.22 Favored Pre-proline 0 C--N 1.325 -0.457 0 O-C-N 124.496 1.123 . . . . 64.239999999999995 111.046 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.85 118.75 5.4 Favored 'Trans proline' 0 C--N 1.359 1.116 0 O-C-N 124.515 1.797 . . . . 74.109999999999999 111.046 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 12.2 m-70 -40.41 158.84 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.5 1.125 . . . . 73.230000000000004 109.61 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -166.96 -64.46 0.03 OUTLIER Glycine 0 CA--C 1.529 0.956 0 O-C-N 124.477 1.111 . . . . 74.140000000000001 110.997 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -79.75 178.34 8.24 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.446 0.733 . . . . 73.540000000000006 110.333 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.422 ' CD ' ' N ' ' A' ' 121' ' ' HIS . 0.9 OUTLIER -61.35 -78.42 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.485 1.116 . . . . 62.539999999999999 110.253 -179.926 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . 0.499 ' CG ' ' O ' ' A' ' 121' ' ' HIS . 0.8 OUTLIER -83.18 87.92 6.92 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.495 1.122 . . . . 72.150000000000006 109.551 -179.984 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.71 HD13 ' O ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -56.3 169.69 0.41 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.484 1.115 . . . . 74.140000000000001 109.316 179.939 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.698 ' N ' HD22 ' A' ' 122' ' ' LEU . 31.3 mt-30 57.17 54.71 6.57 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.505 1.128 . . . . 71.530000000000001 110.356 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.403 ' O ' ' C ' ' A' ' 125' ' ' LEU . 13.5 t-20 -108.57 127.57 54.06 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.525 1.141 . . . . 71.030000000000001 109.32 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.581 ' O ' HG23 ' A' ' 129' ' ' VAL . 1.0 OUTLIER -40.03 -57.93 1.54 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.539 1.149 . . . . 74.329999999999998 109.298 179.979 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -42.67 -61.47 1.23 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.515 1.135 . . . . 72.219999999999999 109.32 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.443 ' O ' ' N ' ' A' ' 130' ' ' ASN . 6.5 m-20 -45.89 -63.23 1.02 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.5 1.125 . . . . 55.340000000000003 109.246 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 1.228 ' HB2' ' CE1' ' A' ' 112' ' ' PHE . . . -50.86 -26.79 6.24 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.498 1.124 . . . . 62.219999999999999 109.299 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.706 HG12 ' O ' ' A' ' 129' ' ' VAL . 99.1 t -94.08 30.87 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.525 1.141 . . . . 65.010000000000005 109.253 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.443 ' N ' ' O ' ' A' ' 127' ' ' ASP . 11.2 t-20 -152.55 145.28 24.3 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.547 1.154 . . . . 51.229999999999997 109.306 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 64.99 38.51 95.56 Favored Glycine 0 CA--C 1.53 0.997 0 O-C-N 124.423 1.077 . . . . 64.5 111.05 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 50.7 m -151.36 178.79 8.92 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.549 0.793 . . . . 74.340000000000003 110.02 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 80' ' ' LYS . . . -112.45 -42.09 3.74 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.573 1.171 . . . . 60.25 109.291 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.57 ' CZ2' ' HA ' ' A' ' 210' ' ' PHE . 14.6 m-90 -141.14 160.76 39.4 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.543 1.152 . . . . 65.219999999999999 107.933 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.886 HG22 ' CG1' ' A' ' 82' ' ' VAL . 1.7 p -145.28 125.54 13.84 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.456 1.098 . . . . 74.239999999999995 110.317 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.565 HD13 ' HE2' ' A' ' 81' ' ' PHE . 0.8 OUTLIER -84.42 134.89 25.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 O-C-N 124.488 1.117 . . . . 61.130000000000003 109.28 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.478 HD22 ' O ' ' A' ' 136' ' ' ILE . 2.2 mm? -117.92 96.81 5.52 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.502 1.127 . . . . 72.109999999999999 109.334 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.877 HD23 ' HB2' ' A' ' 89' ' ' ASP . 0.2 OUTLIER -62.64 104.84 0.57 Allowed 'General case' 0 C--N 1.324 -0.519 0 O-C-N 124.498 1.124 . . . . 74.129999999999995 109.274 179.999 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.417 HD21 HD13 ' A' ' 189' ' ' LEU . 18.9 mt -78.22 111.56 14.29 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.54 1.15 . . . . 72.299999999999997 109.33 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.484 ' O ' ' CB ' ' A' ' 144' ' ' LEU . 9.6 m -139.67 159.46 42.11 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 124.505 1.128 . . . . 73.040000000000006 110.444 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -56.08 -36.51 68.19 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.47 1.106 . . . . 64.129999999999995 110.264 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -88.4 -52.04 5.41 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.501 1.126 . . . . 71.549999999999997 109.294 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.6 ' CD1' ' O ' ' A' ' 138' ' ' LEU . 10.9 t80 -57.46 -19.8 26.42 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.521 1.138 . . . . 75.140000000000001 110.983 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.619 HD12 ' NH1' ' A' ' 145' ' ' ARG . 3.0 tm? -84.93 -52.64 5.86 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.582 1.176 . . . . 71.209999999999994 109.333 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.619 ' NH1' HD12 ' A' ' 144' ' ' LEU . 0.0 OUTLIER -55.85 -27.09 49.96 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.436 1.085 . . . . 63.229999999999997 110.32 179.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -79.13 -63.0 1.52 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.494 1.121 . . . . 73.230000000000004 109.279 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.565 HG21 ' CE1' ' A' ' 143' ' ' PHE . 25.5 p -56.9 -61.59 2.34 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.531 1.144 . . . . 72.219999999999999 110.33 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.471 ' HB2' HD22 ' A' ' 144' ' ' LEU . 1.4 t-105 -44.52 -41.95 6.82 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.009 -1.108 . . . . 70.349999999999994 108.009 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . 0.423 ' CB ' ' O ' ' A' ' 145' ' ' ARG . 7.1 t -63.48 -45.55 90.23 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.484 1.115 . . . . 73.450000000000003 108.278 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' A' ' 147' ' ' THR . 0.8 OUTLIER -57.32 -61.68 2.31 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.539 1.149 . . . . 62.439999999999998 109.274 -179.915 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.956 ' CE1' HD12 ' A' ' 157' ' ' LEU . 8.5 m-30 -39.65 -39.24 0.72 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.524 1.14 . . . . 74.5 110.935 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -56.75 -46.77 81.21 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.511 1.132 . . . . 54.539999999999999 110.278 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.491 ' O ' ' CG ' ' A' ' 153' ' ' PHE . 66.8 t80 -99.9 7.55 44.8 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.459 1.1 . . . . 52.210000000000001 111.015 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.449 ' N ' ' O ' ' A' ' 150' ' ' ASN . 0.3 OUTLIER -145.92 81.63 1.6 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.509 1.13 . . . . 73.329999999999998 111.023 179.953 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 3.9 t -72.1 -5.31 34.45 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.407 1.067 . . . . 51.32 110.409 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . 0.438 ' HB3' ' CE1' ' A' ' 154' ' ' TYR . 1.1 t -67.42 -31.56 71.85 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.53 1.143 . . . . 64.439999999999998 110.022 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.956 HD12 ' CE1' ' A' ' 151' ' ' PHE . 3.4 tm? -79.31 -41.82 27.14 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.539 1.149 . . . . 74.299999999999997 109.333 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' MET . . . . . . . . . . . . . 13.8 tpp -51.63 -21.98 3.02 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.526 1.141 . . . . 75.230000000000004 111.05 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' ASN . . . . . 0.444 ' O ' ' NE2' ' A' ' 164' ' ' GLN . 1.9 m-80 -67.18 -37.39 83.63 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.467 1.105 . . . . 74.030000000000001 109.293 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' SER . . . . . 0.784 ' HB2' HG21 ' A' ' 170' ' ' VAL . 0.8 OUTLIER -77.28 -27.56 53.14 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.523 1.139 . . . . 72.430000000000007 109.986 179.975 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . 0.552 HG13 HH21 ' A' ' 163' ' ' ARG . 3.5 t -62.44 -18.1 19.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.56 1.163 . . . . 62.530000000000001 109.364 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -74.42 -4.39 36.29 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 124.552 1.158 . . . . 62.329999999999998 109.296 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.734 ' HE ' HD13 ' A' ' 192' ' ' ILE . 5.2 mmt180 58.51 30.97 20.48 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.494 1.121 . . . . 72.219999999999999 110.208 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . 0.444 ' NE2' ' O ' ' A' ' 159' ' ' ASN . 22.6 mt-30 -52.45 -174.64 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.483 1.114 . . . . 73.340000000000003 110.264 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -110.53 73.13 0.81 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.536 1.147 . . . . 72.400000000000006 109.58 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.409 ' C ' ' N ' ' A' ' 168' ' ' ASN . 0.0 OUTLIER -111.8 163.75 13.83 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.496 1.123 . . . . 72.030000000000001 109.329 -179.993 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' TYR . . . . . 0.574 ' N ' HG21 ' A' ' 221' ' ' ILE . 1.1 p90 -42.62 -25.91 0.1 Allowed 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.467 1.105 . . . . 74.409999999999997 111.033 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' ASN . . . . . 0.527 ' ND2' HG13 ' A' ' 129' ' ' VAL . 1.5 p-10 -119.3 156.17 30.49 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.54 1.15 . . . . 53.32 109.318 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.493 ' HB2' ' CD1' ' A' ' 134' ' ' TRP . 1.2 m -131.54 143.5 50.42 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.577 1.173 . . . . 72.230000000000004 109.97 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 1.0 ' O ' HD12 ' A' ' 171' ' ' ILE . 5.1 t -102.91 131.63 50.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.467 1.104 . . . . 73.239999999999995 109.333 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 1.0 HD12 ' O ' ' A' ' 170' ' ' VAL . 1.2 mp -140.03 111.09 7.25 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.561 1.163 . . . . 72.209999999999994 109.287 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.759 ' O ' ' HB1' ' A' ' 194' ' ' ALA . 18.2 Cg_endo -75.08 106.74 2.33 Favored 'Trans proline' 0 C--N 1.36 1.153 0 O-C-N 124.45 1.763 . . . . 64.310000000000002 110.983 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . 0.539 ' HB3' HG23 ' A' ' 136' ' ' ILE . 3.1 ttt -90.47 151.83 21.21 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 124.467 1.105 . . . . 64.319999999999993 111.048 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . 0.422 ' N ' ' HG2' ' A' ' 173' ' ' MET . 4.7 tpp85 -110.18 122.04 39.92 Favored Pre-proline 0 C--N 1.324 -0.512 0 O-C-N 124.509 1.131 . . . . 73.040000000000006 110.279 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 175' ' ' PRO . . . . . 0.744 ' C ' HD13 ' A' ' 176' ' ' LEU . 18.3 Cg_endo -75.04 160.91 39.47 Favored 'Trans proline' 0 C--N 1.361 1.185 0 O-C-N 124.477 1.777 . . . . 73.340000000000003 110.992 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.975 HD21 ' CG ' ' A' ' 197' ' ' GLU . 0.0 OUTLIER -100.62 -40.55 7.34 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.579 1.175 . . . . 72.430000000000007 109.316 -179.999 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -73.0 -23.6 60.66 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.466 1.104 . . . . 70.439999999999998 109.275 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 178' ' ' ASN . . . . . 0.447 ' ND2' ' OD2' ' A' ' 89' ' ' ASP . 2.1 m-80 -110.41 106.7 58.13 Favored Pre-proline 0 C--N 1.325 -0.467 0 O-C-N 124.534 1.146 . . . . 74.319999999999993 109.273 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.97 115.12 4.19 Favored 'Trans proline' 0 C--N 1.36 1.144 0 O-C-N 124.497 1.788 . . . . 74.409999999999997 111.013 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.49 ' CD1' ' OG1' ' A' ' 185' ' ' THR . 1.1 tm? -126.94 96.97 33.45 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 124.454 1.096 . . . . 75.200000000000003 109.306 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 181' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 165.37 31.42 Favored 'Trans proline' 0 C--N 1.36 1.14 0 O-C-N 124.548 1.815 . . . . 61.409999999999997 110.969 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 3.7 ptt180 -55.8 -39.35 71.18 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.474 1.109 . . . . 72.340000000000003 110.308 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -55.72 -18.22 7.68 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.481 1.113 . . . . 75.150000000000006 110.277 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 184' ' ' ARG . . . . . 0.401 ' HB3' HD21 ' A' ' 180' ' ' LEU . 14.2 mmt180 -104.14 -18.06 14.66 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.488 1.118 . . . . 61.310000000000002 110.218 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 185' ' ' THR . . . . . 0.522 HG23 ' HD2' ' A' ' 186' ' ' PRO . 42.1 m -91.38 143.99 29.04 Favored Pre-proline 0 C--N 1.324 -0.501 0 O-C-N 124.426 1.079 . . . . 75.510000000000005 110.381 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 186' ' ' PRO . . . . . 0.578 ' CG ' HD12 ' A' ' 189' ' ' LEU . 18.4 Cg_endo -75.06 149.0 35.81 Favored 'Trans proline' 0 C--N 1.362 1.239 0 O-C-N 124.453 1.765 . . . . 61.549999999999997 110.993 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 187' ' ' PHE . . . . . 0.415 ' O ' HG23 ' A' ' 191' ' ' THR . 4.8 t80 -62.82 -11.51 18.48 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.492 1.12 . . . . 61.520000000000003 110.994 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . 0.434 ' O ' HD12 ' A' ' 192' ' ' ILE . . . -88.57 -53.98 4.39 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.5 1.125 . . . . 72.109999999999999 109.36 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.578 HD12 ' CG ' ' A' ' 186' ' ' PRO . 40.4 mt -73.04 -18.17 61.36 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.538 1.149 . . . . 73.049999999999997 109.299 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 190' ' ' GLN . . . . . 0.473 ' CG ' ' O ' ' A' ' 190' ' ' GLN . 6.9 tt0 -86.0 -1.07 56.99 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.504 1.127 . . . . 62.119999999999997 110.289 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 191' ' ' THR . . . . . 0.415 HG23 ' O ' ' A' ' 187' ' ' PHE . 41.2 p -128.12 22.66 6.13 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.492 1.12 . . . . 72.439999999999998 110.411 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.734 HD13 ' HE ' ' A' ' 163' ' ' ARG . 4.2 mt -124.58 157.63 32.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.483 1.115 . . . . 63.32 109.296 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -61.79 82.8 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.513 1.133 . . . . 60.119999999999997 109.288 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 194' ' ' ALA . . . . . 0.759 ' HB1' ' O ' ' A' ' 172' ' ' PRO . . . -82.5 152.05 26.22 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.59 1.181 . . . . 71.540000000000006 109.29 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 195' ' ' LEU . . . . . 0.51 HD23 ' CD1' ' A' ' 209' ' ' ILE . 0.2 OUTLIER -83.86 137.66 33.57 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.475 1.109 . . . . 65.010000000000005 109.3 179.979 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -121.47 123.2 41.48 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.514 1.134 . . . . 72.549999999999997 110.274 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.975 ' CG ' HD21 ' A' ' 176' ' ' LEU . 9.5 tp10 -97.27 -29.61 13.45 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.476 1.11 . . . . 71.409999999999997 110.33 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 198' ' ' GLU . . . . . 0.516 ' HG2' HD12 ' A' ' 176' ' ' LEU . 4.4 pt-20 -95.19 23.08 6.04 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 124.436 1.085 . . . . 73.219999999999999 110.305 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 2.0 t -122.91 134.37 54.36 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.581 1.176 . . . . 75.519999999999996 110.017 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 200' ' ' ARG . . . . . . . . . . . . . 20.4 ttt180 -54.88 -18.56 5.06 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.497 1.123 . . . . 74.230000000000004 110.355 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -91.42 18.77 50.92 Favored Glycine 0 CA--C 1.529 0.964 0 O-C-N 124.504 1.128 . . . . 71.040000000000006 111.01 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 202' ' ' PHE . . . . . 0.803 ' O ' HG23 ' A' ' 206' ' ' VAL . 7.3 t80 -65.67 -39.43 32.13 Favored Pre-proline 0 C--N 1.325 -0.493 0 O-C-N 124.429 0.723 . . . . 64.209999999999994 110.989 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 203' ' ' PRO . . . . . 0.685 ' CD ' ' N ' ' A' ' 202' ' ' PHE . 18.4 Cg_endo -74.98 -38.67 1.5 Allowed 'Trans proline' 0 C--N 1.361 1.209 0 O-C-N 124.509 1.794 . . . . 74.120000000000005 111.012 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 204' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -51.61 -62.66 1.49 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.511 1.132 . . . . 74.239999999999995 110.415 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 205' ' ' GLN . . . . . 0.454 ' O ' ' N ' ' A' ' 208' ' ' ARG . 7.2 mt-30 -55.63 -58.02 9.54 Favored 'General case' 0 C--N 1.323 -0.549 0 O-C-N 124.476 1.11 . . . . 54.5 110.298 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 206' ' ' VAL . . . . . 0.833 HG11 HD22 ' A' ' 100' ' ' LEU . 72.2 t -42.69 -31.2 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.44 1.088 . . . . 71.049999999999997 109.318 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 207' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -83.03 -41.32 18.8 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.491 1.119 . . . . 71.219999999999999 110.323 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . 0.454 ' N ' ' O ' ' A' ' 205' ' ' GLN . 51.1 mtt180 -71.43 -63.23 1.16 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.45 1.094 . . . . 73.109999999999999 110.269 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 209' ' ' ILE . . . . . 0.631 HG22 ' CD1' ' A' ' 210' ' ' PHE . 39.6 mt -48.33 -50.14 12.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.456 1.098 . . . . 75.049999999999997 109.287 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 210' ' ' PHE . . . . . 0.631 ' CD1' HG22 ' A' ' 209' ' ' ILE . 0.5 OUTLIER -102.77 65.06 0.89 Allowed 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.515 1.134 . . . . 75.120000000000005 111.004 -179.977 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 211' ' ' GLN . . . . . 0.552 ' HG2' HG23 ' A' ' 214' ' ' VAL . 0.5 OUTLIER -110.9 144.8 39.39 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 124.519 1.137 . . . . 61.329999999999998 110.286 -179.982 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.448 ' O ' ' N ' ' A' ' 215' ' ' TYR . 21.6 tt0 -48.84 -54.98 12.98 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.542 1.151 . . . . 74.450000000000003 110.286 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 3.4 t -48.34 -25.12 1.44 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.522 1.139 . . . . 72.239999999999995 109.983 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.552 HG23 ' HG2' ' A' ' 211' ' ' GLN . 43.2 t -96.28 -27.07 4.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.52 1.137 . . . . 72.040000000000006 109.298 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 215' ' ' TYR . . . . . 0.448 ' N ' ' O ' ' A' ' 212' ' ' GLU . 13.5 t80 -67.42 -36.62 81.61 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.484 1.115 . . . . 72.5 110.94 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 14.9 mmtt -52.03 -50.71 60.9 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.498 1.124 . . . . 62.200000000000003 109.321 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 217' ' ' THR . . . . . 0.738 HG22 HD11 ' A' ' 221' ' ' ILE . 18.8 m -58.17 -65.24 0.68 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.484 1.115 . . . . 73.209999999999994 110.407 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 218' ' ' GLN . . . . . 0.513 ' HA ' HD12 ' A' ' 221' ' ' ILE . 0.0 OUTLIER -54.12 -22.17 10.4 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.5 1.125 . . . . 73.120000000000005 110.316 179.975 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 219' ' ' GLN . . . . . 0.42 ' N ' ' O ' ' A' ' 215' ' ' TYR . 47.6 tp60 -84.35 -30.17 25.68 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.482 1.114 . . . . 72.239999999999995 110.236 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 220' ' ' THR . . . . . 0.491 ' O ' ' CG ' ' A' ' 224' ' ' GLU . 1.0 OUTLIER -86.64 -22.64 26.05 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 124.536 1.147 . . . . 73.450000000000003 110.379 -179.981 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 221' ' ' ILE . . . . . 0.738 HD11 HG22 ' A' ' 217' ' ' THR . 42.6 mt -74.22 -53.97 15.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 O-C-N 124.424 1.077 . . . . 74.340000000000003 109.303 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 222' ' ' TRP . . . . . 0.787 ' O ' HG22 ' A' ' 225' ' ' THR . 14.4 t90 -63.26 -52.03 63.73 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.937 -1.134 . . . . 73.329999999999998 107.937 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 223' ' ' LYS . . . . . 0.42 ' HB2' ' NE2' ' A' ' 219' ' ' GLN . 0.0 OUTLIER -54.98 -20.93 10.23 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.553 1.158 . . . . 74.340000000000003 109.335 -179.982 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 224' ' ' GLU . . . . . 0.491 ' CG ' ' O ' ' A' ' 220' ' ' THR . 8.2 mm-40 -93.26 -29.14 15.83 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.49 1.119 . . . . 73.010000000000005 110.267 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.787 HG22 ' O ' ' A' ' 222' ' ' TRP . 2.4 t -63.06 -27.54 69.47 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.474 1.109 . . . . 72.239999999999995 110.425 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 226' ' ' ARG . . . . . . . . . . . . . 1.2 mtm180 -73.2 -22.24 60.5 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.533 1.146 . . . . 71.519999999999996 110.342 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 227' ' ' ASN . . . . . 0.433 ' O ' ' CD ' ' A' ' 231' ' ' ARG . 0.9 OUTLIER -79.9 -12.95 59.7 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.444 1.09 . . . . 71.530000000000001 109.257 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 228' ' ' MET . . . . . 0.457 ' CE ' ' HA ' ' A' ' 225' ' ' THR . 43.5 mtm -85.83 -41.8 14.7 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.453 1.095 . . . . 73.239999999999995 110.963 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 229' ' ' VAL . . . . . 0.431 HG13 ' H ' ' A' ' 229' ' ' VAL . 1.3 m -61.28 -44.95 99.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.451 1.095 . . . . 70.200000000000003 109.293 -179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 230' ' ' GLN . . . . . 0.425 ' N ' ' CG2' ' A' ' 229' ' ' VAL . 0.0 OUTLIER -72.0 -46.39 57.41 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.501 1.125 . . . . 71.200000000000003 110.327 179.968 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 231' ' ' ARG . . . . . 0.433 ' CD ' ' O ' ' A' ' 227' ' ' ASN . 0.0 OUTLIER -42.4 -85.17 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.486 1.116 . . . . 74.420000000000002 110.362 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -152.14 59.85 0.84 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.502 1.126 . . . . 70.430000000000007 110.28 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 233' ' ' PHE . . . . . 0.498 ' O ' ' CG1' ' A' ' 234' ' ' ILE . 0.5 OUTLIER -155.85 171.62 19.74 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.544 1.152 . . . . 72.209999999999994 110.952 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 234' ' ' ILE . . . . . 0.498 ' CG1' ' O ' ' A' ' 233' ' ' PHE . 9.4 mt -157.21 151.97 7.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.506 1.129 . . . . 44.229999999999997 109.328 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 235' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.521 0 O-C-N 124.458 1.098 . . . . 60.229999999999997 109.35 179.968 . . . . . . . . 0 0 . 1 stop_ save_